data_1yuu_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 1yuu _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 ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 N--CA 1.444 -0.756 0 CA-C-O 119.593 -0.242 . . . . 4.3 110.457 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -71.62 106.99 2.08 Favored 'Trans proline' 0 N--CA 1.453 -0.902 0 C-N-CA 122.829 2.353 . . . . 2.64 110.757 -174.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.5 mt -66.27 162.75 19.43 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.584 1.154 . . . . 2.31 110.089 172.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 t -76.31 170.1 16.98 Favored 'General case' 0 C--O 1.226 -0.135 0 O-C-N 121.554 -0.717 . . . . 2.49 109.89 -178.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -59.56 -50.21 74.79 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.477 0.711 . . . . 2.0 109.635 -174.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.7 mt -62.09 -53.39 56.18 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.55 -1.214 . . . . 2.59 111.696 176.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -47.33 -55.66 8.34 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.163 1.385 . . . . 2.28 110.785 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -49.71 -60.16 3.15 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.435 1.494 . . . . 3.94 109.616 173.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.4 p -57.05 -40.5 76.91 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.403 -0.811 . . . . 2.33 112.239 -175.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.295 2.8 pp -69.59 -42.2 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 O-C-N 121.819 -0.55 . . . . 1.68 110.248 177.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -58.66 -47.65 83.73 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 118.997 0.817 . . . . 3.47 109.804 177.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.9 m -46.03 -45.77 16.18 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.582 1.553 . . . . 2.93 112.745 174.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 32.6 m -79.89 -35.78 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 O-C-N 120.376 -1.453 . . . . 2.17 110.993 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 49.2 t -58.47 -44.23 88.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 118.779 0.718 . . . . 1.73 110.415 176.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.8 t -63.05 -46.53 87.1 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.02 0.827 . . . . 1.69 110.058 177.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 16.2 m -59.33 -49.48 77.65 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.293 0.497 . . . . 1.91 109.774 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -46.73 -52.07 14.77 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 124.146 0.978 . . . . 4.8 110.043 168.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -57.75 -50.18 74.08 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 118.566 0.621 . . . . 4.72 110.21 -174.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -55.79 -58.53 7.46 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 122.14 -0.35 . . . . 3.4 110.798 174.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -62.98 -23.23 67.33 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 112.377 0.51 . . . . 3.94 112.377 -177.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.46 -26.58 38.23 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 120.996 -1.065 . . . . 1.71 110.338 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 71.4 ttp85 -80.43 -25.73 38.8 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.888 0.875 . . . . 5.1 112.317 -177.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -39.06 -60.59 0.85 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.12 1.368 . . . . 3.37 112.974 -178.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -118.84 167.5 11.64 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 127.447 2.299 . . . . 2.37 106.354 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 0.74 108.73 0.01 OUTLIER Glycine 0 CA--C 1.536 1.383 0 C-N-CA 127.021 2.248 . . . . 1.57 115.636 171.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 66.13 103.25 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.928 1.455 . . . . 5.33 114.928 165.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.5 pttt -62.92 64.71 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.816 2.047 . . . . 4.77 110.973 166.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -177.2 -30.08 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.066 2.146 . . . . 3.61 110.599 -158.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 34.1 t -134.83 148.69 50.23 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 121.307 -0.871 . . . . 4.15 111.964 166.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -83.99 120.04 25.64 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 125.501 1.521 . . . . 3.05 107.473 165.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.4 m -84.48 169.6 14.34 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.599 1.56 . . . . 3.31 108.176 166.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.21 -43.64 91.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 O-C-N 120.854 -1.154 . . . . 3.24 112.215 -170.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -64.63 -51.45 62.54 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 108.989 -0.745 . . . . 2.2 108.989 -178.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -37.97 -54.31 1.31 Allowed 'General case' 0 C--O 1.232 0.136 0 C-N-CA 124.965 1.306 . . . . 1.85 112.139 166.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.21 -51.96 67.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 122.009 -0.432 . . . . 4.52 109.849 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt -55.46 -39.55 70.49 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 122.069 -0.394 . . . . 4.76 110.927 -179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -55.42 -40.14 71.1 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.609 0.64 . . . . 2.56 111.851 173.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -62.88 -51.17 68.03 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 119.52 1.055 . . . . 3.65 108.664 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -69.01 -38.75 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 CA-C-N 115.991 -0.55 . . . . 1.94 110.169 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 78.0 m -63.15 -42.76 99.51 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.666 0.786 . . . . 2.21 111.224 175.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -79.84 -53.81 6.42 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 119.283 -0.389 . . . . 2.42 110.308 -168.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -98.0 -127.64 0.16 Allowed 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 109.858 -0.423 . . . . 3.67 109.858 171.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 mm? 29.7 59.56 0.84 Allowed Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 127.268 2.227 . . . . 3.34 114.374 -173.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.31 -42.54 3.77 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 122.488 2.125 . . . . 1.74 111.864 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -122.96 -20.6 5.75 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 113.618 0.97 . . . . 4.11 113.618 -170.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.84 -97.2 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 118.898 0.772 . . . . 2.45 111.212 172.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 75.5 mt -88.74 71.66 8.71 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 120.87 -1.144 . . . . 2.27 109.31 -163.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.5 ttmm -56.06 156.03 5.84 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.155 -0.93 . . . . 6.92 110.845 170.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.0 t0 57.0 66.06 1.25 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 123.496 1.617 . . . . 4.82 109.987 -157.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.4 m -68.19 -3.3 2.36 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 112.851 -1.977 . . . . 2.76 111.616 162.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -75.4 -55.93 4.89 Favored Glycine 0 C--N 1.343 0.948 0 N-CA-C 108.136 -1.986 . . . . 1.88 108.136 176.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.5 t -74.08 52.06 0.43 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.158 1.383 . . . . 2.39 110.61 173.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -72.09 -45.57 60.14 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 125.015 1.326 . . . . 2.22 108.339 170.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.79 -38.14 74.95 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.561 1.144 . . . . 4.72 110.248 -164.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -54.07 -55.06 31.06 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.415 1.086 . . . . 3.16 111.669 167.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -51.36 68.57 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 107.653 -1.24 . . . . 3.6 107.653 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -46.94 -53.74 11.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.441 0.696 . . . . 2.47 110.698 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -59.56 -26.26 65.23 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.91 0.707 . . . . 4.2 112.91 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.2 m -79.76 -48.59 13.35 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.951 0.9 . . . . 3.13 111.466 178.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.4 mp -62.19 -48.82 78.33 Favored 'General case' 0 C--N 1.341 0.209 0 N-CA-C 109.381 -0.6 . . . . 2.74 109.381 177.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -74.33 73.07 1.83 Allowed 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 107.84 -1.17 . . . . 1.9 107.84 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 20.9 m -49.47 -30.34 4.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.484 1.113 . . . . 2.35 113.09 -173.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -87.33 -21.21 25.85 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.837 1.655 . . . . 3.11 112.645 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 55.16 50.88 14.24 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.509 1.124 . . . . 4.7 109.338 -176.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 34.1 p30 -94.09 -18.05 22.2 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.953 1.701 . . . . 1.94 110.612 172.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.9 m 70.4 17.21 6.98 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.371 1.468 . . . . 1.9 113.453 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -107.21 107.75 18.85 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 104.094 -2.558 . . . . 3.79 104.094 155.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.57 96.74 8.17 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 103.455 -2.794 . . . . 2.4 103.455 171.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.59 162.18 16.07 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.909 -1.145 . . . . 6.02 107.909 176.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -39.58 -52.49 2.19 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 123.578 0.751 . . . . 8.12 111.628 176.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -66.81 -27.58 67.67 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 113.496 0.924 . . . . 3.87 113.496 -176.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -79.73 -56.44 4.28 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.628 -1.249 . . . . 2.02 107.628 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -45.5 -50.48 12.74 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.42 1.088 . . . . 4.68 111.209 173.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.595 ' CH2' ' CH2' ' B' ' 77' ' ' TRP . 2.5 t-105 -39.78 -41.1 1.06 Allowed 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.426 1.89 . . . . 5.06 111.77 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 21.7 mmt180 -39.86 -48.12 2.25 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 123.651 0.781 . . . . 5.11 111.599 176.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.2 tp -48.64 -46.18 39.61 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.681 0.793 . . . . 2.04 110.405 -178.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 66.8 mt -63.46 -29.36 47.05 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 107.913 -1.143 . . . . 2.61 107.913 -172.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.488 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -69.98 -45.37 57.34 Favored Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 109.743 -1.343 . . . . 1.57 109.743 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -68.42 -48.19 65.27 Favored 'General case' 0 N--CA 1.437 -1.096 0 N-CA-C 106.667 -1.605 . . . . 2.5 106.667 -175.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.3 mp -42.04 -58.92 1.92 Allowed 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 118.613 0.642 . . . . 3.49 110.945 166.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.99 -19.73 53.96 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 113.133 0.79 . . . . 2.08 113.133 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -80.45 -52.74 7.29 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.757 1.623 . . . . 2.5 109.761 174.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -58.43 -29.15 65.9 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 127.305 2.242 . . . . 2.63 110.962 -171.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.0 tp -40.59 -38.2 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 124.534 1.134 . . . . 2.66 111.766 168.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.23 -43.73 3.05 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.462 1.105 . . . . 6.33 111.371 177.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 49.0 tttp . . . . . 0 C--O 1.223 -0.341 0 C-N-CA 123.765 0.826 . . . . 4.4 110.414 177.828 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.7 mt . . . . . 0 CA--C 1.55 0.952 0 N-CA-C 113.884 1.068 . . . . 2.88 113.884 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 4.2 t -89.05 -163.72 1.03 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.316 1.446 . . . . 2.19 113.464 173.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -65.14 -67.29 0.45 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.98 2.112 . . . . 2.1 113.057 -172.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 16.3 mt -57.16 -41.46 79.25 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 120.622 -1.299 . . . . 2.06 109.976 178.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -49.77 -42.97 47.8 Favored 'General case' 0 CA--C 1.563 1.473 0 C-N-CA 123.794 0.838 . . . . 3.15 112.512 167.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -61.05 -46.98 88.5 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 119.677 -1.889 . . . . 3.88 110.124 172.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 54.1 p -61.23 -36.96 81.36 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.613 -0.68 . . . . 2.57 111.121 -175.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.283 2.9 pp -68.63 -43.05 83.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 O-C-N 121.587 -0.696 . . . . 2.04 110.476 171.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.07 -43.55 82.23 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.263 0.938 . . . . 4.3 110.845 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.38 -28.77 68.89 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.1 0.56 . . . . 2.4 111.735 -174.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 34.3 m -81.35 -36.84 15.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 O-C-N 120.888 -1.132 . . . . 2.03 111.276 168.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 39.5 t -56.89 -43.92 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 118.731 0.696 . . . . 2.37 110.688 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.6 t -59.49 -50.53 73.58 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.59 0.632 . . . . 2.59 110.268 176.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.9 m -53.83 -55.03 30.31 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.395 -0.816 . . . . 2.11 110.351 177.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -42.84 -56.7 3.12 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 123.929 0.891 . . . . 5.76 110.3 171.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -57.01 -52.15 66.42 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.791 0.436 . . . . 4.92 110.996 -177.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 75.7 p -56.64 -32.9 65.79 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.334 0.494 . . . . 3.08 112.334 -177.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -81.1 -47.2 13.84 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 118.844 0.747 . . . . 3.92 111.534 171.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.32 -40.89 68.41 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 120.769 -1.207 . . . . 1.86 109.854 -175.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -17.19 64.57 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 117.234 -1.365 . . . . 5.68 113.097 -175.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -47.75 -60.87 2.26 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.987 1.267 . . . . 2.84 114.262 -168.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -79.54 -35.38 39.98 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 118.65 2.833 . . . . 3.28 118.65 -158.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -81.6 -92.94 0.52 Allowed Glycine 0 C--N 1.34 0.766 1 C-N-CA 131.448 4.356 . . . . 4.58 114.308 7.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.1 mmt-85 49.15 73.12 0.25 Allowed 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.876 -1.157 . . . . 6.47 107.876 -153.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -78.89 49.78 0.95 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.962 1.705 . . . . 4.53 110.949 -175.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -161.03 -48.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 126.73 2.012 . . . . 4.23 107.448 -168.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 29.8 m -116.35 140.21 49.58 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 124.676 1.19 . . . . 3.05 110.956 -174.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 6.3 mp -93.59 120.68 34.17 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.711 1.204 . . . . 3.45 109.249 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 7.1 m -83.38 171.55 13.38 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.399 -0.963 . . . . 3.41 108.399 173.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 7.1 p -85.37 51.5 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 120.098 -1.626 . . . . 3.73 110.507 177.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -158.53 57.25 0.45 Allowed 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 106.124 -1.806 . . . . 2.16 106.124 157.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -176.29 -57.6 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 102.024 -3.324 . . . . 1.58 102.024 -167.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -62.91 -60.73 3.07 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.914 -1.039 . . . . 3.53 110.479 171.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -58.78 -39.17 80.28 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.984 -0.376 . . . . 4.39 109.984 -176.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -54.39 -34.3 60.96 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.862 -0.59 . . . . 2.56 112.428 175.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 30.8 tp -67.44 -45.77 75.05 Favored 'General case' 0 C--N 1.338 0.092 0 CA-C-N 119.754 1.161 . . . . 3.29 109.045 -177.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 5.6 m -68.67 -45.49 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 N-CA-C 110.009 -0.367 . . . . 2.19 110.009 -177.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 97.7 m -55.56 -51.15 68.03 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.431 0.692 . . . . 1.75 111.111 174.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -80.04 -57.49 3.61 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.094 0.558 . . . . 2.13 111.641 -168.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -80.23 -54.21 5.95 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 112.817 0.673 . . . . 4.82 112.817 -158.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . 0.269 1.0 OUTLIER -39.37 -49.57 4.81 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 116.053 1.872 . . . . 3.72 116.053 -136.425 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -84.34 -28.17 1.21 Allowed 'Trans proline' 0 N--CA 1.448 -1.19 0 CA-C-N 120.672 1.276 . . . . 3.23 108.871 -36.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -100.82 -37.4 8.71 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 125.291 1.437 . . . . 3.53 110.047 -171.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 43.9 tp -35.31 -58.95 0.55 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.99 1.716 . . . . 2.19 115.235 -171.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.89 -175.24 3.12 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.408 -0.96 . . . . 3.92 108.408 168.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . 0.42 ' NZ ' ' OE1' ' B' ' 86' ' ' GLU . 0.0 OUTLIER -150.57 169.88 20.47 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 124.97 1.308 . . . . 6.38 108.04 -163.39 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 11.7 t0 58.9 67.1 0.96 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 123.443 1.592 . . . . 4.24 109.11 -171.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 16.1 m -83.54 -12.1 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 112.213 -2.267 . . . . 2.67 109.897 164.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -64.96 -61.86 5.46 Favored Glycine 0 C--N 1.34 0.803 0 N-CA-C 108.884 -1.686 . . . . 2.76 108.884 176.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 35.5 t -78.3 57.28 1.86 Allowed 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.943 -1.132 . . . . 3.29 107.943 173.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -60.93 -44.29 97.43 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 119.67 -1.894 . . . . 2.16 108.116 173.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -65.03 -24.02 67.37 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.256 1.022 . . . . 4.32 112.25 -166.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -50.95 -60.12 3.42 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.647 1.179 . . . . 2.35 109.585 161.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.47 -51.59 68.82 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.106 -1.072 . . . . 4.88 108.106 177.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.42 -60.47 1.93 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.303 0.956 . . . . 2.38 110.618 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -61.66 -36.38 80.65 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 122.377 -0.202 . . . . 4.06 110.935 -175.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 18.5 m -66.24 -32.48 73.92 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.4 0.518 . . . . 2.87 112.4 175.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 22.0 mt -80.65 -43.8 19.86 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.789 1.236 . . . . 2.67 111.158 -177.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -66.45 -7.15 17.63 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 129.905 3.282 . . . . 1.59 116.787 -166.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 17.1 m -36.95 -19.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 128.629 2.771 . . . . 2.49 117.844 -160.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -69.12 -1.3 7.4 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 120.689 1.586 . . . . 5.04 112.043 170.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 82.43 -29.56 0.1 Allowed 'General case' 0 C--N 1.342 0.241 0 C-N-CA 127.613 2.365 . . . . 5.51 113.284 161.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -50.8 109.16 0.29 Allowed 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.421 -0.955 . . . . 3.31 108.421 160.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 41.0 p -66.85 66.93 0.06 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.31 1.844 . . . . 3.13 111.469 -179.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -167.03 120.28 0.98 Allowed 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 128.472 2.709 . . . . 3.0 104.828 -167.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -87.55 97.9 11.1 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 107.514 -1.291 . . . . 2.02 107.514 -175.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 4.0 tttt -80.25 167.74 19.92 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 122.949 0.5 . . . . 4.89 109.691 -165.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -83.15 54.6 2.83 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.536 -0.727 . . . . 6.03 110.065 175.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -167.37 50.73 0.06 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.879 1.271 . . . . 2.23 107.713 111.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -93.21 -60.69 1.73 Allowed 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.286 -2.133 . . . . 1.85 108.34 140.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -41.37 -50.45 3.79 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 126.135 1.774 . . . . 4.09 111.53 -173.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.595 ' CH2' ' CH2' ' A' ' 77' ' ' TRP . 25.8 t-105 -39.02 -45.99 1.3 Allowed 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 125.787 1.635 . . . . 5.95 111.78 178.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 40.9 mtt-85 -39.42 -52.4 2.08 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.374 1.07 . . . . 6.39 111.681 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 11.9 tp -52.17 -42.29 63.3 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.399 0.679 . . . . 2.17 111.384 -177.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 4.1 mp -62.82 -33.47 60.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 N-CA-C 107.063 -1.458 . . . . 4.16 107.063 -175.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.485 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -67.41 -44.03 85.6 Favored Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 110.151 -1.18 . . . . 1.59 110.151 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -68.38 -54.75 15.12 Favored 'General case' 0 N--CA 1.437 -1.077 0 N-CA-C 108.185 -1.043 . . . . 2.34 108.185 -176.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 4.6 pp -57.52 -38.1 74.11 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.608 1.095 . . . . 3.18 111.924 177.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.28 -58.57 7.39 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 118.859 0.754 . . . . 2.31 109.912 173.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -51.79 -39.33 58.46 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.66 1.584 . . . . 2.55 111.802 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . 0.42 ' OE1' ' NZ ' ' B' ' 51' ' ' LYS . 8.6 mm-40 -60.22 -24.15 64.62 Favored 'General case' 0 C--N 1.338 0.072 0 C-N-CA 125.063 1.345 . . . . 3.09 111.431 -176.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 5.0 tt -52.05 -39.45 26.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 118.897 0.771 . . . . 1.99 109.865 171.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 18.4 tpt180 -84.94 -54.46 4.64 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.747 1.219 . . . . 5.83 112.916 169.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 72.9 tttt . . . . . 0 CA--C 1.535 0.376 0 C-N-CA 123.938 0.895 . . . . 5.71 112.397 -159.166 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 . . . . . 0 CA--C 1.538 0.487 0 N-CA-C 108.357 -0.979 . . . . 5.99 108.357 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -71.96 154.98 58.04 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.306 2.004 . . . . 3.06 109.718 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.7 mt -118.06 176.83 5.03 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.856 1.262 . . . . 2.67 109.414 -169.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -74.09 159.03 33.19 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.107 -0.996 . . . . 2.65 110.077 178.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -43.4 -56.52 3.53 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.237 1.015 . . . . 3.05 112.188 -178.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.8 mt -59.16 -47.38 85.53 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.178 -0.915 . . . . 2.41 110.818 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.9 mt-10 -53.08 -50.92 63.42 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.354 1.061 . . . . 2.19 111.569 176.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -54.85 -53.06 60.23 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.488 0.661 . . . . 4.23 110.011 175.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 84.8 p -62.07 -44.03 97.56 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.867 -0.521 . . . . 2.29 111.69 -174.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.8 pp -65.38 -40.6 88.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 117.695 -1.145 . . . . 1.75 110.023 175.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -51.52 -55.84 16.77 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 119.779 1.172 . . . . 2.91 110.033 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.7 t -58.42 -36.82 74.19 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.469 0.544 . . . . 2.06 112.469 -171.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.3 m -77.67 -37.2 23.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 O-C-N 120.629 -1.294 . . . . 1.88 111.148 175.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.5 t -61.09 -43.55 96.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 124.394 1.078 . . . . 1.92 110.18 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -64.87 -49.35 70.86 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.576 0.625 . . . . 1.68 110.339 176.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 39.7 m -53.3 -44.62 68.49 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.307 0.643 . . . . 1.86 110.055 176.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -59.89 -61.97 2.22 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.037 0.935 . . . . 4.6 110.512 175.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -62.52 -41.28 98.75 Favored 'General case' 0 C--O 1.233 0.204 0 O-C-N 121.163 -0.96 . . . . 6.61 111.89 -171.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.1 t -65.6 -22.13 66.65 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 119.365 -0.35 . . . . 2.79 111.247 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -81.35 -43.09 19.55 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 118.415 0.552 . . . . 4.28 111.059 166.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.08 -28.78 62.92 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 126.304 1.842 . . . . 1.71 111.929 -166.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 33.6 ptt85 -66.38 -34.21 77.45 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.365 1.066 . . . . 4.26 112.383 177.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -41.18 -60.09 1.33 Allowed 'General case' 0 C--N 1.345 0.401 0 C-N-CA 124.604 1.162 . . . . 2.12 112.962 -163.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -106.05 75.75 1.12 Allowed 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 104.931 -2.248 . . . . 2.95 104.931 -178.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 60.21 164.16 0.16 Allowed Glycine 0 CA--C 1.533 1.204 0 C-N-CA 125.449 1.499 . . . . 1.87 114.478 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 28.72 100.38 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 128.104 2.562 . . . . 5.47 114.839 165.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.9 pttt -69.38 65.06 0.17 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.317 1.847 . . . . 4.05 112.741 -177.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -169.31 -45.08 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 127.571 2.348 . . . . 3.82 108.066 -175.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.96 110.92 19.24 Favored 'General case' 0 C--O 1.242 0.659 0 C-N-CA 127.548 2.339 . . . . 2.49 110.193 171.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.9 mp -91.3 124.52 35.56 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 118.776 -0.631 . . . . 3.69 109.549 172.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.9 t -100.05 -179.88 4.28 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 122.007 0.908 . . . . 3.11 111.109 172.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.6 m -57.59 -35.97 52.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 CA-C-N 114.958 -1.019 . . . . 4.24 112.923 -167.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -73.18 -50.72 21.0 Favored 'General case' 0 C--O 1.223 -0.316 0 N-CA-C 108.373 -0.973 . . . . 2.91 108.373 -177.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 62.3 mt-10 -46.09 -48.17 17.11 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.138 0.975 . . . . 1.94 110.901 172.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.17 -58.77 7.08 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.897 -0.592 . . . . 4.16 110.138 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 11.0 ttmm -58.0 -37.05 73.55 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 118.243 0.474 . . . . 3.24 111.577 -175.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -53.33 -44.98 68.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.735 0.814 . . . . 3.23 110.547 173.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -65.57 -50.28 65.71 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 119.441 1.019 . . . . 3.23 108.699 -172.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 31.0 m -62.66 -41.31 91.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 114.767 -1.106 . . . . 2.48 108.782 -173.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 96.6 m -62.19 -50.13 73.02 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.102 0.961 . . . . 3.52 111.235 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -62.77 -54.29 41.39 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.219 1.408 . . . . 4.41 111.818 -168.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -149.36 66.86 1.01 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 118.185 0.448 . . . . 4.74 110.336 -177.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.427 ' N ' ' CD ' ' A' ' 47' ' ' PRO . 2.5 tp -155.04 29.13 0.04 OUTLIER Pre-proline 0 CA--C 1.544 0.74 0 N-CA-C 114.049 1.129 . . . . 2.5 114.049 173.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 46' ' ' LEU . 58.8 Cg_endo -64.12 -46.14 8.69 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.943 2.429 . . . . 1.76 112.932 -166.082 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 -79.6 -45.53 18.98 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.47 -0.937 . . . . 6.53 108.47 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.49 ' CD2' ' HB2' ' A' ' 83' ' ' LEU . 3.4 tp -66.36 -44.24 83.74 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.455 -0.793 . . . . 2.08 111.996 -168.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.7 mt -129.16 75.02 1.62 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 119.191 0.905 . . . . 2.59 109.628 165.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.96 157.51 5.67 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.164 -0.926 . . . . 5.95 109.64 165.595 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 42.9 t0 61.21 74.05 0.46 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 123.378 1.561 . . . . 4.77 108.838 -164.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.2 m -76.97 4.38 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 CA-C-N 113.079 -1.873 . . . . 3.41 110.582 163.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.19 -66.89 1.69 Allowed Glycine 0 C--N 1.341 0.83 0 N-CA-C 107.924 -2.07 . . . . 2.08 107.924 179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 29.2 t -76.28 63.36 1.9 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-O 123.227 1.489 . . . . 2.5 110.23 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -77.83 -31.42 51.59 Favored 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 127.978 2.511 . . . . 2.34 108.323 174.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -46.41 -51.16 15.57 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 127.102 2.161 . . . . 4.12 112.206 172.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -55.78 -53.97 50.16 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.436 -0.579 . . . . 2.92 109.436 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.4 -48.75 78.26 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 109.119 -0.697 . . . . 4.05 109.119 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 8.2 ttt -48.89 -53.73 18.33 Favored 'General case' 0 C--O 1.227 -0.099 0 C-N-CA 123.861 0.864 . . . . 2.51 109.976 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -60.19 -45.78 91.97 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 119.798 -0.144 . . . . 4.28 111.003 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 26.6 m -60.67 -41.45 95.1 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.291 0.478 . . . . 2.94 112.291 177.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.8 mt -71.39 -56.17 6.51 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.178 0.991 . . . . 2.9 110.77 -176.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -75.09 82.41 2.28 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.356 0.663 . . . . 2.42 109.83 -170.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.9 m -45.04 -39.92 2.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 124.492 1.117 . . . . 2.36 113.548 -173.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 23.9 p-10 -97.46 -4.32 38.34 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.93 0.715 . . . . 3.14 112.93 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 51.03 50.1 19.81 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.325 1.85 . . . . 3.87 111.243 177.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.9 p30 -82.2 -42.32 19.14 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.468 0.707 . . . . 2.28 110.291 176.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.4 m 99.92 16.56 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 129.652 3.181 . . . . 2.06 112.112 -170.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 70.8 mt-10 -116.23 108.62 16.35 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 105.145 -2.168 . . . . 2.89 105.145 161.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -79.04 87.42 4.83 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 102.312 -3.218 . . . . 2.13 102.312 168.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.36 145.9 50.0 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.841 -1.541 . . . . 4.14 106.841 177.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -37.61 -51.78 1.2 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.775 1.398 . . . . 6.82 114.775 -169.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -73.3 -26.5 61.09 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.519 1.054 . . . . 2.13 112.167 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -63.79 -60.36 3.39 Favored 'General case' 0 C--N 1.341 0.238 0 N-CA-C 108.338 -0.986 . . . . 2.34 108.338 164.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -50.59 -44.41 56.88 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.253 0.621 . . . . 4.46 110.604 -175.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.671 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 41.7 t90 -44.32 -38.22 3.78 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 125.498 1.519 . . . . 5.58 111.887 -178.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 13.2 mmt85 -39.72 -46.6 1.9 Allowed 'General case' 0 C--N 1.341 0.238 0 C-N-CA 124.06 0.944 . . . . 4.9 111.619 173.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 12.7 tp -49.58 -50.59 41.85 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.974 0.909 . . . . 1.65 111.492 178.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.6 mp -64.7 -24.21 35.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 107.616 -1.253 . . . . 2.9 107.616 -176.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.59 ' CA ' ' CZ2' ' B' ' 77' ' ' TRP . . . -69.79 -55.21 9.94 Favored Glycine 0 CA--C 1.49 -1.525 0 C-N-CA 125.334 1.445 . . . . 1.42 111.822 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.69 -47.19 77.21 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 107.389 -1.337 . . . . 2.39 107.389 -177.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.49 ' HB2' ' CD2' ' A' ' 49' ' ' LEU . 4.0 pp -74.09 -39.97 63.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 115.098 1.518 . . . . 3.24 115.098 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.99 -31.95 63.51 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 121.236 -0.915 . . . . 2.15 110.228 170.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -79.7 -42.41 24.74 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 124.809 1.244 . . . . 3.13 111.461 175.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -45.36 -42.15 9.71 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 126.123 1.769 . . . . 2.93 110.626 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.8 tt -46.46 -32.25 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 123.697 0.799 . . . . 2.56 112.638 178.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -121.93 -18.83 6.88 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.925 1.083 . . . . 5.9 113.925 177.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.4 tttp . . . . . 0 CA--C 1.534 0.328 0 CA-C-O 123.177 1.465 . . . . 4.29 109.139 175.835 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.3 mt . . . . . 0 CA--C 1.539 0.542 0 CA-C-O 119.082 -0.485 . . . . 3.69 110.364 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 15.3 t -73.98 -154.35 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.543 0.737 . . . . 2.96 109.924 156.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -84.13 -62.02 1.67 Allowed 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 121.073 -1.017 . . . . 3.1 111.866 -164.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 mt -47.08 -43.8 20.58 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 120.611 1.55 . . . . 2.2 111.715 168.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -53.83 -44.58 70.36 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.541 1.136 . . . . 3.07 111.676 173.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -35.07 63.58 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.026 -1.671 . . . . 3.86 111.705 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 22.9 t -59.14 -47.19 86.19 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.717 0.807 . . . . 2.41 110.551 177.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.263 2.2 pp -58.05 -37.2 60.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 O-C-N 121.124 -0.985 . . . . 2.3 111.522 172.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -58.4 -55.17 38.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.663 0.665 . . . . 2.98 110.137 174.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . 0.251 4.0 t -54.2 -33.27 57.83 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.247 0.931 . . . . 2.12 112.617 -172.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 33.9 m -78.43 -44.35 26.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 119.008 0.822 . . . . 1.88 111.522 173.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 38.2 t -53.23 -46.74 56.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-O 119.025 -0.512 . . . . 2.18 110.491 177.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 15.3 t -62.38 -45.89 91.08 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.15 0.886 . . . . 2.42 111.43 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 20.4 m -54.82 -50.65 68.06 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 120.621 1.555 . . . . 2.19 109.788 174.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -55.21 -51.46 66.5 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.207 0.603 . . . . 8.67 110.513 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -64.06 -48.26 76.93 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 126.505 1.922 . . . . 4.07 111.285 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 30.4 p -57.36 -53.29 59.82 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.412 -0.588 . . . . 2.52 109.412 176.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -56.1 -39.57 72.36 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.782 0.719 . . . . 4.24 111.258 175.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.32 -29.23 63.77 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.266 1.026 . . . . 1.79 110.851 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -53.74 -32.0 50.51 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 118.105 -0.95 . . . . 5.69 111.494 176.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.16 -65.99 0.47 Allowed 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 116.033 1.864 . . . . 2.65 116.033 -143.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 71.7 mt-10 -91.72 -74.87 0.49 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.846 0.831 . . . . 3.7 112.319 -175.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.46 163.73 28.9 Favored Glycine 0 C--N 1.336 0.563 0 C-N-CA 126.898 2.19 . . . . 2.53 111.361 167.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 38.1 ttm180 36.25 102.93 0.0 OUTLIER 'General case' 0 C--O 1.242 0.709 0 C-N-CA 125.675 1.59 . . . . 5.05 115.155 142.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -72.11 34.82 0.06 Allowed 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 115.213 1.56 . . . . 4.09 115.213 -173.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -147.8 -50.82 0.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.458 -0.942 . . . . 4.05 108.458 -167.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 20.2 m -87.43 130.68 34.58 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-N 115.851 -0.613 . . . . 2.43 109.837 173.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -87.11 160.19 18.64 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.488 1.515 . . . . 3.63 109.186 172.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 7.0 m -154.71 169.51 23.75 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.787 0.835 . . . . 2.42 109.699 -167.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.55 120.36 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 101.503 -3.517 . . . . 3.71 101.503 152.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -118.1 98.45 6.32 Favored 'General case' 0 C--N 1.331 -0.198 1 C-N-CA 131.944 4.098 . . . . 2.65 107.309 9.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -155.03 -52.49 0.09 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 113.592 -1.64 . . . . 2.43 106.852 -175.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -59.3 -49.35 78.18 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 114.132 -1.394 . . . . 3.22 108.314 176.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -58.38 -36.83 74.11 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 120.259 -0.576 . . . . 3.72 110.631 -175.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -58.0 -38.83 76.89 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 112.512 0.56 . . . . 2.7 112.512 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 7.7 tp -66.75 -47.79 71.15 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 119.207 0.912 . . . . 3.24 108.849 -178.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 16.2 m -69.59 -39.01 77.82 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.814 -0.63 . . . . 1.81 109.536 -172.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 97.8 m -64.21 -60.1 3.61 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.446 0.698 . . . . 1.9 110.604 174.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -81.83 -57.39 3.45 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.701 0.8 . . . . 2.63 111.939 -166.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -82.47 -40.61 20.89 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.709 1.204 . . . . 3.11 112.74 -167.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 18.4 tp -81.0 -19.16 0.27 Allowed Pre-proline 0 CA--C 1.538 0.499 0 N-CA-C 116.095 1.887 . . . . 2.98 116.095 -167.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -30.67 -63.26 0.1 Allowed 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 124.82 3.68 . . . . 2.28 116.938 -126.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -80.7 -51.26 8.89 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.87 0.759 . . . . 3.11 112.799 -162.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 17.5 tp -18.84 -62.82 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 127.296 2.238 . . . . 1.93 116.329 -175.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 pp -117.71 145.22 44.58 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-O 121.354 0.597 . . . . 3.91 109.438 168.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.22 163.2 18.82 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.558 -0.746 . . . . 6.63 111.054 -173.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 61.1 t0 57.35 66.73 1.09 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 124.606 2.146 . . . . 3.73 110.236 172.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 18.3 m -71.82 8.59 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.892 0 CA-C-N 110.486 -3.052 . . . . 2.84 111.171 157.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -83.59 -55.37 2.87 Favored Glycine 0 C--N 1.343 0.933 0 N-CA-C 108.467 -1.853 . . . . 2.63 108.467 179.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 17.2 t -69.05 59.16 0.1 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.811 2.445 . . . . 3.11 109.83 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -86.16 -29.5 23.2 Favored 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 124.257 1.023 . . . . 2.05 110.348 -172.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -57.75 -46.45 84.47 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.845 0.858 . . . . 3.71 110.281 173.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -51.51 -60.27 3.33 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.174 0.99 . . . . 2.48 109.832 171.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.07 -49.05 74.87 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.846 0.458 . . . . 3.95 109.957 -176.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tpt -49.05 -56.84 7.77 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 126.464 1.906 . . . . 3.96 108.614 178.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -60.83 -39.73 90.12 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 111.624 0.231 . . . . 4.31 111.624 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.6 t -58.35 -39.05 78.49 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.83 0.452 . . . . 2.22 111.322 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 3.5 mp -74.61 -52.89 10.48 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.549 -0.719 . . . . 2.52 111.956 174.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -54.39 -10.9 0.44 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 116.939 2.2 . . . . 1.46 116.939 -163.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 28.1 m -34.27 -22.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 130.591 3.557 . . . . 2.47 118.906 -137.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -57.26 -24.48 55.1 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.669 1.577 . . . . 3.47 111.608 163.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 69.73 56.62 0.33 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.119 1.367 . . . . 4.31 110.871 168.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 47.2 p30 -110.6 -12.29 14.36 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.578 1.551 . . . . 1.79 111.898 177.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 14.2 m 72.96 1.08 3.9 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.41 1.884 . . . . 2.57 114.154 -174.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -105.14 107.15 17.98 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.351 1.46 . . . . 2.98 107.594 169.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -80.86 94.86 6.54 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 107.354 -1.35 . . . . 1.88 107.354 -179.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 7.6 ptmt -83.38 175.11 10.09 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.03 0.532 . . . . 4.08 110.248 -173.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 40.7 p90 -93.76 52.87 1.74 Allowed 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.616 -0.677 . . . . 6.02 111.996 -175.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -155.62 49.54 0.54 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.377 -0.971 . . . . 2.47 108.377 112.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -93.32 -62.09 1.44 Allowed 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 107.475 -1.306 . . . . 2.13 107.475 142.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -46.85 -48.28 21.02 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 126.431 1.893 . . . . 4.67 112.156 -172.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.671 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 7.5 t-105 -40.34 -40.68 1.22 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.754 1.222 . . . . 5.94 111.916 175.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 8.3 mtp-105 -39.54 -46.31 1.72 Allowed 'General case' 0 C--N 1.347 0.462 0 C-N-CA 124.11 0.964 . . . . 6.13 112.681 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.0 tp -54.68 -38.73 67.33 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 118.861 -0.59 . . . . 1.83 110.922 -176.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 68.3 mt -58.66 -38.09 69.45 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 N-CA-C 109.17 -0.678 . . . . 2.46 109.17 -177.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.575 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -74.2 -42.83 34.41 Favored Glycine 0 CA--C 1.488 -1.655 0 N-CA-C 110.715 -0.954 . . . . 1.65 110.715 -174.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -64.38 -63.27 1.18 Allowed 'General case' 0 N--CA 1.427 -1.616 0 N-CA-C 104.722 -2.325 . . . . 2.18 104.722 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 3.4 pp -52.12 -38.97 59.16 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.069 0.849 . . . . 2.87 111.948 -176.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.2 -60.04 3.86 Favored 'General case' 0 C--N 1.341 0.212 0 N-CA-C 112.237 0.458 . . . . 2.13 112.237 171.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.18 -35.15 66.35 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.001 0.819 . . . . 2.65 111.71 -174.112 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -48.62 -34.21 11.24 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 125.719 1.607 . . . . 2.93 110.524 -178.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 11.8 tt -39.94 -48.29 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 123.972 0.909 . . . . 2.14 110.839 174.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 49.3 ttt180 -85.72 -56.76 3.34 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.339 1.455 . . . . 5.4 111.692 168.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 18.2 mttt . . . . . 0 N--CA 1.461 0.11 0 C-N-CA 124.957 1.303 . . . . 8.21 112.859 -157.592 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 . . . . . 0 N--CA 1.442 -0.865 0 N-CA-C 107.625 -1.25 . . . . 6.03 107.625 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -64.02 149.22 90.95 Favored 'Trans proline' 0 N--CA 1.451 -1.002 0 N-CA-C 107.65 -1.711 . . . . 2.71 107.65 172.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.53 -164.19 0.92 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.729 -0.841 . . . . 2.88 108.729 -172.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.3 m -64.93 140.92 58.92 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 120.914 -1.116 . . . . 4.72 109.615 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -39.51 -56.52 1.62 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.159 0.984 . . . . 2.86 112.322 173.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.1 mt -69.62 -38.75 77.36 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.257 -0.902 . . . . 2.87 112.153 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -50.04 -49.45 51.02 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.802 1.241 . . . . 3.17 111.16 170.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -52.25 -52.11 54.48 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.583 0.753 . . . . 4.25 109.077 173.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.9 p -63.19 -42.37 99.33 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.241 -0.436 . . . . 2.47 111.765 -173.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.28 2.6 pp -71.1 -36.15 61.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 O-C-N 121.742 -0.599 . . . . 1.78 110.405 179.079 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -55.46 -56.03 24.9 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.122 0.874 . . . . 2.66 109.678 172.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.2 t -58.57 -28.63 65.71 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 119.712 -0.795 . . . . 2.48 112.75 -170.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.7 m -80.72 -39.56 18.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 O-C-N 121.361 -0.837 . . . . 1.79 111.556 170.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.8 t -54.57 -46.89 72.35 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 119.267 0.939 . . . . 1.69 110.743 175.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.5 t -59.25 -46.88 87.31 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.715 1.143 . . . . 1.91 111.055 176.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.6 m -59.63 -39.3 83.83 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.848 0.859 . . . . 1.87 110.839 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -56.63 -61.13 2.64 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.474 0.71 . . . . 4.93 109.635 168.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -62.09 -45.97 91.16 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.81 0.844 . . . . 4.05 110.801 -164.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -59.79 -33.57 71.89 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.526 -0.306 . . . . 2.98 110.935 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -76.98 -41.57 42.42 Favored 'General case' 0 C--O 1.22 -0.472 0 O-C-N 121.921 -0.487 . . . . 4.02 111.338 173.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.38 -25.76 66.13 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 125.442 1.497 . . . . 1.62 111.604 -169.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -71.21 -25.18 62.39 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 117.079 -1.439 . . . . 4.45 113.329 175.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -44.11 -53.82 6.08 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-N 119.742 1.156 . . . . 2.32 112.355 -167.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -124.26 170.71 10.5 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 106.422 -1.695 . . . . 2.7 106.422 176.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -7.87 119.15 0.01 OUTLIER Glycine 0 CA--C 1.537 1.409 0 C-N-CA 127.47 2.462 . . . . 2.15 115.972 177.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 60.4 105.33 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.397 1.479 . . . . 7.2 114.885 159.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -72.56 60.87 0.49 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.467 1.107 . . . . 4.73 113.471 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -147.65 -48.1 0.17 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 129.02 2.928 . . . . 4.88 105.419 167.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -81.77 117.15 21.84 Favored 'General case' 0 C--O 1.242 0.669 0 C-N-CA 128.141 2.576 . . . . 2.29 111.116 174.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.7 mp -89.27 132.48 34.88 Favored 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 122.661 0.384 . . . . 3.27 110.068 164.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 29.1 t -82.23 174.67 10.95 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.473 1.509 . . . . 3.22 109.313 175.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.6 t -55.07 -46.34 77.33 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 108.893 -0.78 . . . . 3.13 108.893 172.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -54.8 -62.3 1.75 Allowed 'General case' 0 C--N 1.34 0.179 0 C-N-CA 123.056 0.543 . . . . 4.05 109.897 176.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -49.78 -48.4 50.5 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 124.435 1.094 . . . . 1.96 110.857 -177.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -61.59 -55.89 25.87 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 116.197 -0.456 . . . . 3.91 110.567 178.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 40.3 tttt -60.14 -38.18 82.3 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.549 -0.72 . . . . 3.67 111.174 -174.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -54.74 -34.23 62.22 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.813 -0.613 . . . . 2.55 112.087 174.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.81 -55.64 21.51 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 119.751 1.16 . . . . 3.69 108.407 -177.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.9 m -65.94 -38.56 82.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 CA-C-N 115.042 -0.981 . . . . 2.06 109.464 -172.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.8 m -60.84 -52.49 64.84 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 123.627 0.771 . . . . 2.11 110.865 174.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -76.25 -51.2 12.52 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.039 0.536 . . . . 2.8 111.709 -167.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -146.02 78.25 1.52 Allowed 'General case' 0 CA--C 1.523 -0.086 0 C-N-CA 123.006 0.522 . . . . 4.2 110.1 -175.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.4 tp -153.78 48.99 0.45 Allowed Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 113.313 0.857 . . . . 2.65 113.313 159.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -68.02 139.81 48.04 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.793 2.329 . . . . 4.05 111.984 -177.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 76.48 -1.74 2.84 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.241 1.417 . . . . 5.08 113.681 165.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 11.1 tp -100.47 -92.25 0.29 Allowed 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 124.313 1.045 . . . . 1.8 110.565 -175.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 28.6 mt -65.74 -42.06 91.43 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 118.283 0.492 . . . . 3.15 110.864 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt 57.1 -168.59 0.11 Allowed 'General case' 0 C--N 1.344 0.367 0 C-N-CA 123.185 0.594 . . . . 8.0 110.869 -160.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.6 t0 60.39 44.11 12.56 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 124.028 1.871 . . . . 3.94 110.447 175.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.4 m -53.48 -24.32 8.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 112.76 -2.018 . . . . 3.27 110.796 159.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -62.99 -78.31 0.18 Allowed Glycine 0 CA--C 1.528 0.88 0 N-CA-C 110.64 -0.984 . . . . 1.55 110.64 171.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.25 32.34 0.5 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.229 1.012 . . . . 3.78 111.528 -167.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -50.31 -37.55 37.13 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 124.761 1.225 . . . . 2.44 110.022 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.91 -19.74 45.23 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.25 1.82 . . . . 4.33 113.682 -177.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -80.18 -41.23 25.68 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 120.62 1.554 . . . . 3.8 110.351 166.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.66 -47.19 70.6 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 108.515 -0.92 . . . . 3.5 108.515 174.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -43.96 -51.83 7.4 Favored 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 124.688 1.195 . . . . 2.23 110.153 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.5 mttp -69.39 -47.47 64.11 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 110.333 -0.247 . . . . 4.66 110.333 -177.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.5 m -57.29 -31.49 65.68 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.31 0.644 . . . . 3.2 112.476 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.1 mt -75.69 -60.17 2.43 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.155 1.382 . . . . 3.08 109.409 174.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -76.43 75.37 3.18 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 123.685 0.794 . . . . 1.84 110.717 -174.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.2 m -49.55 -34.49 8.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.203 1.001 . . . . 3.35 113.059 -179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -89.86 -32.28 16.96 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.19 0.596 . . . . 3.88 112.127 -178.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 56.85 44.1 23.84 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.296 1.038 . . . . 3.69 111.466 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 23.8 p30 -50.95 -42.1 59.61 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.14 0.976 . . . . 2.13 110.02 155.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.6 t 113.25 18.37 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.635 1 C-N-CA 131.706 4.002 . . . . 2.79 112.277 -174.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -134.24 126.98 30.96 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.802 1.241 . . . . 4.65 109.211 178.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -80.43 77.58 7.2 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 104.218 -2.512 . . . . 2.09 104.218 168.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.1 tppt? -49.93 153.76 1.25 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 128.124 2.569 . . . . 4.75 108.885 173.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -38.95 -59.95 0.91 Allowed 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.352 1.433 . . . . 6.86 112.836 -166.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.08 -40.03 96.45 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.096 0.558 . . . . 2.34 110.853 -177.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -64.06 -41.72 97.26 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.176 0.591 . . . . 2.38 111.278 177.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -68.64 -53.86 19.92 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 118.937 0.79 . . . . 3.99 109.31 176.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.508 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.7 OUTLIER -40.5 -42.19 1.59 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.317 1.047 . . . . 5.62 108.918 176.216 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 11.3 ttt180 -38.69 -52.39 1.67 Allowed 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 117.868 -1.063 . . . . 5.98 111.266 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.4 tp -43.77 -42.47 5.55 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 123.929 0.892 . . . . 1.92 111.085 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 29.5 mt -68.66 -43.61 83.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 C-N-CA 125.81 1.644 . . . . 2.32 108.066 -174.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -59.46 -47.76 89.32 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 110.591 -1.004 . . . . 1.43 110.591 172.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -58.42 -39.94 81.14 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 124.156 0.982 . . . . 2.52 109.898 178.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 13.7 mt -56.76 -48.62 77.44 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 120.069 1.304 . . . . 3.37 110.984 174.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.36 -27.71 64.45 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.222 0.609 . . . . 2.26 111.86 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.2 ttmt -75.58 -60.64 2.22 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.333 0.653 . . . . 2.97 109.744 168.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -48.67 -49.3 38.15 Favored 'General case' 0 C--N 1.334 -0.068 0 C-N-CA 125.861 1.664 . . . . 2.34 111.223 -172.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.9 tt -51.2 -39.78 21.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 C-N-CA 122.577 0.351 . . . . 1.92 111.625 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.43 -31.02 26.83 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.015 1.326 . . . . 5.29 109.965 -177.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 43.4 tttm . . . . . 0 CA--C 1.542 0.662 0 C-N-CA 125.561 1.544 . . . . 5.19 112.138 -168.714 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.7 mt . . . . . 0 CA--C 1.543 0.679 0 CA-C-O 119.396 -0.335 . . . . 3.15 110.762 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 1.7 t -129.43 -79.9 0.56 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.857 1.263 . . . . 2.82 112.381 -174.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -159.5 -71.32 0.08 Allowed 'General case' 0 C--N 1.342 0.263 0 CA-C-N 119.38 0.991 . . . . 2.32 109.256 -176.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.2 mt -50.98 -49.67 59.77 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.522 -0.736 . . . . 2.24 110.106 169.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 22.8 mp0 -50.68 -46.17 58.57 Favored 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 124.636 1.175 . . . . 3.91 111.788 173.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -60.34 -41.18 93.04 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.519 -0.738 . . . . 4.44 110.398 176.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 31.6 p -64.96 -39.3 93.28 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.595 -0.691 . . . . 2.4 111.51 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.322 2.8 pp -69.57 -32.44 52.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 O-C-N 121.524 -0.735 . . . . 1.84 111.41 172.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -58.76 -57.27 13.78 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.466 -0.771 . . . . 2.79 110.339 173.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.4 t -51.52 -39.46 57.71 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.762 0.71 . . . . 1.89 111.731 -171.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 23.2 m -72.68 -37.02 54.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 120.995 -1.066 . . . . 1.92 111.896 176.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 42.1 t -60.57 -45.27 97.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 119.43 1.014 . . . . 1.85 110.786 173.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -66.22 -41.4 90.15 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.98 -1.075 . . . . 1.94 110.783 176.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 61.6 m -59.23 -46.7 87.78 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.151 0.887 . . . . 1.87 110.826 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -48.25 -61.86 1.78 Allowed 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 108.073 -1.084 . . . . 5.05 108.073 169.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -52.95 -52.81 56.71 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.203 1.001 . . . . 4.55 112.238 -172.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 7.1 t -61.55 -29.97 70.35 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 119.075 -0.488 . . . . 3.84 111.826 -174.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -81.69 -40.25 23.09 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 119.358 0.981 . . . . 4.2 111.538 170.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.16 -25.26 65.4 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 126.913 2.085 . . . . 1.91 112.653 -168.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 20.3 ptt180 -58.62 -28.86 66.04 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 117.675 -1.155 . . . . 5.88 112.9 172.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -52.01 -63.83 1.01 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 115.448 1.647 . . . . 2.58 115.448 -155.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -88.93 -76.74 0.4 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.361 0.6 . . . . 3.33 112.384 -166.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.75 165.38 27.03 Favored Glycine 0 C--N 1.337 0.635 0 C-N-CA 127.791 2.615 . . . . 2.79 110.885 158.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 38.94 103.07 0.0 OUTLIER 'General case' 0 C--O 1.238 0.487 0 N-CA-C 115.973 1.842 . . . . 4.57 115.973 139.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 18.3 pttm -54.58 -32.08 57.96 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.948 1.299 . . . . 4.85 114.033 174.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -79.37 -33.43 42.88 Favored 'General case' 0 CA--C 1.531 0.226 0 O-C-N 121.591 -0.693 . . . . 4.05 111.626 -173.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.0 p -100.73 130.23 46.74 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.953 -0.758 . . . . 2.01 108.953 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.26 170.72 4.39 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 122.486 1.136 . . . . 3.09 108.995 161.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 4.7 m -157.24 -173.5 4.46 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 106.259 -1.756 . . . . 3.77 106.259 -154.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.449 ' C ' ' H ' ' B' ' 37' ' ' GLU . 93.3 t -71.77 -111.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 101.397 -3.557 . . . . 4.17 101.397 -175.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -75.07 59.68 0.97 Allowed 'General case' 0 CA--C 1.551 0.998 0 O-C-N 119.597 -1.94 . . . . 2.39 110.074 -176.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . 0.449 ' H ' ' C ' ' B' ' 35' ' ' VAL . 67.4 mt-10 -115.37 -52.05 2.67 Favored 'General case' 0 N--CA 1.452 -0.347 1 C-N-CA 132.574 4.35 . . . . 2.45 107.621 144.505 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -56.31 -50.33 71.76 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.677 -1.231 . . . . 4.1 107.677 173.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 7.8 tttp -56.0 -39.5 71.97 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 121.02 -0.272 . . . . 3.89 110.723 178.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -56.36 -45.06 80.64 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 122.642 0.377 . . . . 2.55 110.745 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 7.2 tt -64.23 -48.83 74.31 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.381 -0.97 . . . . 3.46 108.381 -174.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 6.8 m -67.05 -42.69 88.78 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-N 115.773 -0.649 . . . . 1.73 109.899 -173.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 88.1 m -61.22 -53.33 58.28 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.929 0.892 . . . . 1.76 110.843 175.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -76.76 -61.16 2.06 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 124.036 0.935 . . . . 1.93 110.617 -167.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -82.64 -53.13 6.18 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.72 0.408 . . . . 2.92 110.575 -173.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 5.8 tp -83.47 -18.77 0.26 Allowed Pre-proline 0 CA--C 1.542 0.653 0 N-CA-C 121.281 3.808 . . . . 2.83 121.281 -143.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -46.17 -54.81 4.26 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 CA-C-N 123.108 2.146 . . . . 4.0 116.154 -145.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -79.69 55.85 2.12 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 118.971 0.805 . . . . 3.23 112.055 -175.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 33.2 tp -147.39 -87.1 0.09 Allowed 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 125.898 1.679 . . . . 2.55 107.117 170.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 53.1 mt -73.99 77.46 1.69 Allowed 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 107.29 -1.374 . . . . 2.75 107.29 165.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . 0.455 ' HZ3' ' CB ' ' B' ' 52' ' ' ASP . 0.4 OUTLIER -50.5 151.76 2.15 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.247 -0.888 . . . . 6.37 109.583 174.77 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.455 ' CB ' ' HZ3' ' B' ' 51' ' ' LYS . 61.3 t0 66.7 73.47 0.35 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 123.665 1.697 . . . . 3.59 108.893 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 14.3 m -78.42 6.68 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 CA-C-N 112.172 -2.285 . . . . 2.34 110.284 163.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -74.11 -58.9 4.15 Favored Glycine 0 C--N 1.342 0.904 0 N-CA-C 106.681 -2.568 . . . . 2.72 106.681 172.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 1.7 t -77.34 49.07 0.68 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.706 0.765 . . . . 3.16 110.46 172.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -62.32 -47.47 84.12 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 107.634 -1.247 . . . . 1.68 107.634 167.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -63.25 -30.72 71.81 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.844 0.857 . . . . 4.59 111.221 -165.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -52.98 -59.94 3.91 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.132 0.973 . . . . 2.41 110.113 163.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -58.51 -39.42 80.04 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.436 -0.792 . . . . 5.56 109.982 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -52.49 -55.77 19.74 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 119.066 0.848 . . . . 2.62 109.232 174.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 35.1 mtmt -58.1 -40.9 82.35 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.226 0.921 . . . . 4.16 111.954 176.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 18.0 t -61.35 -25.27 67.04 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.734 -0.604 . . . . 2.96 112.475 173.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 1.2 tp -81.95 -52.07 7.43 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.035 1.734 . . . . 3.71 110.625 176.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -62.16 -13.73 30.17 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 128.662 2.785 . . . . 1.67 115.211 -164.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 30.1 m -35.98 -27.12 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 C-N-CA 130.931 3.693 . . . . 2.46 118.456 -130.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -65.25 -11.52 42.05 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.603 1.092 . . . . 2.88 111.643 166.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 70.15 28.67 3.94 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.712 1.205 . . . . 5.34 112.297 165.099 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 55.4 p30 -91.54 -1.21 57.59 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.783 1.233 . . . . 2.13 112.73 177.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 8.1 t 69.39 1.56 3.35 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 114.524 1.305 . . . . 3.86 114.524 -176.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -103.64 126.77 50.99 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 119.855 1.207 . . . . 3.7 108.412 171.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -98.76 80.85 2.58 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.802 -1.184 . . . . 2.92 107.802 175.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 11.0 ptpp? -83.42 177.75 8.34 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.513 1.125 . . . . 4.7 111.772 -174.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -83.08 56.65 3.57 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.373 -0.829 . . . . 5.27 112.898 -173.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -163.19 49.07 0.15 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.375 -0.972 . . . . 2.51 108.375 109.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -93.78 -62.47 1.35 Allowed 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 124.885 1.274 . . . . 1.76 108.428 150.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -61.1 -32.32 71.99 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.174 -0.921 . . . . 5.8 112.012 -164.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.425 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 5.8 t90 -41.11 -44.64 2.55 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 124.49 1.119 . . . . 5.52 109.541 175.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 60.1 mtp85 -38.92 -41.19 0.73 Allowed 'General case' 0 C--N 1.344 0.36 0 C-N-CA 123.833 0.853 . . . . 4.82 111.509 -178.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 16.7 tp -51.53 -54.5 26.7 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.934 0.788 . . . . 2.17 112.822 176.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.6 mt -70.23 -30.94 45.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 120.144 1.338 . . . . 2.29 108.529 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -41.92 -51.98 4.9 Favored Glycine 0 C--N 1.344 0.999 0 C-N-CA 125.437 1.494 . . . . 1.83 110.184 165.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -75.58 -57.9 3.61 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 112.89 -1.655 . . . . 2.23 109.862 -176.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 10.5 mp -41.69 -59.33 1.68 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 120.62 1.555 . . . . 3.25 112.212 -176.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.71 -28.84 70.16 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-N 115.436 -0.802 . . . . 1.95 111.739 -174.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -71.24 -62.09 1.53 Allowed 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 108.12 -1.067 . . . . 2.69 108.12 172.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -58.27 -39.11 78.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.047 0.939 . . . . 2.73 111.87 -166.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 11.4 tt -47.51 -47.37 10.64 Favored 'Isoleucine or valine' 0 C--N 1.347 0.492 0 CA-C-N 119.603 1.092 . . . . 2.26 112.104 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 5.9 ttp85 -82.27 -48.4 11.26 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 122.313 1.054 . . . . 5.05 110.14 173.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 2.7 tttt . . . . . 0 N--CA 1.45 -0.462 0 C-N-CA 126.846 2.058 . . . . 7.19 109.022 -169.685 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 . . . . . 0 CA--C 1.537 0.462 0 CA-C-O 119.182 -0.437 . . . . 5.51 110.199 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.69 103.4 1.7 Allowed 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.912 2.408 . . . . 3.18 110.467 -177.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 88.5 mt -67.65 164.82 18.4 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.228 0.537 . . . . 2.39 110.833 173.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.8 t -83.18 175.68 9.77 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.658 -0.867 . . . . 2.28 108.658 171.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -69.37 -48.52 60.99 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.567 0.747 . . . . 2.58 109.175 -167.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.5 mp -62.33 -52.46 63.56 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 119.361 -0.352 . . . . 3.56 111.226 178.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -54.42 -50.55 67.34 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.226 1.01 . . . . 2.89 110.248 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -50.99 -55.2 18.52 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.3 1.04 . . . . 3.58 110.606 172.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.9 m -55.24 -49.77 71.17 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.878 -0.514 . . . . 2.66 111.654 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.293 2.9 pp -62.49 -37.12 78.02 Favored 'Isoleucine or valine' 0 C--N 1.339 0.13 0 C-N-CA 119.763 -0.775 . . . . 1.8 110.332 178.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -60.65 -58.08 9.98 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.093 0.86 . . . . 2.63 110.431 175.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.9 t -52.33 -39.86 61.18 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.392 0.996 . . . . 1.99 111.583 -172.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.0 m -73.36 -42.09 57.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 O-C-N 121.107 -0.996 . . . . 2.09 111.271 175.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 28.2 t -55.39 -51.29 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 119.376 0.989 . . . . 1.65 110.853 175.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.6 t -60.27 -48.34 82.15 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.163 0.892 . . . . 1.93 110.448 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 90.6 m -55.29 -51.38 66.85 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-N 118.691 0.678 . . . . 1.96 110.251 178.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -46.88 -58.9 3.47 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 123.658 0.783 . . . . 4.15 109.447 171.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -57.09 -47.07 81.95 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.617 1.167 . . . . 3.85 111.452 -169.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.05 -41.85 65.19 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 119.101 -0.476 . . . . 3.29 111.945 178.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -81.41 -31.18 33.31 Favored 'General case' 0 C--O 1.221 -0.427 0 C-N-CA 123.668 0.787 . . . . 4.74 111.71 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.01 -34.91 72.42 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 120.432 -1.417 . . . . 1.83 109.762 178.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 33.7 ttp180 -69.27 -26.24 64.66 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.12 1.768 . . . . 5.51 113.589 178.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -41.05 -60.82 1.11 Allowed 'General case' 0 C--N 1.344 0.345 0 CA-C-N 120.49 1.495 . . . . 2.19 113.514 -168.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -110.54 169.27 8.86 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 127.009 2.124 . . . . 2.63 106.346 175.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -11.91 121.09 0.01 OUTLIER Glycine 0 CA--C 1.533 1.2 0 C-N-CA 127.264 2.364 . . . . 1.66 115.19 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.27 106.3 0.06 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.932 0.893 . . . . 6.59 113.072 170.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -68.08 55.22 0.07 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.163 1.385 . . . . 4.51 111.769 168.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -158.83 -61.8 0.08 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 126.572 1.949 . . . . 4.14 105.771 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.7 m -82.53 127.24 33.14 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.003 -0.999 . . . . 2.83 109.365 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.8 mp -93.29 132.41 37.51 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.694 0.283 . . . . 3.67 110.537 170.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.5 t -81.5 175.78 10.23 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.276 1.43 . . . . 3.58 108.429 172.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.1 t -64.73 -48.58 84.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 C-N-CA 123.1 0.56 . . . . 2.98 109.642 -175.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -59.5 -56.8 17.45 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 118.932 -0.556 . . . . 2.64 109.537 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -39.23 -52.14 1.96 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 125.098 1.359 . . . . 1.72 112.479 172.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -58.58 -58.2 9.59 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.476 -0.564 . . . . 4.42 109.476 175.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 33.9 tttm -52.98 -39.59 63.14 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 119.216 -0.421 . . . . 4.52 111.823 -175.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 67.9 mt-10 -47.78 -47.56 30.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 118.972 -0.537 . . . . 2.89 111.224 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.3 tp -65.95 -46.76 77.0 Favored 'General case' 0 C--N 1.337 0.063 0 CA-C-N 119.816 1.189 . . . . 3.65 109.266 -171.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.8 m -69.04 -36.29 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-O 121.494 0.664 . . . . 1.91 109.471 -173.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 57.9 m -75.35 -30.34 60.2 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.393 0.677 . . . . 2.06 110.795 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -80.53 -57.42 3.59 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.754 1.222 . . . . 2.36 110.655 -176.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.4 mp0 -97.95 -125.95 0.15 Allowed 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 109.109 -0.701 . . . . 4.11 109.109 177.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.4 mm? 28.96 64.61 0.73 Allowed Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 127.973 2.509 . . . . 3.42 115.62 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -75.54 -50.12 0.13 Allowed 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 121.918 1.745 . . . . 1.72 111.062 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 19.6 t-160 -107.47 -22.77 12.43 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.13 0.972 . . . . 5.22 112.181 -166.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.411 ' CD2' ' HB2' ' A' ' 83' ' ' LEU . 18.1 tp -74.73 -91.08 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.475 1.11 . . . . 2.31 109.733 -167.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.6 mt -82.65 68.08 8.97 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.117 -1.068 . . . . 2.23 108.117 172.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -59.74 156.1 14.62 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.155 -0.475 . . . . 6.36 110.054 170.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 60.1 t0 67.69 84.58 0.15 Allowed 'General case' 0 C--O 1.231 0.089 0 C-N-CA 125.879 1.672 . . . . 4.44 109.055 -155.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 25.2 m -100.09 28.72 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 114.224 -1.353 . . . . 2.97 109.244 166.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -104.57 -59.0 0.68 Allowed Glycine 0 C--N 1.34 0.778 0 C-N-CA 126.419 1.961 . . . . 1.6 108.74 177.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 t -77.28 60.81 2.04 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 123.242 1.496 . . . . 2.71 109.571 175.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -73.88 -25.01 59.81 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 124.782 1.233 . . . . 2.16 109.078 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -52.83 -53.07 53.86 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.953 1.701 . . . . 4.02 111.613 171.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . 0.402 ' OE1' ' NZ ' ' A' ' 59' ' ' LYS . 2.1 tt0 -54.26 -56.74 15.41 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.132 0.973 . . . . 3.39 108.903 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.402 ' NZ ' ' OE1' ' A' ' 58' ' ' GLU . 0.0 OUTLIER -53.43 -45.52 69.48 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.969 -0.56 . . . . 3.53 110.034 179.502 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -57.35 -56.06 26.68 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 123.514 0.725 . . . . 2.26 109.693 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 60.1 mttt -63.05 -33.08 74.67 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 111.665 0.246 . . . . 4.54 111.665 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -62.09 -41.96 98.73 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.132 -0.355 . . . . 2.76 110.781 173.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 21.5 mt -76.54 -56.4 4.65 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.214 1.406 . . . . 2.6 112.773 -174.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -59.34 114.42 2.65 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.04 0.936 . . . . 1.85 108.834 -175.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.2 t -73.76 -30.66 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 N-CA-C 109.169 -0.678 . . . . 4.76 109.169 -173.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -84.19 -40.5 18.06 Favored 'General case' 0 C--O 1.227 -0.109 0 N-CA-C 109.197 -0.668 . . . . 2.75 109.197 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 65.36 64.56 0.6 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.014 1.326 . . . . 4.04 108.032 -158.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -104.11 -125.11 0.21 Allowed 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 105.467 -2.049 . . . . 3.64 105.467 172.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.3 t -137.28 18.22 2.96 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.365 1.066 . . . . 3.42 110.117 170.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 40.0 mp0 -133.12 113.38 12.66 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 125.282 1.433 . . . . 5.02 107.399 -165.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -84.27 87.85 7.21 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 105.461 -2.052 . . . . 2.18 105.461 167.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -54.64 158.96 2.34 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 118.222 -0.894 . . . . 5.58 109.485 176.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -37.25 -53.03 1.07 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.44 1.096 . . . . 6.19 112.011 -176.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -70.23 -40.31 74.56 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.565 0.58 . . . . 3.75 112.565 -178.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -63.07 -34.76 78.28 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.873 0.469 . . . . 2.12 110.576 176.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -75.63 -47.04 28.18 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 119.008 -0.52 . . . . 4.79 109.832 175.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.526 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 2.3 t-105 -43.74 -43.94 6.31 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 108.73 -0.841 . . . . 5.59 108.73 173.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.0 mtp180 -39.71 -51.48 2.33 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-O 117.087 -1.435 . . . . 5.09 109.44 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.7 tp -43.6 -47.64 7.52 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 120.44 1.473 . . . . 1.82 112.198 177.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.5 mp -68.19 -44.11 84.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 125.689 1.595 . . . . 2.77 108.707 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -60.49 -36.97 92.53 Favored Glycine 0 C--N 1.332 0.314 0 CA-C-O 122.121 0.845 . . . . 1.56 113.48 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -75.99 -56.04 5.03 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 104.979 -2.23 . . . . 3.12 104.979 -175.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.411 ' HB2' ' CD2' ' A' ' 49' ' ' LEU 0.282 4.6 pp -57.14 -32.18 66.11 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 121.207 -0.933 . . . . 3.62 113.38 177.027 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.12 -25.09 68.2 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 118.065 -0.969 . . . . 2.21 112.876 175.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . 0.308 0.0 OUTLIER -84.74 -41.4 16.24 Favored 'General case' 0 C--N 1.344 0.346 0 CA-C-N 120.201 1.364 . . . . 3.56 112.507 158.968 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -52.94 -39.39 62.84 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 119.211 0.914 . . . . 2.54 111.336 -171.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.3 tp -26.87 -50.47 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.449 1.1 . . . . 2.81 111.963 166.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -115.24 -42.68 3.15 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.007 0.923 . . . . 5.51 112.981 -176.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 44.6 tttm . . . . . 0 C--O 1.232 0.166 0 O-C-N 119.92 -1.737 . . . . 3.94 109.298 171.811 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.549 0.912 0 N-CA-C 112.188 0.44 . . . . 4.37 112.188 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 5.1 t -79.85 -159.9 0.24 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.403 1.881 . . . . 2.14 113.068 -173.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -75.28 -66.83 0.72 Allowed 'General case' 0 C--O 1.223 -0.29 0 O-C-N 121.957 -0.465 . . . . 2.68 111.786 -172.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.0 mt -48.81 -41.67 33.54 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 120.852 -1.155 . . . . 1.94 110.353 175.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -44.69 -61.51 1.55 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.323 1.849 . . . . 3.52 113.71 164.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.66 -34.94 78.12 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 120.464 -1.397 . . . . 4.29 110.234 -177.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.8 m -64.16 -38.06 89.71 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.204 0.602 . . . . 3.09 111.238 178.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.263 2.9 pp -71.47 -36.51 60.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 O-C-N 121.477 -0.765 . . . . 2.29 111.209 167.562 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -53.11 -57.3 10.9 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 118.857 0.753 . . . . 2.65 110.043 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.1 t -47.24 -44.51 22.77 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.284 0.947 . . . . 1.91 112.699 -176.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.0 m -74.36 -36.22 41.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 O-C-N 120.832 -1.168 . . . . 2.45 110.967 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 56.3 t -61.53 -48.18 89.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 118.828 0.74 . . . . 2.12 110.739 175.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 10.1 t -59.89 -44.91 93.97 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 120.197 1.362 . . . . 2.21 110.532 176.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 56.5 m -55.7 -49.81 72.0 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.422 0.63 . . . . 2.23 110.483 175.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -49.75 -55.64 13.24 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 118.155 -0.926 . . . . 4.94 110.751 170.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -49.61 -57.74 6.58 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 120.125 1.329 . . . . 5.72 111.161 178.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 30.5 p -60.05 -45.75 91.82 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 122.311 -0.243 . . . . 3.01 110.398 -172.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -66.21 -49.38 67.47 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 121.506 0.67 . . . . 4.83 110.488 177.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.02 -30.24 64.03 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 126.011 1.724 . . . . 1.74 110.384 -177.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -58.5 -26.11 63.1 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 117.541 -1.218 . . . . 8.02 111.453 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -45.05 -66.19 0.43 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.87 1.804 . . . . 2.12 115.87 -156.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -90.21 -75.41 0.46 Allowed 'General case' 0 C--N 1.341 0.219 0 C-N-CA 119.604 -0.838 . . . . 3.48 111.694 -168.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.85 165.18 29.28 Favored Glycine 0 C--N 1.337 0.628 0 C-N-CA 126.891 2.186 . . . . 2.5 110.741 156.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 18.4 mmt85 36.33 105.5 0.0 OUTLIER 'General case' 0 C--O 1.242 0.67 0 N-CA-C 116.819 2.155 . . . . 6.38 116.819 136.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -66.09 46.76 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.833 2.053 . . . . 5.08 114.448 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -148.07 -55.98 0.22 Allowed 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 124.872 1.269 . . . . 4.43 108.161 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 2.6 p -81.89 117.55 22.23 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.791 1.636 . . . . 2.38 109.952 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 7.7 mp -96.22 137.59 35.07 Favored 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 108.382 -0.97 . . . . 3.31 108.382 169.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 34' ' ' SER . . . . . 0.444 ' C ' ' H ' ' B' ' 36' ' ' ASN . 0.8 OUTLIER -81.77 -171.5 3.38 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 128.547 2.739 . . . . 3.79 108.055 179.464 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 13.2 p -96.52 42.99 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 CA-C-O 123.454 1.597 . . . . 3.39 108.569 164.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . 0.444 ' H ' ' C ' ' B' ' 34' ' ' SER . 0.6 OUTLIER -161.09 170.55 20.22 Favored 'General case' 0 CA--C 1.544 0.747 1 C-N-CA 141.317 7.847 . . . . 3.68 101.403 169.592 . . . . . . . . 4 4 . 1 . 004 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 58.0 -65.36 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 121.918 2.145 . . . . 2.46 110.156 -153.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -57.62 -50.59 72.64 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.709 -0.849 . . . . 3.44 108.709 177.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -57.32 -48.58 78.6 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.741 -0.208 . . . . 5.44 110.885 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -53.86 -38.48 64.74 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 121.917 -0.49 . . . . 3.61 111.137 174.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 8.8 tt -68.56 -47.04 67.85 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.955 -0.758 . . . . 3.49 108.955 -177.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -65.24 -51.79 60.67 Favored 'Isoleucine or valine' 0 C--N 1.34 0.155 0 CA-C-N 118.379 0.536 . . . . 2.0 110.187 -179.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 63.3 m -53.39 -53.58 49.17 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.878 0.871 . . . . 2.18 111.252 177.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -81.64 -60.44 2.25 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.93 0.492 . . . . 2.31 112.139 -171.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -80.92 -44.19 18.64 Favored 'General case' 0 C--N 1.337 0.039 0 N-CA-C 113.808 1.04 . . . . 3.34 113.808 -159.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -39.89 -57.08 2.83 Favored Pre-proline 0 N--CA 1.467 0.418 0 CA-C-O 117.333 -1.317 . . . . 2.98 112.823 -164.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -87.22 -27.57 5.2 Favored 'Cis proline' 0 N--CA 1.45 -1.04 0 CA-C-N 120.48 1.207 . . . . 2.77 109.506 -25.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 22.2 t-160 -98.72 -44.36 6.44 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.467 1.107 . . . . 3.66 110.327 -166.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 13.0 tp -29.34 -57.8 0.15 Allowed 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.555 1.942 . . . . 1.94 114.652 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 72.0 mt -97.56 116.19 29.29 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 109.398 -0.593 . . . . 2.1 109.398 175.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.21 178.23 8.19 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.108 0.563 . . . . 6.09 109.617 164.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.326 1.0 OUTLIER 62.6 16.26 8.67 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.761 2.025 . . . . 4.31 114.075 176.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 19.3 m -54.76 -20.17 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 C-N-CA 125.812 1.645 . . . . 3.52 113.101 171.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.3 -44.95 21.42 Favored Glycine 0 CA--C 1.532 1.095 0 N-CA-C 110.456 -1.058 . . . . 2.77 110.456 166.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 18.4 m -92.17 40.34 1.04 Allowed 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.821 1.248 . . . . 3.05 110.872 174.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -48.36 -48.67 36.39 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 119.541 1.064 . . . . 2.19 109.809 176.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -45.41 -36.73 4.5 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.188 1.795 . . . . 4.83 112.819 177.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -64.69 -51.39 62.73 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.139 -0.976 . . . . 2.88 110.111 172.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 4.4 mmpt? -54.16 -53.61 51.04 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 107.997 -1.112 . . . . 4.1 107.997 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.03 -42.08 98.78 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.876 -0.583 . . . . 3.03 110.464 -174.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -53.84 -37.17 63.34 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.178 0.899 . . . . 4.28 112.051 171.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 9.2 m -68.86 -44.81 72.6 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 122.708 0.403 . . . . 2.77 111.703 176.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 6.5 mp -69.5 -43.61 72.77 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.23 -0.919 . . . . 2.89 111.816 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.268 16.9 t0 -62.88 -9.0 8.12 Favored 'General case' 0 C--O 1.221 -0.395 0 C-N-CA 127.874 2.469 . . . . 1.46 115.99 -166.103 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.3 m -32.26 -21.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 130.57 3.548 . . . . 2.42 120.139 -131.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -53.94 -33.82 57.89 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 121.191 1.814 . . . . 2.95 110.723 155.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 58.92 55.33 4.59 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.638 0.775 . . . . 5.21 109.658 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 34.2 p30 -81.66 -34.24 30.88 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.331 -0.849 . . . . 2.13 109.056 172.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 24.8 m 109.07 -6.23 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 129.531 3.132 . . . . 2.37 111.879 -175.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -111.85 98.22 7.23 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.852 1.661 . . . . 5.39 106.568 -177.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -76.02 91.19 3.06 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 126.674 1.99 . . . . 1.84 106.843 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 12.3 ptmt -84.25 176.37 8.79 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.873 1.269 . . . . 3.91 110.25 -177.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -83.73 50.24 1.76 Allowed 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.42 1.267 . . . . 5.75 114.42 -176.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -162.13 49.46 0.19 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.206 1.402 . . . . 2.47 107.882 125.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -95.54 -58.85 2.01 Favored 'General case' 0 N--CA 1.44 -0.963 0 O-C-N 119.498 -2.001 . . . . 1.85 108.475 131.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -46.27 -44.53 16.56 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 124.15 0.98 . . . . 4.27 112.967 -173.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.417 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 7.7 t90 -43.2 -46.65 6.13 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 123.636 0.585 . . . . 5.25 110.207 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -41.57 -37.7 1.18 Allowed 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.749 -0.643 . . . . 6.89 111.802 -177.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 11.1 tp -50.34 -55.51 15.26 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 119.186 0.903 . . . . 2.03 111.935 175.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.2 mt -71.29 -30.51 40.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 120.183 1.356 . . . . 2.45 108.353 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -41.77 -49.57 5.05 Favored Glycine 0 C--N 1.344 1.001 0 C-N-CA 125.687 1.613 . . . . 1.91 111.298 166.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -80.51 -59.54 2.65 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 112.538 -1.831 . . . . 2.42 108.676 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 8.4 mp -39.01 -56.48 1.41 Allowed 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 121.374 1.897 . . . . 3.46 113.893 -174.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.35 -30.34 69.48 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 123.146 0.578 . . . . 2.05 111.953 -177.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt -75.84 -46.58 29.66 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 123.971 0.908 . . . . 2.74 109.896 169.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -56.77 -40.86 76.59 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-N 120.372 1.442 . . . . 2.66 111.931 -175.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 5.7 tt -55.52 -32.36 30.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 CA-C-N 118.776 0.717 . . . . 1.99 111.657 174.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 50.2 tpt85 -81.86 -40.53 22.29 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.449 1.1 . . . . 4.59 112.79 175.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 43.4 tttp . . . . . 0 CA--C 1.532 0.259 0 C-N-CA 125.182 1.393 . . . . 4.96 112.866 -157.52 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 . . . . . 0 N--CA 1.448 -0.548 0 N-CA-C 110.064 -0.347 . . . . 4.2 110.064 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.41 101.46 1.36 Allowed 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 122.583 2.189 . . . . 3.1 109.688 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 91.4 mt -60.08 152.17 24.85 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.473 0.654 . . . . 2.51 110.82 175.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.4 t -69.07 151.06 46.91 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.823 0.849 . . . . 2.36 109.249 178.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -39.09 -59.12 1.04 Allowed 'General case' 0 CA--C 1.527 0.084 0 C-N-CA 126.291 1.836 . . . . 3.2 112.147 -172.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 10.3 mt -69.07 -46.05 68.79 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.435 -0.793 . . . . 2.6 111.16 -172.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -54.61 -48.55 72.06 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.996 0.919 . . . . 2.94 110.597 175.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -50.67 -60.8 2.66 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.984 1.314 . . . . 3.85 109.655 171.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 54.5 p -55.92 -42.95 76.86 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.606 0.362 . . . . 2.18 111.478 -173.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.306 2.6 pp -66.34 -41.03 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-O 117.671 -1.157 . . . . 1.83 111.346 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.72 -52.72 64.28 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 120.046 1.294 . . . . 2.52 108.818 172.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -43.23 -43.84 4.97 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.962 1.305 . . . . 3.08 113.72 177.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 35.1 m -81.43 -39.35 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.886 1.221 . . . . 1.83 112.619 173.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.3 t -57.47 -40.8 76.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 C-N-CA 123.816 0.847 . . . . 1.79 110.592 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.7 t -59.6 -50.78 72.55 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.544 0.611 . . . . 1.72 110.882 176.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.2 m -57.25 -50.89 71.45 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.376 -0.828 . . . . 2.18 110.12 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -49.1 -58.57 4.74 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.945 0.898 . . . . 4.24 109.951 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -63.15 -45.86 89.93 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 118.552 -0.737 . . . . 6.25 111.839 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.6 t -60.58 -44.7 95.92 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.506 1.048 . . . . 2.6 110.056 -176.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -61.17 -48.61 80.8 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 121.127 0.489 . . . . 3.91 111.02 172.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.2 -22.12 66.82 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 120.953 -1.092 . . . . 1.82 112.178 -175.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -79.04 -17.18 55.73 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.665 1.986 . . . . 7.46 112.378 174.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -39.74 -55.28 1.96 Allowed 'General case' 0 C--N 1.344 0.335 0 CA-C-N 119.86 1.209 . . . . 3.46 111.255 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -145.64 -165.39 2.18 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 123.94 0.896 . . . . 5.34 109.471 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -18.28 113.58 0.01 OUTLIER Glycine 0 CA--C 1.527 0.806 0 C-N-CA 128.393 2.901 . . . . 2.21 114.37 -166.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? 66.05 106.9 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.48 1.112 . . . . 5.77 112.956 173.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.89 -26.11 65.63 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 113.32 0.859 . . . . 7.84 113.32 176.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -90.56 9.92 27.56 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.577 0.626 . . . . 4.64 111.99 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.6 p -151.35 160.5 43.74 Favored 'General case' 0 C--O 1.24 0.568 0 O-C-N 120.908 -1.12 . . . . 2.54 111.708 174.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mp -118.03 127.97 54.32 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 122.678 0.391 . . . . 4.18 110.918 -172.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.7 t -81.92 172.46 13.27 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.502 -0.925 . . . . 3.17 108.502 174.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 43.1 t -67.28 -48.75 77.1 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 O-C-N 121.492 -0.755 . . . . 4.02 110.36 -168.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -56.99 -52.03 66.87 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 109.473 -0.565 . . . . 3.13 109.473 172.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -48.71 -49.58 37.3 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.349 1.46 . . . . 2.1 110.39 -176.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -59.47 -57.65 12.05 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 124.553 1.141 . . . . 4.18 109.932 172.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.434 ' HZ3' ' CG ' ' A' ' 57' ' ' ASP . 3.0 ttmp? -52.02 -44.72 64.29 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 117.948 0.34 . . . . 5.69 111.78 -174.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -48.58 -37.79 18.93 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.295 0.48 . . . . 2.74 112.295 177.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -64.65 -47.27 79.1 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 108.534 -0.913 . . . . 3.43 108.534 -176.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 28.7 m -71.01 -40.64 76.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 116.287 -0.415 . . . . 2.54 110.126 -175.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.8 m -61.5 -42.01 98.14 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.385 0.674 . . . . 2.82 110.88 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -80.63 -55.6 4.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.122 0.569 . . . . 2.79 111.478 -171.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -92.97 -122.34 0.09 Allowed 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.303 0.501 . . . . 4.54 110.421 177.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.9 mp 12.81 71.53 0.11 Allowed Pre-proline 0 CA--C 1.545 0.754 0 C-N-CA 129.927 3.291 . . . . 3.67 115.502 -174.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.59 -52.22 0.6 Allowed 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 123.055 2.504 . . . . 1.66 113.263 -177.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 -136.0 61.58 1.64 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.78 0.8 . . . . 3.96 110.081 -168.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.404 ' CD2' ' HB2' ' A' ' 83' ' ' LEU . 5.9 tp -143.94 -118.72 0.09 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.876 -1.056 . . . . 2.96 108.477 -164.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 68.2 mt -68.56 77.83 0.28 Allowed 'General case' 0 C--N 1.34 0.164 0 N-CA-C 108.524 -0.917 . . . . 2.9 108.524 163.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -66.65 -168.91 0.07 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.43 -0.805 . . . . 5.95 110.433 172.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 63.93 37.84 9.19 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 124.698 1.199 . . . . 3.55 109.46 178.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -63.02 -22.38 30.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 124.796 1.238 . . . . 3.18 111.742 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -49.82 -35.82 24.98 Favored Glycine 0 CA--C 1.532 1.117 0 N-CA-C 111.235 -0.746 . . . . 2.07 111.235 166.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.8 t -108.06 46.59 0.94 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.118 1.367 . . . . 3.09 109.55 173.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -55.39 -46.5 76.56 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.077 -1.015 . . . . 2.25 109.342 167.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . 0.434 ' CG ' ' HZ3' ' A' ' 39' ' ' LYS . 2.0 m-20 -62.63 -22.82 66.71 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.355 1.062 . . . . 5.3 111.775 -169.397 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -62.34 -48.73 78.52 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 120.801 -1.187 . . . . 3.27 110.437 166.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.23 -37.78 81.37 Favored 'General case' 0 C--O 1.225 -0.232 0 O-C-N 121.441 -0.787 . . . . 4.08 109.406 174.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.0 ttp -53.33 -53.47 50.53 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 118.952 0.797 . . . . 2.91 109.876 173.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -57.21 -41.63 79.81 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 119.207 -0.425 . . . . 4.22 112.021 177.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.8 t -55.79 -57.47 11.89 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 118.908 0.776 . . . . 2.81 110.159 172.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 40.6 mt -58.97 -53.31 59.87 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.435 1.094 . . . . 2.78 110.971 -171.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -68.96 81.05 0.31 Allowed 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 123.66 0.6 . . . . 2.39 109.461 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.8 m -47.27 -33.34 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 C-N-CA 124.252 1.021 . . . . 2.72 111.722 172.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -92.83 -11.5 33.49 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.636 0.976 . . . . 2.9 113.636 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 45.41 59.02 3.79 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.587 1.555 . . . . 4.1 111.208 -176.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -77.73 -98.88 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 106.316 -1.735 . . . . 3.29 106.316 164.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.1 m 178.72 44.27 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 130.949 3.699 . . . . 2.41 106.003 162.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.66 109.34 3.45 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 105.792 -1.929 . . . . 4.01 105.792 -169.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -84.7 94.75 8.73 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 105.443 -2.058 . . . . 1.95 105.443 -176.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.54 151.67 45.87 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 107.858 -1.164 . . . . 3.98 107.858 175.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -39.13 -54.11 1.78 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.593 0.96 . . . . 7.3 113.593 -171.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -73.35 -26.95 61.24 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.553 0.575 . . . . 2.12 112.553 -176.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.32 -59.65 3.82 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 108.08 -1.082 . . . . 2.13 108.08 169.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -49.92 -49.53 49.49 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 124.044 0.937 . . . . 4.57 110.463 -177.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 1.3 t-105 -39.61 -42.41 1.18 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 125.266 1.426 . . . . 5.14 111.393 -178.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 -49.13 -38.98 26.87 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-O 117.994 -1.003 . . . . 4.55 112.102 -178.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 tp -46.43 -48.12 18.87 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 119.088 0.858 . . . . 2.19 110.763 178.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.6 mp -60.78 -34.44 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 108.0 -1.111 . . . . 2.88 108.0 -177.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.541 ' CA ' ' CZ2' ' B' ' 77' ' ' TRP . . . -70.4 -48.45 37.3 Favored Glycine 0 CA--C 1.491 -1.415 0 C-N-CA 124.217 0.913 . . . . 1.37 110.904 -178.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.18 -58.69 7.54 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 104.503 -2.406 . . . . 2.74 104.503 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.404 ' HB2' ' CD2' ' A' ' 49' ' ' LEU 0.26 3.8 pp -56.01 -40.95 74.15 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.703 1.372 . . . . 3.43 114.703 177.324 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.79 -23.87 66.49 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 118.793 0.724 . . . . 2.66 112.27 174.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -80.91 -44.69 17.9 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 125.415 1.486 . . . . 2.89 109.514 168.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.496 ' CD ' ' HZ2' ' A' ' 89' ' ' LYS . 36.7 mm-40 -61.84 -34.21 75.55 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 120.061 1.3 . . . . 2.24 111.419 -172.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.4 tt -49.04 -37.7 10.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-N 118.114 0.415 . . . . 2.51 111.955 171.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.66 -53.96 4.51 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.246 1.018 . . . . 6.21 109.056 176.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.496 ' HZ2' ' CD ' ' A' ' 86' ' ' GLU . 3.1 ttpm? . . . . . 0 N--CA 1.437 -1.122 0 C-N-CA 125.601 1.56 . . . . 4.53 112.826 -170.002 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 44.1 mt . . . . . 0 CA--C 1.542 0.659 0 N-CA-C 112.772 0.656 . . . . 3.28 112.772 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 10.2 t -89.36 -132.04 0.09 Allowed 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.04 1.336 . . . . 2.56 110.513 171.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -92.44 -59.06 2.17 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.111 1.365 . . . . 2.11 114.03 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.5 mt -62.93 -50.33 71.24 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 120.846 -1.159 . . . . 2.04 111.482 -173.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.02 115.22 25.34 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 100.433 -3.914 . . . . 4.82 100.433 138.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -54.67 -50.98 66.93 Favored 'General case' 0 C--N 1.342 0.271 1 C-N-CA 133.753 4.821 . . . . 3.68 118.752 19.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 52.7 p -51.74 -40.05 59.55 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.474 0.916 . . . . 2.27 113.474 -155.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 pp -57.34 -42.68 80.85 Favored 'Isoleucine or valine' 0 C--N 1.339 0.134 0 N-CA-C 112.837 0.68 . . . . 2.12 112.837 174.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -60.2 -50.04 75.22 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.867 -1.16 . . . . 2.42 107.867 173.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -50.05 -38.69 39.2 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.526 0.73 . . . . 3.53 112.882 -178.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 35.8 m -80.36 -40.54 19.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 O-C-N 121.124 -0.985 . . . . 2.04 111.924 171.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 18.0 t -55.22 -43.99 73.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 123.645 0.778 . . . . 2.18 111.308 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 10.2 t -57.26 -49.05 77.27 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.233 0.924 . . . . 2.14 110.428 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 34.6 m -57.61 -52.68 64.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.753 -0.462 . . . . 2.5 109.753 176.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -46.47 -51.82 14.44 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.407 1.083 . . . . 5.72 111.395 174.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -66.18 -53.87 32.11 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.088 0.47 . . . . 5.11 109.8 -173.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 1.3 t -64.55 -32.66 74.4 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 122.092 -0.38 . . . . 3.92 110.363 -176.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -61.35 -59.03 5.91 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.591 1.157 . . . . 7.02 110.238 170.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.48 -22.94 35.8 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 126.638 1.975 . . . . 1.78 112.033 -178.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -18.01 22.58 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 117.678 -1.153 . . . . 5.61 113.456 171.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -45.99 -62.37 1.35 Allowed 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.237 1.569 . . . . 3.66 115.237 -172.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -73.11 -42.5 62.89 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 116.174 1.916 . . . . 5.24 116.174 -152.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -80.35 -88.29 0.55 Allowed Glycine 0 CA--C 1.528 0.874 0 C-N-CA 130.015 3.674 . . . . 4.21 115.1 18.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 43.49 72.88 0.16 Allowed 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.864 -0.786 . . . . 5.7 109.092 -163.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 61.23 2.31 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.951 1.3 . . . . 6.03 111.064 -174.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -168.66 -59.7 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 127.286 2.234 . . . . 4.39 106.658 171.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 4.1 p -83.86 149.41 26.39 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.72 -0.673 . . . . 2.06 111.164 -174.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -107.12 128.64 54.57 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 107.951 -1.129 . . . . 3.31 107.951 174.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 52.8 m -114.11 174.65 5.84 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 119.335 0.97 . . . . 3.33 108.851 166.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 12.7 p -84.88 56.1 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.167 0 O-C-N 120.826 -1.171 . . . . 3.54 111.45 -174.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -152.9 55.89 0.78 Allowed 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 123.683 1.706 . . . . 2.17 108.24 130.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -141.49 -57.51 0.48 Allowed 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 130.408 3.483 . . . . 1.94 101.976 164.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -40.76 -52.82 2.93 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.206 1.003 . . . . 3.99 112.616 -177.232 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -68.19 -28.04 66.93 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.373 0.509 . . . . 3.71 112.373 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -66.91 -35.53 80.22 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 121.376 -0.827 . . . . 3.45 110.886 -178.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.52 -49.13 70.11 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.324 -0.86 . . . . 3.6 109.181 -176.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -62.56 -44.07 99.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 114.957 -1.019 . . . . 1.99 109.217 -176.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 99.4 m -57.31 -55.65 32.04 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.583 0.753 . . . . 1.9 111.257 172.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -80.9 -62.61 1.62 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.349 0.66 . . . . 2.75 112.443 -162.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 -82.41 -39.87 22.06 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 121.805 -0.559 . . . . 3.54 111.985 -173.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.62 -12.77 0.19 Allowed Pre-proline 0 CA--C 1.544 0.746 1 N-CA-C 121.954 4.057 . . . . 2.98 121.954 -153.919 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -49.89 -41.46 47.39 Favored 'Trans proline' 0 CA--C 1.535 0.569 0 C-N-CA 122.726 2.284 . . . . 2.62 116.676 -147.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 61.5 t-80 -86.77 50.03 1.93 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 120.795 1.634 . . . . 3.94 109.415 -174.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 10.3 tp -151.18 -82.52 0.1 Allowed 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.076 0.55 . . . . 1.97 110.444 -175.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 69.9 mt -80.64 70.95 7.48 Favored 'General case' 0 CA--C 1.522 -0.117 0 N-CA-C 108.501 -0.926 . . . . 2.15 108.501 171.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.05 137.53 10.27 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.513 -0.921 . . . . 6.96 108.513 155.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 16.2 t0 70.71 79.07 0.18 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 126.021 1.728 . . . . 3.35 109.869 -156.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 18.1 m -90.47 6.87 4.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 114.085 -1.416 . . . . 2.25 110.209 160.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -89.16 -65.13 1.27 Allowed Glycine 0 C--N 1.341 0.854 0 N-CA-C 108.123 -1.991 . . . . 2.63 108.123 -171.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 13.0 t -78.17 50.04 0.87 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.104 0.961 . . . . 3.13 108.493 172.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.68 -41.47 99.12 Favored 'General case' 0 N--CA 1.445 -0.681 0 O-C-N 120.469 -1.394 . . . . 2.28 108.214 171.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -32.33 71.39 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.689 1.596 . . . . 4.35 110.338 -170.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -56.8 -55.73 30.63 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.646 1.179 . . . . 2.43 110.615 167.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.17 -48.52 73.66 Favored 'General case' 0 C--N 1.343 0.295 0 N-CA-C 108.184 -1.043 . . . . 4.72 108.184 177.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -48.88 -51.01 32.17 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 123.576 0.75 . . . . 2.64 110.411 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -49.28 -46.76 46.8 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.379 0.671 . . . . 4.23 111.494 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 10.0 t -71.16 -39.22 72.03 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.95 0.5 . . . . 3.19 111.417 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 41.0 mt -68.63 -46.66 68.62 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.583 1.153 . . . . 2.63 110.826 -174.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -61.46 -10.31 7.39 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.694 2.398 . . . . 1.64 115.989 -173.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 1.1 p -33.49 -18.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.529 1 C-N-CA 132.607 4.363 . . . . 4.0 119.956 -141.095 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.33 -38.3 41.14 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 120.053 1.297 . . . . 4.09 109.476 156.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 70.94 67.68 0.17 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 126.626 1.97 . . . . 3.91 109.303 -177.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 16.5 p30 -126.97 -13.66 5.7 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.463 1.905 . . . . 1.97 113.525 -174.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 4.5 m 88.53 -10.0 0.48 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 127.203 2.201 . . . . 2.85 114.061 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -111.57 115.04 28.51 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 119.346 0.975 . . . . 3.32 108.922 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.73 97.53 9.18 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 106.016 -1.846 . . . . 2.37 106.016 173.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -82.95 178.28 8.23 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.71 0.686 . . . . 5.17 110.67 -178.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 42.3 p90 -82.8 52.56 2.16 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 114.066 1.136 . . . . 6.84 114.066 -166.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -162.69 47.35 0.15 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.465 -1.309 . . . . 2.78 107.465 126.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -96.18 -63.79 1.11 Allowed 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 120.046 -1.658 . . . . 2.07 109.057 153.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -50.12 -43.63 51.89 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 125.992 1.717 . . . . 4.25 110.543 -175.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 7.7 t-105 -41.78 -43.55 2.97 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.943 0.897 . . . . 5.7 111.637 176.24 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 21.6 mtt180 -45.53 -44.57 12.76 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.615 0.643 . . . . 5.15 111.382 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.0 tp -53.72 -39.47 65.27 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.337 0.655 . . . . 2.13 111.39 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 62.5 mt -65.28 -32.73 59.52 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 N-CA-C 106.688 -1.597 . . . . 2.41 106.688 -177.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.559 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -69.22 -44.95 63.47 Favored Glycine 0 CA--C 1.496 -1.152 0 N-CA-C 110.297 -1.121 . . . . 1.68 110.297 -178.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . 0.442 ' OE2' ' NZ ' ' B' ' 85' ' ' LYS . 3.2 mm-40 -66.17 -62.27 1.58 Allowed 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 106.867 -1.531 . . . . 2.18 106.867 -179.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 3.7 pp -54.42 -37.06 64.66 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.466 1.03 . . . . 2.96 112.452 -178.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.69 -61.44 2.62 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.549 0.613 . . . . 2.35 109.869 173.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . 0.442 ' NZ ' ' OE2' ' B' ' 82' ' ' GLU . 2.1 ptpp? -66.73 -23.76 66.14 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 118.037 -0.982 . . . . 2.54 111.789 -173.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -53.11 -25.67 13.88 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.993 1.717 . . . . 3.08 111.656 173.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 3.8 tt -59.57 -36.27 64.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 CA-C-N 118.709 0.686 . . . . 1.92 110.447 172.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 -82.91 -48.23 10.93 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.801 1.641 . . . . 5.0 112.011 169.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 43.5 tttm . . . . . 0 CA--C 1.536 0.405 0 C-N-CA 125.934 1.694 . . . . 7.33 112.043 -159.341 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 . . . . . 0 CA--C 1.542 0.638 0 N-CA-C 109.955 -0.387 . . . . 7.94 109.955 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -82.5 -13.93 9.47 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.964 2.443 . . . . 9.37 113.291 -173.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 58.5 mt -72.23 134.8 45.82 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.38 0.672 . . . . 3.4 110.737 -162.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.6 t -63.52 -61.65 2.19 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.916 0.886 . . . . 3.62 112.062 -170.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -177.97 -75.32 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 126.253 1.821 . . . . 3.31 106.475 -175.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.06 -42.93 40.26 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.471 0.708 . . . . 2.21 111.154 171.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -49.64 -44.0 47.26 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.586 1.154 . . . . 2.24 112.497 174.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -54.59 -49.55 70.14 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.982 0.81 . . . . 3.81 109.229 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.3 t -63.78 -54.2 38.94 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.762 -0.654 . . . . 3.05 109.812 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.352 2.8 pp -62.81 -34.6 66.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 C-N-CA 118.503 -1.279 . . . . 2.0 112.562 -178.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -61.06 -56.64 18.66 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 119.352 0.978 . . . . 2.86 108.95 173.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.88 -39.31 65.6 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.878 0.847 . . . . 2.35 111.556 -171.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.8 m -75.23 -37.43 39.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 120.798 -1.189 . . . . 2.14 111.815 175.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 28.3 t -58.66 -48.68 85.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 119.808 1.186 . . . . 2.01 110.803 174.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -59.52 -38.32 80.67 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.853 -1.154 . . . . 2.06 110.347 175.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.0 m -56.14 -49.82 72.85 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 118.669 0.668 . . . . 2.0 110.115 171.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -50.99 -52.7 40.11 Favored 'General case' 0 C--N 1.342 0.276 0 CA-C-N 118.613 0.642 . . . . 6.64 109.805 176.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -55.94 -58.21 8.83 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.199 0.444 . . . . 4.96 112.199 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -65.07 -24.31 67.42 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 121.152 0.501 . . . . 3.07 111.397 -175.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.493 ' CZ ' ' HB2' ' A' ' 41' ' ' LEU . 8.1 t80 -80.55 -51.77 8.38 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 124.271 1.028 . . . . 6.12 112.711 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.7 -22.89 65.73 Favored 'General case' 0 C--O 1.24 0.59 0 C-N-CA 126.352 1.861 . . . . 2.18 113.065 -166.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -69.12 -19.8 64.04 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.215 1.406 . . . . 5.2 112.385 175.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -41.9 -62.19 0.96 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.396 0.998 . . . . 3.28 113.041 -172.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -127.37 106.8 9.45 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 126.495 1.918 . . . . 3.86 105.93 -175.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 62.56 118.11 0.01 OUTLIER Glycine 0 CA--C 1.534 1.269 0 CA-C-N 118.822 0.737 . . . . 2.64 113.763 169.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.0 ttm180 63.41 102.85 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 121.794 0.806 . . . . 5.71 113.006 162.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt -73.06 59.96 0.54 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.219 1.007 . . . . 6.89 112.845 -177.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -156.19 -62.76 0.11 Allowed 'General case' 0 C--O 1.231 0.091 0 C-N-CA 128.023 2.529 . . . . 3.69 106.404 177.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.0 p -84.13 135.55 34.34 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 123.666 0.786 . . . . 2.55 110.993 -174.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.429 HD13 ' CZ ' ' A' ' 23' ' ' PHE . 3.2 mm? -88.93 143.6 26.76 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.418 -0.956 . . . . 3.38 108.418 168.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.9 m -111.9 175.86 5.26 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.349 0.659 . . . . 2.67 109.952 168.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.9 p -57.05 -50.22 77.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 N-CA-C 114.008 1.114 . . . . 4.01 114.008 -164.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -64.94 -50.41 66.54 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 118.697 0.68 . . . . 3.19 109.184 -177.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -37.02 -57.85 0.81 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.149 1.38 . . . . 2.28 110.097 166.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.49 -55.6 23.99 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 121.917 -0.489 . . . . 4.56 110.75 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -55.84 -41.94 75.05 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 120.658 -0.417 . . . . 5.08 111.505 -177.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -49.94 -44.09 50.34 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 118.159 0.436 . . . . 2.9 111.022 177.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . 0.493 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 9.6 tp -66.47 -47.58 72.63 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.831 0.741 . . . . 3.75 109.323 -173.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 23.3 m -74.12 -29.13 24.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-N 115.041 -0.981 . . . . 2.25 109.951 -171.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 84.8 m -78.05 -47.04 19.27 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.712 0.805 . . . . 3.45 110.263 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -81.39 -59.95 2.44 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.373 1.069 . . . . 2.79 111.93 -171.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -76.8 -51.8 10.69 Favored 'General case' 0 C--N 1.338 0.083 0 O-C-N 122.101 -0.375 . . . . 5.69 110.206 -169.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 mp -81.69 114.44 50.04 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 124.846 1.258 . . . . 2.81 110.033 -171.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -84.79 -58.96 0.02 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 122.965 2.444 . . . . 2.46 110.304 -174.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -141.26 9.03 2.06 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.068 0.947 . . . . 5.93 113.442 -168.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.4 tp -55.68 -78.88 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 122.073 0.939 . . . . 2.43 109.348 171.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.6 mt -79.4 -55.88 4.74 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.539 -0.912 . . . . 3.69 108.539 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 39.79 38.14 0.41 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.467 1.907 . . . . 6.45 112.331 -168.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.481 ' CG ' ' HZ1' ' A' ' 59' ' ' LYS . 62.2 t0 -108.37 12.51 26.28 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 130.137 3.375 . . . . 6.15 108.616 -175.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 18.8 m -66.25 -22.43 30.2 Favored 'Isoleucine or valine' 0 C--N 1.341 0.207 0 C-N-CA 124.738 1.215 . . . . 3.52 112.172 -171.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.6 -32.55 46.63 Favored Glycine 0 CA--C 1.529 0.967 0 N-CA-C 111.009 -0.836 . . . . 3.33 111.009 169.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 18.7 m -124.22 60.42 1.14 Allowed 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.186 0.994 . . . . 3.5 108.928 178.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -74.37 -38.65 63.12 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.792 1.237 . . . . 2.2 110.172 176.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -54.51 -50.84 66.88 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.406 0.682 . . . . 4.37 111.415 -173.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -57.21 -41.44 79.42 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 121.897 -0.502 . . . . 3.06 111.713 177.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.481 ' HZ1' ' CG ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -58.04 -59.33 5.44 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.36 -0.978 . . . . 3.32 108.36 173.122 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -46.84 -51.48 16.5 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.202 0.601 . . . . 2.64 111.001 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -56.99 -47.6 80.42 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.665 0.786 . . . . 4.21 110.72 177.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 45.6 m -59.62 -39.67 85.06 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 122.195 -0.316 . . . . 2.53 111.419 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -69.81 -49.43 52.83 Favored 'General case' 0 CA--C 1.53 0.18 0 O-C-N 121.933 -0.479 . . . . 3.12 110.812 176.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -76.85 62.28 2.04 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.661 0.784 . . . . 1.82 110.043 -176.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.6 m -56.78 -31.32 35.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 124.698 1.199 . . . . 2.8 112.194 -176.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -88.8 -3.0 58.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.558 1.543 . . . . 3.17 112.057 178.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 54.87 63.35 2.16 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 125.6 1.56 . . . . 4.21 111.982 165.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.3 p30 -130.41 -1.77 4.42 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.784 1.234 . . . . 2.2 112.894 -173.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.2 p 64.3 12.67 7.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.231 1.812 . . . . 3.22 114.062 -175.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -113.37 106.47 14.63 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.614 1.565 . . . . 3.27 108.377 169.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.14 81.78 7.25 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 103.414 -2.81 . . . . 1.97 103.414 167.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.3 ttmt -67.37 161.15 25.81 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.638 0.775 . . . . 5.16 108.985 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -38.65 -53.57 1.61 Allowed 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.309 1.226 . . . . 7.1 114.309 -169.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -65.06 -40.22 94.4 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 121.53 -0.731 . . . . 2.89 112.637 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -63.8 -52.73 58.92 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.805 -1.183 . . . . 1.99 107.805 178.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -52.13 -45.59 65.03 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.55 0.74 . . . . 4.43 110.704 176.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.454 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.4 OUTLIER -40.29 -45.1 2.04 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-O 117.364 -1.303 . . . . 6.37 110.382 173.59 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -39.36 -46.34 1.59 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 120.753 1.615 . . . . 6.33 111.776 -178.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.2 tp -56.25 -45.14 80.17 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.016 0.826 . . . . 2.0 112.989 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.1 mt -69.44 -40.78 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 C-N-CA 125.155 1.382 . . . . 3.25 108.18 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -44.45 -57.99 4.82 Favored Glycine 0 N--CA 1.436 -1.337 0 N-CA-C 109.529 -1.428 . . . . 2.18 109.529 172.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -66.57 -50.97 61.37 Favored 'General case' 0 N--CA 1.435 -1.213 0 CA-C-N 112.134 -2.033 . . . . 2.8 107.751 -174.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.1 tp -37.26 -53.88 1.06 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.297 1.839 . . . . 4.38 111.747 -178.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.02 -34.02 65.46 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.976 0.911 . . . . 2.61 112.802 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -81.84 -48.18 11.9 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.119 0.968 . . . . 3.26 111.637 170.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.25 -26.52 66.5 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 123.743 0.817 . . . . 4.08 112.909 -170.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.6 tp -36.79 -47.27 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 123.5 0.72 . . . . 2.26 111.046 165.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.52 -51.54 6.81 Favored 'General case' 0 C--N 1.345 0.382 0 O-C-N 121.472 -0.767 . . . . 6.05 109.979 170.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.3 tttt . . . . . 0 CA--C 1.538 0.503 0 C-N-CA 125.148 1.379 . . . . 4.32 112.177 -170.341 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.447 -0.597 0 N-CA-C 109.723 -0.473 . . . . 5.03 109.723 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 10.7 t -75.33 -166.24 0.5 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.03 0.932 . . . . 2.5 111.907 -172.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -73.82 -60.17 2.38 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.049 -0.407 . . . . 2.82 111.091 -171.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mt -47.59 -45.75 27.59 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.169 -0.957 . . . . 2.14 110.363 172.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -48.71 -58.78 4.23 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 126.043 1.737 . . . . 3.22 112.981 170.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.22 -36.9 83.38 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 120.863 -1.148 . . . . 5.11 109.204 -176.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 15.8 m -63.17 -37.07 85.77 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.925 0.49 . . . . 3.04 111.329 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.335 2.9 pp -70.51 -38.99 75.62 Favored 'Isoleucine or valine' 0 C--N 1.343 0.292 0 CA-C-N 118.691 0.678 . . . . 2.74 111.428 167.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -55.33 -52.18 64.34 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.421 1.01 . . . . 3.68 110.76 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 11.9 t -55.02 -39.63 69.33 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.42 0.629 . . . . 2.2 111.66 -176.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 25.6 m -77.61 -34.8 20.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 120.713 -1.242 . . . . 2.6 110.781 177.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 45.3 t -59.22 -45.54 92.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-N 119.167 0.894 . . . . 2.31 110.366 173.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.2 t -65.59 -42.41 91.73 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.711 0.687 . . . . 2.74 110.412 177.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 34.9 m -55.46 -47.34 76.23 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.089 0.859 . . . . 1.97 110.282 174.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -53.44 -56.43 16.93 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.157 -0.965 . . . . 4.99 110.173 172.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -49.52 -51.07 38.98 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.498 1.519 . . . . 4.9 111.585 -177.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 32.5 p -64.07 -28.59 69.89 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.184 -0.436 . . . . 2.9 111.736 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -82.17 -34.5 29.04 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-N 118.665 0.666 . . . . 4.21 111.791 170.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.54 -39.48 73.45 Favored 'General case' 0 C--O 1.239 0.531 0 O-C-N 120.949 -1.094 . . . . 2.03 110.475 -172.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 5.2 ptt180 -53.97 -44.09 70.5 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.626 -0.715 . . . . 4.71 111.755 174.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -41.62 -66.24 0.36 Allowed 'General case' 0 N--CA 1.443 -0.792 0 O-C-N 124.249 0.968 . . . . 2.39 113.012 -126.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -96.92 -72.84 0.62 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 124.13 1.919 . . . . 6.09 112.385 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.44 80.63 1.51 Allowed Glycine 0 N--CA 1.439 -1.109 0 CA-C-N 112.076 -2.329 . . . . 3.51 109.579 -171.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 15.2 ttt180 71.44 111.93 0.06 Allowed 'General case' 0 C--O 1.241 0.647 0 CA-C-N 120.725 2.262 . . . . 6.64 114.026 159.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -66.98 64.37 0.05 Allowed 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.886 -1.134 . . . . 5.08 111.727 172.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -132.48 -65.77 0.71 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 125.374 1.47 . . . . 4.96 107.261 172.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 50.0 m -113.93 159.83 19.46 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.18 -0.918 . . . . 2.52 110.812 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 10.5 mp -98.73 123.27 42.85 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.518 1.127 . . . . 3.41 109.036 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 1.1 t -94.87 176.77 6.13 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.509 1.123 . . . . 3.04 109.377 173.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 23.3 m -88.55 52.94 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 O-C-N 120.655 -1.278 . . . . 3.95 112.012 -178.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -157.54 58.11 0.5 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 106.103 -1.814 . . . . 2.61 106.103 143.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -163.34 -57.21 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 129.578 3.151 . . . . 2.21 103.167 -176.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -62.01 -59.94 4.34 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.377 -1.283 . . . . 3.6 109.456 171.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -56.82 -40.88 76.8 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 120.27 -0.572 . . . . 4.43 110.749 -174.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -50.7 -41.27 55.85 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.188 0.305 . . . . 2.64 111.437 175.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.18 -55.96 26.26 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.674 -1.232 . . . . 3.52 107.674 -175.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.2 m -67.94 -44.26 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.674 -0.693 . . . . 1.88 109.574 -170.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 87.5 m -62.86 -47.61 82.63 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 124.061 0.945 . . . . 2.92 110.243 -178.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -80.62 -55.79 4.61 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.085 0.402 . . . . 2.92 112.085 -173.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -81.19 -41.83 21.74 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 113.798 1.036 . . . . 3.19 113.798 -158.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -62.03 -28.76 4.16 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.186 0.81 . . . . 3.03 113.186 -156.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -57.27 -24.55 60.27 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.132 -2.445 . . . . 2.55 111.342 -78.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -91.52 -33.24 15.25 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.899 1.679 . . . . 4.12 110.653 -175.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 42.8 tp -58.61 -56.4 22.68 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.507 0.323 . . . . 1.93 111.449 -165.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 30.2 mt -87.24 162.69 17.3 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 108.404 -0.962 . . . . 2.26 108.404 161.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.29 170.92 14.75 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 107.557 -1.275 . . . . 5.84 107.557 165.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 18.7 t0 55.15 72.63 0.46 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 123.393 1.568 . . . . 4.2 109.25 -161.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 28.0 m -87.7 22.21 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 112.643 -2.071 . . . . 2.56 109.786 160.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -103.59 -70.74 0.84 Allowed Glycine 0 C--N 1.342 0.89 0 N-CA-C 108.81 -1.716 . . . . 2.81 108.81 -177.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 46.7 t -79.02 50.2 1.01 Allowed 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.619 1.167 . . . . 3.49 109.677 178.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -50.94 -41.65 59.16 Favored 'General case' 0 N--CA 1.444 -0.752 0 C-N-CA 125.679 1.592 . . . . 2.28 109.066 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -30.47 -48.18 0.1 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 127.743 2.417 . . . . 4.14 113.526 170.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -60.35 -54.55 44.33 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.309 0.576 . . . . 2.85 110.28 178.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.3 -54.29 48.68 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.115 -1.439 . . . . 5.17 107.115 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -45.51 -55.05 6.64 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.863 1.265 . . . . 2.51 110.635 178.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -64.43 -39.82 94.56 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.268 0.485 . . . . 3.85 110.855 -177.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.4 t -63.89 -30.23 71.33 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 122.833 0.453 . . . . 2.43 111.791 175.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 36.6 mt -80.13 -53.91 6.25 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.595 1.158 . . . . 2.16 110.809 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.261 16.8 t0 -54.63 -8.47 0.24 Allowed 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 128.531 2.732 . . . . 1.75 117.324 -168.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.8 m -34.17 -20.14 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 130.706 3.602 . . . . 2.93 119.762 -134.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -60.35 -25.16 65.64 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 121.281 1.855 . . . . 4.39 111.043 161.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 62.33 64.12 0.98 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.939 1.695 . . . . 4.06 109.908 176.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 39.4 p30 -104.33 -27.42 11.99 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.029 1.332 . . . . 2.56 111.546 176.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 35.0 m 111.35 -21.06 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.337 3.055 . . . . 2.63 111.926 -174.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -113.18 114.8 27.27 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 125.882 1.673 . . . . 6.14 108.566 -168.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -83.16 104.56 13.44 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.76 1.224 . . . . 2.12 108.336 -176.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -84.28 174.32 10.25 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 127.462 2.305 . . . . 6.2 112.339 -165.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -80.42 55.2 2.21 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.512 0.725 . . . . 6.64 109.782 167.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -167.53 46.68 0.05 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 120.316 -0.554 . . . . 5.81 111.067 102.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 69.2 mt-10 -91.33 -60.09 1.98 Allowed 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.473 1.509 . . . . 2.18 108.577 162.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -45.2 -41.48 8.31 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 125.011 1.324 . . . . 3.99 111.707 -175.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.461 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 1.4 t90 -39.5 -48.93 2.07 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 124.527 1.142 . . . . 5.3 109.312 178.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 48.6 mtp85 -42.58 -36.93 1.51 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.197 0.908 . . . . 5.02 113.15 -176.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.1 tp -63.69 -45.26 90.83 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.829 1.195 . . . . 2.07 111.177 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 8.2 pt -77.74 -31.52 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 C-N-CA 124.216 1.006 . . . . 4.87 108.664 -177.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -46.83 -59.27 5.62 Favored Glycine 0 N--CA 1.433 -1.563 0 N-CA-C 108.461 -1.856 . . . . 2.23 108.461 165.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -74.51 -53.97 8.43 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 113.531 -1.334 . . . . 2.87 110.916 -169.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . 0.292 4.5 pp -50.6 -29.28 10.5 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 121.116 1.78 . . . . 2.81 113.157 -175.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.63 -46.63 77.39 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.761 0.652 . . . . 1.94 112.761 168.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -77.45 -35.21 54.13 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 117.871 -1.062 . . . . 3.37 112.281 172.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -52.99 -31.92 43.47 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 120.753 1.615 . . . . 3.22 112.17 -172.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 9.2 tt -43.34 -46.44 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 123.16 0.584 . . . . 2.48 111.61 170.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 9.5 ptm85 -85.55 -49.51 7.98 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.326 1.45 . . . . 4.42 113.699 168.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 23.4 tttm . . . . . 0 CA--C 1.531 0.247 0 O-C-N 121.128 -0.983 . . . . 7.61 111.659 -174.558 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 . . . . . 0 N--CA 1.451 -0.385 0 N-CA-C 109.031 -0.729 . . . . 4.93 109.031 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -72.06 154.46 57.56 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 122.174 1.916 . . . . 2.56 108.754 175.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 73.6 mt -109.33 169.68 8.54 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.187 0.995 . . . . 2.41 108.577 -174.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.5 t -75.18 159.97 30.97 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 120.885 -1.134 . . . . 2.17 110.504 -176.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -46.45 -56.85 5.32 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.193 -0.942 . . . . 2.79 113.164 -175.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 mt -61.08 -44.44 97.37 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.532 -0.747 . . . . 2.89 111.085 -178.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -54.36 -53.14 57.9 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.536 2.334 . . . . 2.71 112.208 173.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -53.26 -55.7 22.43 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.406 1.082 . . . . 3.58 109.274 172.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.0 t -53.08 -51.84 60.54 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.581 0.752 . . . . 2.75 112.076 -178.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.4 pp -65.56 -39.32 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-O 118.472 -0.775 . . . . 1.83 110.155 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -56.06 -58.08 9.42 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 119.138 0.881 . . . . 2.45 109.653 177.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.2 t -54.7 -40.86 69.59 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.351 0.596 . . . . 2.23 111.726 -172.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.4 m -74.28 -35.54 40.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 O-C-N 120.929 -1.107 . . . . 1.71 111.401 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 37.4 t -60.6 -48.4 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 119.285 0.948 . . . . 1.61 110.114 175.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.1 t -62.52 -42.08 99.27 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.077 0.853 . . . . 1.72 110.623 177.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 48.4 m -57.52 -53.45 57.98 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 118.736 0.698 . . . . 1.91 110.226 176.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -45.61 -54.1 8.18 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.109 0.964 . . . . 4.2 109.98 171.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -60.93 -50.19 74.39 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.578 0.751 . . . . 4.51 111.772 -173.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.0 t -63.94 -30.8 71.85 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.95 -0.469 . . . . 2.66 110.836 -178.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -69.71 -42.64 73.75 Favored 'General case' 0 C--O 1.221 -0.406 0 O-C-N 121.631 -0.668 . . . . 4.09 111.13 166.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.81 -22.48 66.93 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 125.259 1.423 . . . . 1.56 112.747 -170.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.253 0.0 OUTLIER -80.66 -15.73 55.82 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 117.112 -1.423 . . . . 4.59 113.543 175.046 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.69 -66.09 0.33 Allowed 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 120.071 1.305 . . . . 2.69 112.595 178.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -117.44 172.73 7.14 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 126.621 1.968 . . . . 2.47 107.219 -173.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -3.52 112.5 0.01 OUTLIER Glycine 0 CA--C 1.531 1.059 0 C-N-CA 127.906 2.67 . . . . 1.95 114.454 172.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.5 mtp180 62.99 106.54 0.03 OUTLIER 'General case' 0 C--O 1.236 0.387 0 N-CA-C 114.309 1.226 . . . . 7.11 114.309 175.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 51.56 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.835 1.654 . . . . 5.5 112.263 157.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -148.14 -53.13 0.19 Allowed 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 125.746 1.618 . . . . 3.99 107.505 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -118.96 162.71 18.07 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 124.533 1.133 . . . . 2.38 111.339 -175.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 mp -112.92 170.17 8.39 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 124.547 1.139 . . . . 3.74 110.461 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.6 t -153.77 179.48 8.82 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.991 1.716 . . . . 4.04 106.794 175.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.7 t -37.28 -62.85 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 125.768 1.627 . . . . 3.33 113.619 -166.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -66.2 -56.29 12.05 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.647 0.658 . . . . 2.3 109.951 -174.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -38.84 -45.89 1.22 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.238 1.415 . . . . 1.72 112.704 171.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -67.53 -58.02 5.45 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 122.996 0.519 . . . . 3.98 110.304 176.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -54.17 -39.98 67.1 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.071 0.396 . . . . 3.78 111.11 -174.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -47.76 -40.43 20.65 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 112.741 0.645 . . . . 3.03 112.741 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 tp -66.22 -45.92 79.01 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-N 119.404 1.002 . . . . 3.53 108.787 -175.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.8 m -68.15 -53.6 28.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 N-CA-C 108.66 -0.867 . . . . 2.45 108.66 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 93.9 m -53.08 -48.9 67.39 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.983 0.913 . . . . 2.33 111.983 179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -80.39 -52.88 7.16 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.751 0.42 . . . . 2.57 111.433 -174.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -106.0 6.55 31.36 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.523 1.129 . . . . 3.61 113.087 -162.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 tp -136.28 84.03 30.7 Favored Pre-proline 0 CA--C 1.537 0.457 0 O-C-N 121.079 -1.013 . . . . 2.97 108.36 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.07 -29.23 48.49 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.431 2.088 . . . . 2.35 111.696 -170.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -141.22 -99.52 0.14 Allowed 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 118.901 -0.571 . . . . 4.6 109.556 173.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.418 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 5.8 tp 51.39 -87.99 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.785 1.634 . . . . 2.19 113.127 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.4 mt -73.62 -29.52 62.41 Favored 'General case' 0 N--CA 1.458 -0.034 0 C-N-CA 125.743 1.617 . . . . 3.1 110.66 177.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 49.4 -173.26 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.948 2.099 . . . . 7.51 113.057 -179.097 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 46.64 42.59 11.6 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 125.958 1.703 . . . . 6.41 111.482 170.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -61.74 2.08 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 127.985 2.514 . . . . 3.79 113.613 -177.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.17 -70.15 0.97 Allowed Glycine 0 CA--C 1.53 1.0 0 N-CA-C 109.502 -1.439 . . . . 1.83 109.502 164.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -81.9 63.81 6.31 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 122.664 1.221 . . . . 2.28 110.156 -174.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -73.23 -28.93 62.44 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 124.553 1.141 . . . . 2.8 109.706 175.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 29.7 p-10 -42.02 -52.89 4.08 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.537 1.535 . . . . 4.76 112.371 173.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -49.2 -50.75 36.81 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.647 0.779 . . . . 4.27 110.082 176.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.45 -47.53 75.84 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.8 -0.444 . . . . 3.98 109.8 -177.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 16.2 tmm? -52.41 -43.69 64.95 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 123.284 0.634 . . . . 4.54 109.466 176.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.6 tptt -70.17 -38.32 75.38 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 122.663 0.385 . . . . 5.97 111.658 178.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.2 m -58.97 -34.87 72.3 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.807 0.443 . . . . 2.89 110.443 172.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 83.8 mt -69.37 -78.27 0.07 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 109.433 -0.58 . . . . 3.49 109.433 168.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.62 80.13 4.1 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 122.012 0.91 . . . . 2.55 110.443 -178.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.2 m -65.19 -19.16 25.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-N 115.617 -0.72 . . . . 4.69 111.318 165.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -69.42 -58.36 4.09 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 118.92 -0.562 . . . . 4.74 112.232 -168.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 121.85 -35.39 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 130.503 3.521 . . . . 4.73 110.322 -167.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . 0.444 ' C ' ' H ' ' A' ' 70' ' ' GLU . 4.0 p-10 -62.54 99.99 0.17 Allowed 'General case' 0 C--N 1.347 0.464 0 N-CA-C 105.711 -1.959 . . . . 4.22 105.711 169.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.0 m -78.94 36.15 0.27 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.222 1.409 . . . . 3.43 111.664 -166.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . 0.444 ' H ' ' C ' ' A' ' 68' ' ' ASP . 12.1 mp0 -121.27 121.11 37.0 Favored 'General case' 0 N--CA 1.426 -1.656 0 C-N-CA 131.647 3.979 . . . . 5.92 102.898 -178.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -93.15 101.25 13.54 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 106.734 -1.58 . . . . 2.12 106.734 -177.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.95 160.05 15.67 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.51 1.124 . . . . 4.42 108.575 169.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -40.45 -60.02 1.2 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.587 1.155 . . . . 6.65 111.667 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -69.14 -25.7 64.51 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.565 0.746 . . . . 2.01 112.036 -176.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -68.04 -59.61 3.12 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 108.497 -0.927 . . . . 1.93 108.497 172.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -55.44 -43.11 75.09 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.643 0.377 . . . . 4.53 110.496 -175.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 8.2 t-105 -39.97 -37.2 0.55 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.688 1.195 . . . . 5.13 112.171 173.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 44.2 mtt180 -39.49 -48.0 1.93 Allowed 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 120.302 1.41 . . . . 4.62 112.12 173.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.7 tp -51.52 -38.85 56.08 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.703 0.801 . . . . 1.9 111.492 -178.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 84.5 mt -67.05 -32.19 56.76 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 108.269 -1.011 . . . . 3.28 108.269 -176.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.556 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -69.61 -46.19 55.76 Favored Glycine 0 CA--C 1.485 -1.822 0 N-CA-C 110.025 -1.23 . . . . 1.34 110.025 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -61.79 -57.2 12.77 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 105.716 -1.957 . . . . 2.41 105.716 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.418 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 4.4 mp -38.39 -59.99 0.84 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 120.074 1.307 . . . . 3.73 112.339 172.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.46 -28.13 69.6 Favored 'General case' 0 C--O 1.225 -0.231 0 N-CA-C 113.153 0.798 . . . . 2.17 113.153 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.0 ttmt -81.45 -62.4 1.66 Allowed 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.814 1.246 . . . . 2.61 110.522 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -39.85 -49.5 2.39 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 126.489 1.915 . . . . 2.44 110.536 -174.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.2 tt -37.12 -43.71 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 125.513 1.525 . . . . 2.11 113.128 177.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.31 67.36 1.08 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.392 1.077 . . . . 7.58 109.86 165.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 84.6 tttt . . . . . 0 C--N 1.327 -0.384 0 C-N-CA 124.389 1.075 . . . . 4.66 109.252 170.753 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 46.7 mt . . . . . 0 CA--C 1.539 0.545 0 N-CA-C 111.536 0.198 . . . . 3.74 111.536 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 6.1 t -76.27 -68.52 0.58 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.38 1.472 . . . . 2.72 114.276 178.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -169.57 -71.69 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.09 1.356 . . . . 2.19 108.702 -164.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.1 mt -51.58 -45.32 63.07 Favored 'General case' 0 C--N 1.341 0.199 0 O-C-N 121.37 -0.831 . . . . 2.46 109.243 166.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -51.55 -47.27 63.49 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.514 1.526 . . . . 3.17 111.621 172.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -59.4 -48.46 81.56 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.224 -0.923 . . . . 3.69 110.072 176.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 14.4 p -62.93 -40.79 98.71 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.284 -0.885 . . . . 2.16 111.282 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.358 2.9 pp -62.15 -37.87 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 O-C-N 121.159 -0.963 . . . . 2.11 110.525 174.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -59.04 -46.07 89.16 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 119.189 -1.004 . . . . 3.3 111.961 170.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . 0.29 1.3 t -56.03 -36.7 68.27 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 120.2 1.363 . . . . 2.0 112.002 -177.056 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 8.8 m -76.17 -35.82 29.18 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 O-C-N 120.414 -1.429 . . . . 1.88 111.578 174.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 94.1 t -57.63 -46.69 86.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 119.188 0.903 . . . . 2.38 110.254 174.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.8 t -64.54 -40.84 96.32 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.411 -0.805 . . . . 2.61 110.474 177.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 27.6 m -57.25 -54.87 41.89 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.478 1.036 . . . . 1.97 109.355 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -42.15 -60.79 1.33 Allowed 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 124.799 1.239 . . . . 5.75 110.582 171.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -57.78 -54.18 49.79 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.035 0.934 . . . . 4.99 111.683 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 36.9 p -57.33 -43.34 83.29 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 122.842 0.457 . . . . 2.69 110.908 -177.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -68.49 -43.64 76.46 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 118.565 0.62 . . . . 4.08 111.591 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.87 -32.77 63.96 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 125.48 1.512 . . . . 1.71 110.33 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.14 -26.34 66.2 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 117.781 -1.104 . . . . 4.78 112.581 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -52.96 -64.15 0.91 Allowed 'General case' 0 C--N 1.343 0.323 0 N-CA-C 114.799 1.407 . . . . 2.76 114.799 -153.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -89.43 -72.86 0.53 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.891 0.853 . . . . 2.89 110.535 -170.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.88 155.74 22.64 Favored Glycine 0 C--N 1.336 0.54 0 C-N-CA 126.634 2.064 . . . . 2.37 110.594 164.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 39.06 105.23 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 116.367 1.988 . . . . 5.46 116.367 131.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -72.74 15.33 0.2 Allowed 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.816 1.784 . . . . 5.63 115.816 -171.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 27.7 p-10 -90.99 -39.9 11.96 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 126.238 1.815 . . . . 4.64 110.205 175.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 11.6 p -99.67 141.33 32.62 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 127.889 2.475 . . . . 2.9 108.951 -164.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -89.25 179.62 6.07 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 107.779 -1.193 . . . . 3.11 107.779 147.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 17.0 t -155.66 -168.32 2.77 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 123.279 1.514 . . . . 3.56 112.191 -144.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 5.2 t -69.36 -157.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 N-CA-C 100.807 -3.775 . . . . 3.98 100.807 135.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -76.66 57.74 1.3 Allowed 'General case' 0 CA--C 1.549 0.915 1 O-C-N 116.153 -4.092 . . . . 2.93 112.866 -136.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -80.21 -44.53 19.6 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 127.504 2.322 . . . . 2.07 108.259 125.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.33 -54.35 30.2 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 122.071 -0.393 . . . . 3.78 111.756 -170.041 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 28.6 tttt -59.69 -32.5 70.55 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 118.706 -1.198 . . . . 4.19 110.367 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -57.56 -33.48 68.18 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 112.59 0.589 . . . . 2.79 112.59 172.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -63.46 -55.5 23.71 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 107.836 -1.172 . . . . 4.11 107.836 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -69.66 -38.91 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 CA-C-N 116.028 -0.533 . . . . 2.04 110.1 -171.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 98.1 m -62.57 -54.57 37.74 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.77 0.828 . . . . 1.69 110.684 175.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -72.36 -60.07 2.42 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.107 -0.371 . . . . 3.02 110.755 -172.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -80.02 -58.41 3.17 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 122.301 -0.249 . . . . 3.37 111.38 -159.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -50.53 -38.57 42.16 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 124.729 1.211 . . . . 3.23 114.242 -155.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -52.54 -49.15 18.45 Favored 'Trans proline' 0 N--CA 1.452 -0.914 0 C-N-CA 119.783 -3.007 . . . . 2.47 109.021 -76.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -51.34 -52.6 44.02 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 126.915 2.086 . . . . 4.32 112.129 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 21.6 tp -54.52 -46.9 73.6 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.607 0.242 . . . . 2.02 110.941 -163.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.435 ' C ' ' H ' ' B' ' 52' ' ' ASP . 91.9 mt -106.16 68.03 0.76 Allowed 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 124.913 1.285 . . . . 2.16 110.046 165.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.29 0.49 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 129.084 2.954 . . . . 7.16 117.715 158.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.435 ' H ' ' C ' ' B' ' 50' ' ' LEU . 9.1 t0 -107.15 90.88 3.44 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 105.233 -2.136 . . . . 3.55 105.233 162.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 30.2 m -97.38 21.0 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 115.391 -0.822 . . . . 2.91 109.133 164.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -95.17 -76.12 1.31 Allowed Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 108.239 -1.944 . . . . 3.01 108.239 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 11.5 m -79.4 52.25 1.34 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 126.637 1.975 . . . . 3.2 111.465 -164.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -67.98 -28.48 67.47 Favored 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 124.129 0.972 . . . . 2.43 109.4 178.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -65.12 -48.12 74.75 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.023 0.829 . . . . 4.01 109.993 173.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -53.66 -53.0 58.15 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.673 0.789 . . . . 2.87 109.126 173.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -57.75 -46.26 84.74 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 118.849 -0.596 . . . . 4.91 110.231 178.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -53.07 -52.72 57.64 Favored 'General case' 0 N--CA 1.462 0.137 0 C-N-CA 124.215 1.006 . . . . 2.72 109.604 178.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -55.73 -44.2 77.32 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.004 0.522 . . . . 4.51 110.119 176.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 16.1 m -66.89 -30.78 71.03 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.028 0.751 . . . . 2.7 113.028 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 37.4 mt -80.47 -56.41 4.2 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 125.307 1.443 . . . . 2.35 109.641 -177.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -67.24 -10.18 48.03 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 127.626 2.37 . . . . 1.58 115.607 -167.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 21.4 m -33.01 -20.79 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 C-N-CA 130.349 3.46 . . . . 2.36 119.613 -133.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -57.35 -27.86 62.64 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 121.117 1.78 . . . . 3.46 110.978 160.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 64.88 60.93 0.81 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.397 1.479 . . . . 3.73 110.589 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 44.6 p30 -107.22 -13.21 15.2 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.064 1.746 . . . . 1.98 111.656 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 14.3 m 69.41 15.14 8.42 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.412 1.485 . . . . 2.23 113.526 -173.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -114.48 101.12 8.83 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 106.185 -1.783 . . . . 3.11 106.185 160.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -78.11 104.16 8.5 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.975 -1.861 . . . . 2.0 105.975 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -81.43 176.8 9.4 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 121.476 0.655 . . . . 5.71 109.742 -171.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -80.57 82.71 6.52 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 107.809 -1.182 . . . . 6.35 107.809 -174.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 97.68 50.21 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.325 1 C-N-CA 133.666 4.786 . . . . 2.6 108.126 -172.593 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -89.05 -59.48 2.21 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 120.698 -1.251 . . . . 2.16 108.521 107.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -38.49 -51.75 1.58 Allowed 'General case' 0 C--N 1.345 0.384 0 C-N-CA 126.525 1.93 . . . . 4.11 112.338 -172.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 46.2 t90 -44.61 -34.33 2.12 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 125.737 1.615 . . . . 4.88 112.807 -176.083 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -40.8 -45.51 2.48 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.947 0.899 . . . . 4.77 111.7 172.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 6.1 tp -54.58 -44.49 73.03 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 118.547 0.612 . . . . 2.12 111.402 178.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 34.5 mt -64.08 -30.26 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.806 0 N-CA-C 107.302 -1.37 . . . . 2.42 107.302 -178.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.577 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -68.07 -44.43 77.35 Favored Glycine 0 CA--C 1.497 -1.057 0 C-N-CA 124.765 1.174 . . . . 1.67 112.088 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . 0.41 ' OE2' ' NZ ' ' B' ' 85' ' ' LYS . 2.3 mm-40 -65.57 -61.89 1.83 Allowed 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 107.203 -1.406 . . . . 2.7 107.203 178.257 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 3.8 pp -56.85 -34.64 68.0 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.038 0.835 . . . . 3.05 112.062 -178.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.67 -61.49 2.55 Favored 'General case' 0 C--N 1.34 0.188 0 O-C-N 121.611 -0.681 . . . . 2.15 110.315 172.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . 0.41 ' NZ ' ' OE2' ' B' ' 82' ' ' GLU . 0.1 OUTLIER -60.66 -33.85 73.43 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 118.291 -0.862 . . . . 2.76 110.138 -175.316 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -50.67 -33.75 23.83 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 125.457 1.503 . . . . 2.98 112.046 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 4.3 tt -56.95 -38.66 60.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 119.091 0.859 . . . . 1.94 110.634 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -82.19 -41.59 20.12 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.779 1.632 . . . . 5.17 110.225 175.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 82.1 tttt . . . . . 0 N--CA 1.448 -0.566 0 C-N-CA 125.018 1.327 . . . . 5.64 111.254 -166.057 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 . . . . . 0 CA--C 1.54 0.574 0 N-CA-C 109.68 -0.489 . . . . 5.66 109.68 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -76.97 101.32 1.5 Allowed 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.507 2.138 . . . . 3.59 109.853 -178.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 94.7 mt -70.54 157.75 37.34 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 121.66 0.743 . . . . 3.02 110.742 175.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.1 m -48.44 136.89 12.11 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.307 1.843 . . . . 3.04 111.47 172.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -45.31 -54.17 7.49 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 119.027 0.83 . . . . 2.79 112.59 174.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.1 mt -57.67 -43.95 85.37 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 119.534 -0.867 . . . . 2.6 111.167 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -58.96 -51.31 70.62 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.928 0.785 . . . . 2.5 112.132 175.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -50.36 -55.7 14.52 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.703 0.764 . . . . 3.15 109.608 176.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.5 p -62.94 -42.22 99.74 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.625 -0.716 . . . . 2.14 112.395 -175.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.54 -33.28 48.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 119.651 1.114 . . . . 1.99 111.006 177.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -61.3 -57.24 13.16 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 118.196 -0.907 . . . . 3.23 109.86 176.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.1 t -51.13 -41.29 59.98 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.712 1.142 . . . . 2.89 111.876 -173.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.9 m -71.78 -37.35 61.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 O-C-N 120.945 -1.097 . . . . 1.97 111.317 178.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 40.3 t -60.25 -52.29 62.98 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 119.542 1.064 . . . . 1.85 110.693 172.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.1 t -59.53 -45.13 92.66 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.182 -0.949 . . . . 2.17 110.376 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 88.5 m -57.44 -46.91 83.05 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.877 0.762 . . . . 2.54 111.041 176.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -49.63 -56.69 9.15 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.232 -0.655 . . . . 4.82 109.232 171.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -57.43 -48.43 79.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.976 0.51 . . . . 5.05 111.478 -175.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.6 p -60.47 -56.54 20.16 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.451 -0.574 . . . . 3.59 109.451 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -55.03 -39.15 68.82 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.729 0.695 . . . . 3.95 111.469 178.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.52 -19.32 61.96 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 125.47 1.508 . . . . 2.29 111.878 -177.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.05 -30.74 70.02 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 118.308 -0.854 . . . . 4.76 111.618 175.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -45.73 -63.98 0.84 Allowed 'General case' 0 C--N 1.346 0.439 0 N-CA-C 113.493 0.923 . . . . 2.31 113.493 -159.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -98.97 80.17 2.45 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 104.155 -2.535 . . . . 3.08 104.155 177.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 34.96 -150.62 0.01 OUTLIER Glycine 0 CA--C 1.525 0.678 0 C-N-CA 127.746 2.593 . . . . 2.85 112.866 -177.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 72.2 mtp85 34.16 81.91 0.02 OUTLIER 'General case' 0 C--O 1.24 0.577 0 C-N-CA 126.122 1.769 . . . . 5.74 110.513 164.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -74.23 29.64 0.08 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.703 2.001 . . . . 4.51 113.681 -163.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -145.0 -45.77 0.23 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.068 1.347 . . . . 3.63 107.624 -170.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.7 p -84.7 134.04 34.36 Favored 'General case' 0 C--O 1.244 0.798 0 O-C-N 121.366 -0.833 . . . . 2.51 111.15 171.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -90.61 120.73 31.93 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.181 1.392 . . . . 3.23 107.896 171.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.3 t -85.55 -179.94 7.0 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.283 1.833 . . . . 2.95 110.921 170.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.3 t -57.29 -58.17 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 124.925 1.29 . . . . 3.68 111.532 -176.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -63.26 -48.3 78.77 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 108.138 -1.06 . . . . 3.24 108.138 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -39.15 -52.44 1.91 Allowed 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 124.965 1.306 . . . . 2.0 112.921 172.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -61.98 -53.82 50.23 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 120.941 -0.304 . . . . 4.21 110.215 175.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.3 tttt -58.23 -36.99 74.01 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 122.047 -0.408 . . . . 4.69 111.337 -172.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -53.72 -40.59 66.21 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.497 1.519 . . . . 2.39 110.887 173.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 tp -66.83 -44.02 82.2 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 119.35 0.977 . . . . 3.73 109.51 -176.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.8 m -76.79 -27.27 16.64 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 CA-C-N 115.914 -0.585 . . . . 2.09 111.264 -174.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.3 m -73.37 -54.85 7.33 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.158 0.583 . . . . 2.72 110.013 172.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -82.68 -58.78 2.75 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.232 1.413 . . . . 3.27 112.778 -167.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -83.57 -49.65 9.01 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.583 0.753 . . . . 3.95 110.901 -167.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.68 121.58 85.39 Favored Pre-proline 0 CA--C 1.541 0.611 0 N-CA-C 109.089 -0.708 . . . . 3.43 109.089 175.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -84.25 -37.4 0.14 Allowed 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.784 2.322 . . . . 3.31 111.627 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -151.74 -47.94 0.11 Allowed 'General case' 0 C--N 1.34 0.166 0 CA-C-O 118.335 -0.84 . . . . 5.46 111.863 -166.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.45 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 9.6 tp -20.76 -78.26 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 127.43 2.292 . . . . 2.76 113.409 -178.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 49.8 mt -77.82 69.1 4.01 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.444 0.698 . . . . 2.6 109.489 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.38 -8.68 0.14 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.084 1.354 . . . . 6.06 114.091 175.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.4 -8.92 56.94 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 128.09 2.556 . . . . 5.2 110.679 176.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.4 m -39.74 -37.24 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.404 0 C-N-CA 124.395 1.078 . . . . 3.05 113.44 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -46.53 -39.64 10.54 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 124.087 0.851 . . . . 2.1 112.728 176.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.1 t -120.39 43.92 2.59 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.771 1.228 . . . . 2.8 109.374 174.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -43.55 -44.98 6.4 Favored 'General case' 0 C--N 1.339 0.111 0 CA-C-O 122.144 0.973 . . . . 2.05 110.052 173.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.65 -26.04 65.2 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 125.751 1.62 . . . . 4.8 111.805 -172.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -73.02 -43.73 61.72 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.742 1.156 . . . . 3.56 108.934 171.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.06 -41.69 79.19 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 108.605 -0.887 . . . . 3.35 108.605 176.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -52.09 -50.28 61.91 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.038 0.535 . . . . 2.44 110.775 175.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.85 -43.21 94.75 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.427 0.558 . . . . 5.3 110.768 178.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.0 t -58.96 -40.09 83.67 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.938 0.399 . . . . 2.29 110.929 174.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 tp -65.5 -56.45 12.32 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.635 0.774 . . . . 4.03 109.884 -178.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -79.09 75.0 5.63 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.256 0.55 . . . . 1.89 110.576 -177.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.7 m -52.48 -25.59 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 123.293 0.637 . . . . 2.44 112.616 177.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -79.23 -29.16 42.59 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.625 0.648 . . . . 3.45 112.003 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 54.98 55.1 8.11 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.692 0.797 . . . . 4.02 110.114 -160.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 56.4 p30 -110.28 -8.26 14.75 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.229 1.811 . . . . 2.34 112.353 177.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.5 m 67.16 18.23 10.39 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.227 1.411 . . . . 2.57 112.86 -175.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -123.53 118.58 27.69 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.877 1.271 . . . . 3.32 108.023 166.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -83.22 100.94 10.9 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 106.194 -1.78 . . . . 2.43 106.194 165.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -62.79 164.99 7.11 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 109.19 -0.671 . . . . 4.15 109.19 169.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -39.5 -58.96 1.17 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.913 1.285 . . . . 6.05 111.218 176.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -70.4 -31.32 68.49 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.156 0.982 . . . . 2.32 111.357 -170.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -69.07 -56.77 6.71 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.876 -0.787 . . . . 1.96 108.876 173.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -55.04 -42.22 72.4 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 110.058 -0.349 . . . . 4.91 110.058 -178.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.658 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 37.3 t90 -46.18 -36.55 6.11 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 124.325 1.05 . . . . 5.92 112.286 176.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 8.5 mtm180 -45.71 -42.94 12.33 Favored 'General case' 0 C--N 1.346 0.427 0 CA-C-N 119.129 0.877 . . . . 4.99 111.023 174.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.4 tp -48.07 -50.09 29.3 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 123.398 0.679 . . . . 2.07 111.045 176.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 19.5 mm -65.25 -27.85 43.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 108.091 -1.077 . . . . 3.51 108.091 -175.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.538 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -61.13 -50.88 62.46 Favored Glycine 0 CA--C 1.494 -1.23 0 N-CA-C 109.429 -1.469 . . . . 1.6 109.429 173.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -76.95 -32.31 57.22 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-O 117.8 -1.095 . . . . 2.3 109.028 -171.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.45 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 7.0 mp -51.67 -58.02 7.56 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 120.297 1.408 . . . . 3.37 109.9 161.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.46 -29.62 67.93 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.792 0.837 . . . . 2.37 112.032 -176.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.11 -60.09 2.42 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-O 118.587 -0.72 . . . . 2.85 110.022 167.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -47.12 -48.63 23.06 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 127.103 2.161 . . . . 3.2 111.41 -168.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.5 tt -51.24 -33.54 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 112.477 0.547 . . . . 2.48 112.477 175.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.05 -46.44 6.81 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.597 2.359 . . . . 6.32 111.603 -174.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 64.0 tttp . . . . . 0 CA--C 1.536 0.43 0 C-N-CA 128.035 2.534 . . . . 4.09 112.959 -177.961 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.1 mt . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 113.594 0.961 . . . . 3.17 113.594 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 10.0 t -81.03 -173.25 4.18 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.758 1.223 . . . . 2.66 110.088 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 73.8 tt0 -73.11 -54.66 7.93 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.256 0.622 . . . . 3.68 111.875 -173.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mt -53.28 -46.66 69.39 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.199 -0.938 . . . . 2.67 109.64 177.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -51.8 -54.99 22.63 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 113.917 1.08 . . . . 2.94 113.917 169.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -60.96 -33.97 74.03 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.882 1.219 . . . . 4.16 110.331 -177.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 13.4 m -60.94 -55.74 29.39 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.213 0.605 . . . . 2.47 110.891 173.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.28 2.3 pp -60.49 -39.23 80.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 O-C-N 121.505 -0.747 . . . . 2.35 110.87 179.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -61.12 -55.94 26.59 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.75 0.704 . . . . 2.59 110.241 175.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.1 t -54.54 -38.53 66.69 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.194 0.906 . . . . 2.18 111.214 -173.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 12.8 m -75.41 -37.42 38.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 O-C-N 121.356 -0.84 . . . . 2.25 111.494 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 25.0 t -58.6 -46.68 90.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 119.759 1.163 . . . . 2.32 110.785 173.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 15.0 t -65.83 -46.87 76.92 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.353 -0.842 . . . . 2.73 110.516 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 86.1 m -59.21 -45.53 90.86 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 120.081 1.309 . . . . 2.09 110.861 176.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -47.07 -54.94 9.22 Favored 'General case' 0 C--O 1.225 -0.196 0 N-CA-C 109.231 -0.655 . . . . 5.52 109.231 170.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -58.89 -51.66 69.07 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 122.977 0.511 . . . . 3.75 111.697 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 41.5 p -62.15 -35.18 77.99 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.556 -0.715 . . . . 3.25 111.229 -177.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -70.03 -44.11 69.93 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.468 0.576 . . . . 4.26 111.016 170.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.93 -27.13 68.63 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.356 1.463 . . . . 2.06 111.0 -173.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -55.72 -26.37 44.93 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 118.926 -0.559 . . . . 4.91 110.957 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.61 -70.9 0.14 Allowed 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 116.085 1.883 . . . . 4.01 116.085 -147.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -95.14 -76.92 0.48 Allowed 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 122.328 1.061 . . . . 3.08 113.257 -169.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.43 112.38 4.22 Favored Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 127.447 2.451 . . . . 2.97 109.557 168.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.6 ttt85 66.85 109.07 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 121.027 2.413 . . . . 5.2 115.845 149.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 21.1 pttt -53.35 -13.64 0.6 Allowed 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 116.565 2.061 . . . . 5.03 116.565 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -88.46 -46.41 9.15 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.761 0.824 . . . . 3.87 110.494 -170.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 5.4 p -107.28 163.27 13.17 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 126.69 1.996 . . . . 2.24 109.512 -175.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 mp -120.78 140.75 51.26 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-O 121.718 0.771 . . . . 4.03 112.743 170.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 5.1 t -86.33 -170.06 2.92 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 128.473 2.709 . . . . 2.94 110.427 174.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.413 ' C ' ' H ' ' B' ' 37' ' ' GLU . 67.7 t -66.65 -108.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.384 1 C-N-CA 132.056 4.142 . . . . 3.68 100.215 177.608 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -75.42 58.01 0.96 Allowed 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 124.068 3.122 . . . . 2.62 112.511 -175.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . 0.413 ' H ' ' C ' ' B' ' 35' ' ' VAL . 4.7 tt0 -123.97 -47.5 1.92 Allowed 'General case' 0 CA--C 1.542 0.639 1 C-N-CA 131.897 4.079 . . . . 2.11 106.301 154.114 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -60.7 -48.02 83.65 Favored 'General case' 0 C--N 1.344 0.336 0 O-C-N 121.282 -0.886 . . . . 4.31 109.925 166.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 13.7 ttmt -59.57 -31.84 69.82 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.217 0.532 . . . . 3.88 110.121 -171.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -54.73 -41.37 70.29 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 123.461 0.705 . . . . 2.93 112.241 173.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.1 tp -63.89 -47.24 81.41 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 120.391 1.45 . . . . 3.02 109.403 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 16.9 m -69.66 -41.0 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 CA-C-N 115.346 -0.843 . . . . 2.2 109.477 -172.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 85.4 m -68.13 -55.55 11.99 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 123.401 0.68 . . . . 1.65 110.519 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -81.84 -58.84 2.81 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.627 1.571 . . . . 3.0 111.635 -163.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.33 -41.23 25.19 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 122.017 -0.427 . . . . 4.01 111.093 -172.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.9 tp -82.59 -14.55 0.21 Allowed Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 119.129 3.011 . . . . 3.31 119.129 -158.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -38.96 -56.73 1.1 Allowed 'Trans proline' 0 CA--C 1.535 0.572 1 C-N-CA 125.601 4.201 . . . . 2.79 116.274 -133.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -71.44 -26.58 62.79 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.741 -0.6 . . . . 4.71 112.439 -169.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 39.0 tp -62.33 -77.01 0.05 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.081 0.552 . . . . 2.26 111.402 -166.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.81 97.68 8.75 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.293 -1.003 . . . . 2.95 108.293 168.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 15.6 pttp -63.54 179.33 0.47 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.007 0.432 . . . . 6.2 110.209 167.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 57.65 34.98 25.18 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.248 1.019 . . . . 5.77 109.882 177.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -55.55 -22.08 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 125.933 1.693 . . . . 4.29 112.999 -173.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -46.01 -41.95 11.35 Favored Glycine 0 CA--C 1.531 1.075 0 N-CA-C 111.316 -0.714 . . . . 2.64 111.316 168.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 82.5 p -76.28 43.11 0.29 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 117.723 0.761 . . . . 4.81 112.179 -178.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -74.94 -50.16 17.7 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 120.98 -1.075 . . . . 2.04 109.055 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.46 -14.17 62.74 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.91 -0.494 . . . . 4.36 112.327 -161.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -80.54 -41.42 24.17 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.702 0.801 . . . . 3.6 111.517 165.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.37 -49.64 71.77 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 107.584 -1.265 . . . . 4.32 107.584 171.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -39.62 -53.83 2.09 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 124.033 0.933 . . . . 2.66 110.978 176.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -60.74 -37.61 82.34 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.361 0.504 . . . . 3.44 112.361 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.0 t -67.18 -30.44 70.39 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.844 0.683 . . . . 3.08 112.844 175.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -80.32 -54.52 5.64 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.455 -0.778 . . . . 2.84 110.385 176.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -54.31 -12.04 0.6 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 128.562 2.745 . . . . 1.51 116.051 -170.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -35.66 -21.99 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.408 1 C-N-CA 132.404 4.281 . . . . 3.77 119.681 -130.367 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 16.8 p30 -64.82 -19.1 65.67 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 120.198 1.363 . . . . 2.87 110.949 163.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 65.13 58.8 0.87 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.323 1.049 . . . . 3.5 110.041 169.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -108.24 -6.54 16.3 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.395 1.878 . . . . 1.83 110.839 -178.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m 67.97 12.66 8.9 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.448 1.499 . . . . 2.78 113.753 -173.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -114.93 100.88 8.53 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.372 1.469 . . . . 3.02 107.106 162.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.92 100.55 0.21 Allowed 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 106.038 -1.838 . . . . 2.12 106.038 166.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.8 tppt? -84.22 167.63 16.48 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.729 1.612 . . . . 4.87 110.199 -167.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -92.1 52.44 1.97 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.646 0.736 . . . . 5.88 110.951 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -162.28 49.74 0.19 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 105.925 -1.88 . . . . 2.42 105.925 113.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -95.68 -61.08 1.52 Allowed 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 119.914 -1.741 . . . . 2.05 109.097 148.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -53.23 -37.73 62.31 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.567 1.147 . . . . 5.67 110.786 -170.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.658 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 17.7 t-105 -39.35 -37.77 0.47 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.129 1.372 . . . . 5.52 111.535 172.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 -37.77 -49.39 1.16 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.595 1.558 . . . . 6.62 111.605 173.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.8 tp -53.4 -40.79 65.34 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-O 119.741 -0.171 . . . . 1.88 110.582 -176.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 76.4 mt -63.75 -28.15 44.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 N-CA-C 108.602 -0.888 . . . . 2.71 108.602 -173.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.58 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -76.01 -45.8 15.13 Favored Glycine 0 CA--C 1.487 -1.671 0 N-CA-C 109.857 -1.297 . . . . 1.5 109.857 178.343 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -68.2 -34.63 76.62 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 107.823 -1.177 . . . . 2.28 107.823 -175.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 5.4 mt -49.23 -60.16 3.05 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 120.642 1.565 . . . . 3.06 111.087 169.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.46 -50.83 68.83 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 122.092 0.949 . . . . 2.02 110.127 -179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 12.7 ttpp -60.18 -40.15 89.01 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 123.769 0.828 . . . . 2.65 110.329 -177.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -64.37 -43.11 95.54 Favored 'General case' 0 C--O 1.226 -0.144 0 C-N-CA 125.716 1.606 . . . . 2.77 110.417 176.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -32.14 47.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 119.545 -0.862 . . . . 2.43 110.836 171.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.91 -36.27 42.15 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 113.75 1.019 . . . . 4.27 113.75 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 16.6 pttp . . . . . 0 N--CA 1.469 0.514 0 C-N-CA 125.25 1.42 . . . . 7.41 112.285 -168.141 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 . . . . . 0 CA--C 1.539 0.548 0 N-CA-C 107.495 -1.298 . . . . 6.6 107.495 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -65.82 164.89 25.24 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 121.359 1.373 . . . . 3.69 111.049 170.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.1 mt -112.13 -178.38 3.4 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 127.046 2.138 . . . . 2.75 109.921 -164.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.5 t -70.96 167.08 19.91 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.733 -1.229 . . . . 2.8 110.093 176.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -61.56 -54.38 43.85 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.166 -0.959 . . . . 2.32 111.607 -166.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.7 mt -60.97 -44.24 97.6 Favored 'General case' 0 C--O 1.222 -0.357 0 O-C-N 121.344 -0.847 . . . . 2.61 111.232 177.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -50.87 -51.47 51.16 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.207 2.203 . . . . 2.8 112.21 174.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -49.84 -58.41 5.45 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.569 0.748 . . . . 4.43 109.157 170.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.0 m -56.08 -50.65 70.42 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.973 0.909 . . . . 2.89 111.719 -173.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.276 2.7 pp -61.92 -43.61 97.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 109.004 -0.739 . . . . 2.24 109.004 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -61.29 -45.69 93.42 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.305 0.957 . . . . 4.21 110.925 175.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.25 -36.53 68.64 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.614 0.766 . . . . 2.83 111.747 -178.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . 0.252 31.2 m -79.46 -40.13 21.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 O-C-N 120.926 -1.109 . . . . 2.22 111.5 172.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.8 t -51.2 -48.46 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 120.48 1.491 . . . . 2.19 110.989 175.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.2 t -59.55 -40.9 88.79 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.866 -0.522 . . . . 1.88 110.524 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 28.7 m -58.94 -50.08 75.39 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.434 0.694 . . . . 2.06 110.039 176.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -52.36 -57.25 10.4 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 123.423 0.689 . . . . 8.33 109.191 175.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -56.51 -53.38 58.19 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.635 1.174 . . . . 5.01 110.382 -172.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.8 t -63.4 -48.5 77.6 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 120.008 -0.677 . . . . 2.63 110.403 -176.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -60.62 -42.39 96.74 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 119.458 1.027 . . . . 4.78 110.773 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.2 -17.71 58.94 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 124.804 1.242 . . . . 2.0 111.965 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.7 ptt180 -71.04 -20.14 62.42 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 117.363 -1.304 . . . . 6.07 111.772 173.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -42.35 -63.0 0.83 Allowed 'General case' 0 C--N 1.346 0.456 0 CA-C-N 119.282 0.947 . . . . 3.21 112.009 -175.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -120.7 171.42 8.6 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 126.405 1.882 . . . . 2.39 106.781 -176.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -11.1 119.45 0.01 OUTLIER Glycine 0 CA--C 1.53 0.989 0 C-N-CA 127.546 2.498 . . . . 1.62 114.298 175.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.6 ttm180 72.56 105.16 0.07 Allowed 'General case' 0 C--O 1.237 0.421 0 C-N-CA 123.446 0.698 . . . . 4.58 112.731 167.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -75.1 50.17 0.47 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.56 1.144 . . . . 4.36 112.868 177.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -147.73 -57.6 0.24 Allowed 'General case' 0 C--O 1.227 -0.121 0 C-N-CA 125.802 1.641 . . . . 3.72 106.914 174.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.0 144.66 28.98 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 124.311 1.044 . . . . 2.08 111.181 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.6 mp -99.87 121.76 41.79 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.087 -1.079 . . . . 3.96 108.087 172.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.6 m -79.54 166.82 21.53 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 107.772 -1.195 . . . . 2.96 107.772 177.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -54.88 -44.66 73.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 O-C-N 120.92 -1.112 . . . . 2.93 112.695 -169.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -62.04 -58.18 8.83 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.468 -0.568 . . . . 2.17 109.468 176.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -37.76 -52.04 1.27 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.743 2.017 . . . . 1.88 111.744 172.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -58.27 -55.59 32.97 Favored 'General case' 0 N--CA 1.442 -0.834 0 C-N-CA 124.764 1.225 . . . . 4.11 109.15 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.6 tttt -59.85 -42.51 93.81 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 119.28 -0.968 . . . . 4.15 112.307 178.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 73.2 mt-10 -52.23 -42.46 63.62 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-N 119.172 0.897 . . . . 2.2 110.621 174.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.4 tt -66.13 -47.18 74.96 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 107.758 -1.201 . . . . 4.03 107.758 -173.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -64.32 -51.85 63.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 118.581 -1.248 . . . . 2.24 109.393 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 95.1 m -48.13 -53.99 14.79 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.446 1.098 . . . . 2.36 111.999 178.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -80.23 -54.83 5.38 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.337 1.055 . . . . 3.04 110.641 -172.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -83.31 -39.63 20.53 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.634 1.174 . . . . 6.37 110.457 -167.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -115.48 68.94 2.82 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-N 119.266 0.939 . . . . 3.51 111.288 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -64.78 -37.53 35.09 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.36 2.04 . . . . 2.74 112.302 -178.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -123.84 -34.08 3.06 Favored 'General case' 0 C--N 1.342 0.257 0 N-CA-C 113.307 0.854 . . . . 7.86 113.307 -174.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 30.2 tp -54.9 -59.85 4.17 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-N 118.471 0.578 . . . . 3.39 110.182 -175.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.0 mt -74.92 124.3 26.66 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 105.21 -2.145 . . . . 2.91 105.21 152.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.2 -7.37 21.26 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 125.455 1.502 . . . . 8.81 110.039 -176.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -110.22 87.89 2.63 Favored 'General case' 0 N--CA 1.435 -1.188 0 N-CA-C 104.844 -2.28 . . . . 4.46 104.844 169.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.5 m -98.26 22.63 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 114.59 -1.187 . . . . 3.33 108.865 161.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -93.2 -76.02 1.32 Allowed Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 107.319 -2.312 . . . . 2.64 107.319 176.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.7 m -79.22 61.52 3.35 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 126.147 1.779 . . . . 3.05 110.085 -171.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.07 -29.56 64.25 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 125.768 1.627 . . . . 2.32 109.327 178.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -53.72 -63.49 1.13 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.869 1.667 . . . . 4.67 112.726 174.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -58.13 -33.66 69.4 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 120.489 -1.382 . . . . 3.6 111.046 177.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 -56.76 17.11 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.584 -0.895 . . . . 3.26 108.584 172.276 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -46.99 -50.53 18.97 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 123.877 0.871 . . . . 3.18 110.01 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -60.19 -38.39 83.12 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 117.981 0.355 . . . . 4.57 111.183 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.7 m -68.67 -47.81 65.57 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.642 0.377 . . . . 2.39 111.95 178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.3 mp -73.94 -48.89 27.45 Favored 'General case' 0 C--O 1.232 0.137 0 O-C-N 121.815 -0.553 . . . . 3.14 111.122 -176.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -75.7 78.44 2.66 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.48 0.712 . . . . 2.42 109.961 -169.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 17.5 m -47.63 -37.4 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 124.152 0.981 . . . . 3.46 113.412 -170.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -96.06 -8.51 33.29 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.059 0.763 . . . . 3.38 113.059 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 54.39 55.03 8.58 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 125.969 1.708 . . . . 3.67 111.329 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.3 p30 -87.43 -42.83 12.53 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.57 0.748 . . . . 2.09 110.22 174.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.5 m 101.9 13.96 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 130.088 3.355 . . . . 2.01 112.727 -171.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -112.93 111.35 22.04 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 105.514 -2.032 . . . . 3.25 105.514 162.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -79.93 89.93 5.32 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 103.421 -2.807 . . . . 2.31 103.421 175.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.3 ttpt -71.26 160.27 33.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.441 1.097 . . . . 4.07 108.349 -178.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -40.09 -60.71 0.99 Allowed 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.561 1.144 . . . . 6.31 112.975 -168.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -69.66 -20.02 63.59 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.195 0.813 . . . . 2.61 113.195 -177.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -76.7 -61.35 2.0 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-N 119.866 1.212 . . . . 1.83 108.288 172.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -45.33 -39.75 7.04 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 125.586 1.554 . . . . 4.3 110.792 176.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.425 ' HE1' ' CA ' ' B' ' 81' ' ' GLY . 11.6 t90 -39.07 -43.59 1.04 Allowed 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 125.243 1.417 . . . . 5.71 114.686 174.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.53 -38.92 32.58 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 109.793 -0.447 . . . . 7.8 109.793 178.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 tp -57.06 -42.39 80.51 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.862 -0.59 . . . . 1.87 111.278 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 14.9 mm -70.76 -41.07 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 107.195 -1.409 . . . . 2.95 107.195 -177.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.407 ' HA2' ' CD2' ' B' ' 77' ' ' TRP . . . -60.97 -38.35 95.34 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-N 115.24 -0.891 . . . . 1.35 111.687 178.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -81.02 -49.36 11.02 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-O 117.789 -1.1 . . . . 3.59 111.331 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . 0.258 4.0 pp -55.34 -34.0 63.84 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 120.885 1.675 . . . . 3.54 110.881 174.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.42 -40.34 78.13 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.219 -0.925 . . . . 2.3 112.52 168.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.3 -48.42 75.74 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 125.068 1.347 . . . . 4.22 111.484 173.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -62.38 -28.11 69.54 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.679 1.592 . . . . 2.84 111.936 -158.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.0 tt -50.73 -38.05 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 123.497 0.719 . . . . 2.81 111.279 169.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . 2.306 0.0 OUTLIER -86.73 -55.13 4.0 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 129.342 3.057 . . . . 5.95 110.472 176.324 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 13.1 tttm . . . . . 0 CA--C 1.537 0.466 0 C-N-CA 127.465 2.306 . . . . 5.78 112.471 -168.839 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.552 1.049 0 N-CA-C 115.718 1.747 . . . . 4.7 115.718 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 9.2 t -130.04 -140.97 0.23 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 127.84 2.456 . . . . 2.85 111.409 -171.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -87.46 -63.58 1.28 Allowed 'General case' 0 C--N 1.34 0.157 0 C-N-CA 125.448 1.499 . . . . 3.12 107.948 177.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.23 -34.13 21.93 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.628 0.771 . . . . 4.49 111.354 -179.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.72 -46.83 20.52 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 122.89 0.476 . . . . 6.53 110.933 175.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -65.04 -44.15 90.04 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 108.149 -1.056 . . . . 5.02 108.149 -171.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 24.6 p -75.09 -27.09 59.75 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.157 -0.929 . . . . 2.31 111.682 -173.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.268 2.0 pp -74.89 -40.66 46.15 Favored 'Isoleucine or valine' 0 C--N 1.34 0.19 0 CA-C-N 119.47 1.032 . . . . 2.58 111.215 166.197 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -53.2 -56.84 13.27 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 119.305 0.957 . . . . 4.01 109.093 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.1 t -52.2 -42.35 63.44 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.048 0.451 . . . . 2.2 111.668 -173.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 19.8 m -79.3 -29.58 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 120.942 -1.099 . . . . 2.07 111.804 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 25.3 t -63.42 -41.65 93.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 119.041 0.837 . . . . 2.96 109.551 172.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . 0.255 9.8 t -67.2 -42.98 83.24 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.091 -0.957 . . . . 2.69 110.482 174.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 4.2 m -51.56 -56.63 12.43 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.855 1.661 . . . . 1.98 110.382 171.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -40.47 -62.0 0.84 Allowed 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 125.097 1.359 . . . . 5.83 110.189 172.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -64.81 -48.42 74.45 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.772 0.32 . . . . 3.57 111.596 -171.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 54.8 p -60.29 -35.54 75.79 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.07 0.548 . . . . 2.71 111.754 -178.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 -69.66 -54.66 12.82 Favored 'General case' 0 N--CA 1.458 -0.07 0 CA-C-O 121.325 0.583 . . . . 4.08 110.403 168.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.62 -18.48 64.96 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 126.199 1.8 . . . . 2.18 112.072 -166.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -52.55 -27.25 15.87 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 118.816 -0.611 . . . . 4.74 111.804 169.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.02 -68.9 0.17 Allowed 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 117.677 2.473 . . . . 3.02 117.677 -151.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -89.18 -76.85 0.4 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.209 0.913 . . . . 2.74 111.922 -161.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.16 167.43 29.11 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 127.722 2.582 . . . . 2.33 110.472 150.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 36.8 ttm180 53.63 101.13 0.01 OUTLIER 'General case' 0 C--O 1.238 0.458 0 C-N-CA 124.336 1.054 . . . . 4.62 113.81 136.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 14.7 pttm -60.5 -39.01 86.18 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 113.479 0.918 . . . . 4.68 113.479 -175.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -77.88 -19.25 55.11 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.343 0.868 . . . . 4.6 113.343 -168.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 96.8 p -130.32 160.52 33.69 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-N 119.544 1.065 . . . . 2.39 111.639 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 5.2 mp -113.22 161.84 16.71 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.281 1.032 . . . . 3.3 111.717 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 15.2 m -140.97 170.45 15.72 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 127.095 2.158 . . . . 2.71 105.852 -178.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 33.0 m -88.91 54.07 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 O-C-N 121.279 -0.888 . . . . 3.94 112.024 -170.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -152.12 54.29 0.81 Allowed 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 105.934 -1.876 . . . . 2.13 105.934 141.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -160.56 -58.52 0.06 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 127.952 2.501 . . . . 1.73 104.722 -174.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -56.36 -60.01 4.13 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.741 -1.118 . . . . 3.45 110.309 177.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 41.3 tttm -58.66 -35.03 71.92 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.303 0.573 . . . . 4.7 109.565 -175.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . 0.288 16.3 mm-40 -63.01 -18.7 63.6 Favored 'General case' 0 N--CA 1.44 -0.954 0 N-CA-C 112.824 0.676 . . . . 5.27 112.824 -174.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 24.7 tp -62.24 -50.78 70.39 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.573 -0.899 . . . . 3.07 108.573 169.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 16.6 m -70.72 -42.73 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 109.816 -0.438 . . . . 2.14 109.816 -174.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 24.1 m -51.96 -55.22 21.69 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 122.688 0.395 . . . . 2.32 110.275 173.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -82.33 -58.72 2.81 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.835 1.05 . . . . 2.37 113.835 -168.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -79.57 -48.53 13.66 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.51 1.3 . . . . 3.89 114.51 -164.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -52.43 -38.78 59.93 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 115.69 1.737 . . . . 3.5 115.69 -148.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -63.94 -39.3 33.43 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.569 -1.846 . . . . 2.77 109.619 -58.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -89.09 -30.6 18.54 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.139 1.375 . . . . 4.68 112.365 -168.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 19.3 tp -47.57 -63.28 1.1 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.491 1.516 . . . . 2.2 111.405 -175.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 33.0 mt -93.09 72.42 4.65 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.372 -0.973 . . . . 2.32 108.372 163.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.9 147.29 0.22 Allowed 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.81 1.244 . . . . 6.25 110.305 174.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 32.0 t0 61.9 41.08 11.86 Favored 'General case' 0 C--N 1.343 0.286 0 N-CA-C 106.856 -1.535 . . . . 4.17 106.856 173.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 5.9 m 32.25 50.54 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 C-N-CA 127.748 2.419 . . . . 4.06 112.924 -172.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 65.07 19.16 65.61 Favored Glycine 0 CA--C 1.525 0.698 0 CA-C-O 118.718 -1.046 . . . . 8.67 114.174 174.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 5.6 p 42.22 61.24 2.04 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 118.288 1.044 . . . . 5.12 108.658 -168.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -45.51 -46.75 14.08 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 126.416 1.886 . . . . 2.49 112.648 -148.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -40.37 -47.72 2.59 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.598 1.959 . . . . 3.65 112.812 174.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -54.22 -60.47 3.29 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 109.332 -0.618 . . . . 4.63 109.332 176.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -44.69 95.84 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 118.458 -0.782 . . . . 6.02 109.242 -175.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 9.2 mtp -47.54 -60.89 2.22 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.586 1.085 . . . . 4.7 110.508 175.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -63.31 -36.8 84.89 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.382 -0.372 . . . . 4.92 110.546 -175.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 14.7 t -62.92 -41.28 99.4 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.015 0.526 . . . . 3.23 111.204 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 29.9 mt -77.19 -51.25 11.29 Favored 'General case' 0 CA--C 1.527 0.079 0 C-N-CA 125.317 1.447 . . . . 2.35 110.394 -172.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -53.39 -14.9 0.85 Allowed 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 116.615 2.08 . . . . 2.18 116.615 -165.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 17.8 m -36.43 -32.35 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 129.71 3.204 . . . . 2.82 117.468 -139.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -65.55 -12.61 54.49 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.352 0.978 . . . . 3.39 112.393 175.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 61.51 41.99 11.89 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 124.363 1.065 . . . . 3.95 113.012 167.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 48.9 p30 -91.92 -7.93 47.76 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.456 1.502 . . . . 2.21 111.48 163.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.0 m 65.31 10.14 6.24 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.985 1.314 . . . . 3.28 113.78 -172.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -99.44 154.12 18.46 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 108.447 -0.945 . . . . 2.9 108.447 167.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -111.81 93.51 4.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 106.215 -1.772 . . . . 2.27 106.215 168.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.69 178.98 7.72 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.412 0.685 . . . . 4.87 110.705 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 40.6 p90 -91.61 52.28 2.02 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.885 0.698 . . . . 5.77 112.885 -171.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -155.52 49.84 0.55 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 107.002 -1.481 . . . . 3.07 107.002 114.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -90.99 -60.88 1.8 Allowed 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 106.066 -1.828 . . . . 1.9 106.066 140.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -52.8 -49.74 65.01 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 124.103 0.961 . . . . 4.16 113.259 -168.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.407 ' CD2' ' HA2' ' A' ' 81' ' ' GLY . 0.3 OUTLIER -43.9 -34.32 1.61 Allowed 'General case' 0 C--N 1.341 0.233 0 O-C-N 123.786 0.679 . . . . 6.34 111.206 177.34 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . 0.401 ' HA ' ' CH2' ' A' ' 77' ' ' TRP . 45.3 mtp180 -51.84 -52.95 45.69 Favored 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 120.098 -0.641 . . . . 5.81 110.933 -175.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 3.2 tp -57.56 -28.04 63.2 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 118.251 -1.38 . . . . 2.62 110.811 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 45.1 mt -71.84 -47.89 53.82 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.346 0 N-CA-C 107.041 -1.466 . . . . 3.01 107.041 -168.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.425 ' CA ' ' HE1' ' A' ' 77' ' ' TRP . . . -80.95 -27.99 47.74 Favored Glycine 0 N--CA 1.42 -2.37 0 CA-C-O 117.863 -1.521 . . . . 3.3 111.227 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -57.28 -47.45 81.42 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 105.264 -2.124 . . . . 3.39 105.264 -173.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 7.8 mp -38.54 -47.94 1.36 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.904 1.282 . . . . 3.83 113.173 174.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.74 -29.8 70.96 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.87 0.868 . . . . 2.53 111.573 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -80.28 -45.9 17.11 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 123.876 0.87 . . . . 2.38 111.24 167.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.39 -50.39 73.15 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.831 1.196 . . . . 3.57 108.193 -171.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 14.3 tt -50.49 -39.22 17.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 123.454 0.701 . . . . 2.16 111.651 174.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.66 -19.11 42.37 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.537 1.535 . . . . 4.46 112.598 -176.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 42.3 tttp . . . . . 0 CA--C 1.535 0.368 0 C-N-CA 123.984 0.914 . . . . 6.23 111.888 -161.626 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 . . . . . 0 N--CA 1.442 -0.854 0 N-CA-C 108.61 -0.885 . . . . 5.95 108.61 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -70.14 141.15 42.97 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 121.951 1.767 . . . . 2.76 108.133 173.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 86.7 mt -99.1 163.73 12.45 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 108.325 -0.991 . . . . 2.59 108.325 -175.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.3 t -73.8 153.01 40.14 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 120.739 -1.225 . . . . 2.23 109.898 -175.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -45.07 -51.63 9.91 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 121.232 -0.918 . . . . 2.46 112.855 -174.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -58.9 -52.08 67.28 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 118.311 -0.852 . . . . 2.66 111.255 178.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -48.87 -55.05 12.82 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.083 2.153 . . . . 2.77 111.767 173.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -52.52 -52.31 55.29 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.164 0.985 . . . . 3.06 109.932 174.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.9 t -57.74 -50.6 72.68 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.385 0.674 . . . . 3.15 111.08 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.279 2.8 pp -62.61 -37.68 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 O-C-N 121.247 -0.908 . . . . 1.96 110.431 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -57.26 -59.4 5.16 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 119.344 0.974 . . . . 2.72 109.965 174.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.6 t -53.92 -40.78 67.02 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 118.986 0.812 . . . . 2.35 111.552 -172.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.1 m -76.34 -30.66 19.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 120.525 -1.359 . . . . 1.67 112.108 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.3 t -64.37 -44.69 97.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 119.679 1.127 . . . . 1.58 110.065 173.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.4 t -65.42 -42.25 92.7 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.46 -0.775 . . . . 1.74 110.242 175.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 50.5 m -55.5 -50.62 69.46 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.906 0.775 . . . . 2.37 110.147 173.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -48.25 -60.04 2.96 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 123.405 0.682 . . . . 4.42 110.089 172.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -52.93 -51.56 60.91 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.226 1.01 . . . . 4.77 111.571 -173.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.1 t -63.78 -25.15 68.05 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 118.493 -0.765 . . . . 3.36 112.17 -176.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -81.54 -42.84 19.59 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 118.951 0.796 . . . . 3.87 111.456 169.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -52.43 -40.25 61.98 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 120.872 -1.142 . . . . 2.02 110.671 -179.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -19.21 61.04 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 116.065 -1.921 . . . . 5.76 113.342 -178.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -45.0 -61.81 1.48 Allowed 'General case' 0 C--N 1.345 0.395 0 CA-C-N 120.758 1.617 . . . . 3.81 110.133 -168.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -128.77 96.74 4.46 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 126.348 1.859 . . . . 5.58 107.613 -177.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.38 149.83 0.11 Allowed Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.425 1.488 . . . . 1.99 114.334 167.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 51.92 82.43 0.07 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.134 0.974 . . . . 6.87 110.806 175.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -71.27 31.31 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.731 1.382 . . . . 4.34 114.731 -175.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -139.57 22.06 2.52 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.604 1.562 . . . . 4.51 108.657 167.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.8 m -154.82 140.48 17.99 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.925 -1.109 . . . . 3.84 113.165 -179.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.1 mp -103.94 117.36 34.13 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.14 1.376 . . . . 3.73 112.705 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.2 t -83.69 177.04 8.55 Favored 'General case' 0 C--O 1.227 -0.131 0 O-C-N 120.84 -1.162 . . . . 3.38 109.784 171.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.5 m -55.43 -50.18 67.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 112.903 0.705 . . . . 3.87 112.903 -163.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -62.37 -57.4 11.45 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 118.604 0.638 . . . . 3.92 109.781 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -38.1 -50.87 1.4 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.306 1.442 . . . . 2.15 110.787 173.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -58.64 -53.6 56.5 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 114.728 -1.124 . . . . 5.29 110.226 177.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -60.71 -37.21 80.91 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 120.618 -0.433 . . . . 4.08 110.06 -174.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -53.81 -37.45 63.56 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 119.076 -0.488 . . . . 3.63 110.937 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.8 tp -68.63 -45.72 71.11 Favored 'General case' 0 C--N 1.339 0.115 0 CA-C-N 119.881 1.219 . . . . 3.42 109.27 -177.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 10.2 m -69.42 -38.46 77.18 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.178 0 CA-C-O 121.457 0.646 . . . . 2.11 109.359 -173.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 74.8 m -69.42 -43.39 73.48 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 124.276 1.031 . . . . 2.47 110.224 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -80.14 -60.47 2.32 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.095 0.558 . . . . 2.58 111.783 -173.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -79.45 -37.75 36.24 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 118.407 -0.806 . . . . 3.91 113.011 -167.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.84 83.51 0.55 Allowed Pre-proline 0 N--CA 1.469 0.478 0 C-N-CA 125.127 1.371 . . . . 3.47 111.732 -165.119 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -64.81 -32.14 56.46 Favored 'Trans proline' 0 N--CA 1.449 -1.115 0 C-N-CA 122.659 2.239 . . . . 1.62 111.898 178.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.37 -3.36 0.42 Allowed 'General case' 0 C--N 1.347 0.487 0 N-CA-C 118.332 2.716 . . . . 6.36 118.332 -174.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.5 tp -58.89 -64.44 0.94 Allowed 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 120.536 1.516 . . . . 1.91 110.487 174.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 45.6 mt -78.67 -42.12 29.45 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 115.952 -0.567 . . . . 3.1 110.97 -175.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 28.5 40.66 0.0 OUTLIER 'General case' 0 C--N 1.343 0.305 0 C-N-CA 129.281 3.032 . . . . 5.03 114.603 -170.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -136.06 24.76 3.3 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.405 2.282 . . . . 5.05 109.236 -176.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.1 m -58.02 -28.94 35.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 124.405 1.082 . . . . 3.05 110.82 -178.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.16 -41.97 16.15 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 124.047 0.832 . . . . 2.06 111.877 172.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 87.3 p -104.43 34.23 3.19 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-N 117.979 0.889 . . . . 3.74 111.166 -177.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -54.47 -35.02 62.59 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 121.001 -1.062 . . . . 2.37 110.567 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -56.07 -40.35 73.44 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.395 -0.816 . . . . 4.16 111.954 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -69.2 -49.83 52.93 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 108.019 -1.104 . . . . 3.24 108.019 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.92 -42.78 65.7 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 109.328 -0.619 . . . . 3.27 109.328 177.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.5 tmm? -61.7 -52.53 63.9 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 124.686 1.194 . . . . 2.99 110.093 178.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -53.97 -38.93 65.52 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 118.744 -0.646 . . . . 3.83 111.906 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.1 t -60.79 -61.54 2.51 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-N 118.908 0.776 . . . . 3.24 109.198 168.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 28.5 mt -53.27 -61.31 2.38 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 125.29 1.436 . . . . 2.55 112.36 -166.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -72.13 88.77 1.12 Allowed 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.028 -0.73 . . . . 2.09 109.028 -171.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.9 m -49.07 -28.07 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 C-N-CA 124.299 1.04 . . . . 3.11 113.71 -175.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -104.56 -11.66 16.86 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.031 1.332 . . . . 3.36 112.845 178.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 52.69 50.4 18.22 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.473 1.109 . . . . 4.94 111.361 177.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.0 p30 -82.33 -20.62 37.0 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 109.077 -0.712 . . . . 1.65 109.077 166.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 78.95 26.57 0.45 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.244 1.418 . . . . 2.58 111.449 176.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -135.13 120.73 19.37 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 104.313 -2.477 . . . . 5.39 104.313 162.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.31 90.99 7.01 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.057 -1.46 . . . . 2.48 107.057 -168.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.0 pttt -76.22 169.59 17.93 Favored 'General case' 0 CA--C 1.528 0.113 0 O-C-N 123.147 0.279 . . . . 5.13 110.726 -178.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.2 p90 -36.66 -61.63 0.52 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.441 1.275 . . . . 7.83 114.441 -163.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.98 -26.56 54.05 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.539 1.063 . . . . 2.71 111.212 -175.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -64.98 -56.75 11.36 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 108.374 -0.973 . . . . 2.08 108.374 174.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -48.9 -54.93 13.34 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.871 1.268 . . . . 4.4 109.775 173.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 59.2 t90 -46.85 -41.89 16.44 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.955 0.902 . . . . 5.51 111.956 -168.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 23.6 ttp85 -45.06 -40.67 6.91 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 118.305 -0.855 . . . . 4.42 111.357 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 6.6 tp -45.09 -50.35 11.1 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 118.154 -0.927 . . . . 2.0 111.87 177.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 92.1 mt -58.81 -32.03 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 108.316 -0.994 . . . . 2.66 108.316 -176.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.527 ' CA ' ' CZ2' ' B' ' 77' ' ' TRP . . . -70.0 -50.14 30.63 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 127.072 2.273 . . . . 1.26 112.103 177.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -58.2 -62.9 1.49 Allowed 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 106.775 -1.565 . . . . 2.9 106.775 177.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . 0.262 4.3 pp -53.34 -37.42 62.31 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.301 0.955 . . . . 3.57 112.305 177.23 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.52 -62.11 1.9 Allowed 'General case' 0 C--N 1.342 0.245 0 CA-C-N 119.179 0.9 . . . . 2.19 111.073 173.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . 0.275 0.0 OUTLIER -70.2 -20.09 63.13 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 119.095 -1.042 . . . . 3.13 112.042 -174.75 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -56.31 -31.35 63.6 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 118.144 -0.931 . . . . 2.62 110.676 173.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.5 tt -58.81 -12.49 2.64 Favored 'Isoleucine or valine' 0 C--N 1.348 0.501 0 N-CA-C 113.417 0.895 . . . . 2.48 113.417 173.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 5.5 ptm85 -118.75 -38.43 3.11 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 118.918 0.781 . . . . 5.01 112.079 172.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.408 0 N-CA-C 116.565 2.061 . . . . 4.46 116.565 -177.028 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 66.1 mt . . . . . 0 CA--C 1.555 1.141 0 N-CA-C 112.675 0.62 . . . . 4.5 112.675 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' THR . . . . . 0.457 HG21 ' CG ' ' B' ' 10' ' ' GLU . 2.2 t -66.51 178.04 1.37 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.451 1.501 . . . . 2.12 111.224 178.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -59.26 -61.54 2.55 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.436 -0.79 . . . . 2.69 112.387 -175.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 14.4 mt -53.63 -43.61 68.84 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.162 -0.961 . . . . 2.47 111.68 175.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . 0.457 ' CG ' HG21 ' B' ' 7' ' ' THR . 69.5 mt-10 -53.73 -48.19 69.87 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 124.761 1.225 . . . . 3.54 111.785 175.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -59.15 -46.99 86.93 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 120.609 -1.307 . . . . 4.52 109.772 173.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 16.1 m -57.44 -43.78 84.17 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.479 0.712 . . . . 2.45 110.977 -175.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.256 2.3 pp -67.05 -41.32 87.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.149 0 CA-C-O 118.479 -0.772 . . . . 2.17 111.385 172.042 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -53.49 -56.75 14.37 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.258 0.935 . . . . 2.4 110.661 178.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.9 t -49.33 -45.8 45.97 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 118.996 0.816 . . . . 2.31 111.968 -174.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 20.3 m -72.62 -38.18 58.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 O-C-N 120.808 -1.182 . . . . 1.82 111.395 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 43.8 t -58.04 -41.28 80.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 O-C-N 121.823 -0.548 . . . . 1.93 110.218 174.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . 0.257 11.9 t -70.64 -41.23 72.43 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 118.205 -0.902 . . . . 2.03 111.257 176.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 4.0 m -51.21 -52.43 44.58 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-N 120.649 1.568 . . . . 1.76 109.991 171.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -51.9 -61.07 2.49 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.362 0.665 . . . . 5.44 110.09 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -61.74 -40.92 96.79 Favored 'General case' 0 C--N 1.334 -0.107 0 C-N-CA 123.463 0.705 . . . . 4.7 111.517 -168.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 41.1 p -60.96 -60.09 4.35 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.474 -0.565 . . . . 3.4 109.474 173.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -57.99 -35.12 70.76 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.417 0.553 . . . . 4.99 111.346 -174.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.04 -29.31 43.38 Favored 'General case' 0 CA--C 1.513 -0.448 0 C-N-CA 127.182 2.193 . . . . 2.03 110.929 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -47.06 -34.31 5.71 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 124.241 0.963 . . . . 5.29 111.873 175.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.84 -66.55 0.48 Allowed 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 115.963 1.838 . . . . 2.04 115.963 -146.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -91.2 -75.89 0.46 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 119.24 -0.984 . . . . 3.03 113.089 -167.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.44 156.19 23.18 Favored Glycine 0 C--N 1.338 0.667 0 C-N-CA 127.394 2.426 . . . . 3.02 109.666 160.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 47.4 102.37 0.0 OUTLIER 'General case' 0 C--O 1.242 0.684 0 N-CA-C 114.775 1.398 . . . . 5.57 114.775 144.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -71.5 47.28 0.12 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.13 1.372 . . . . 4.91 112.867 176.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -157.24 -51.69 0.07 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.674 0.79 . . . . 3.17 109.448 -173.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 33.9 p -85.36 146.39 27.03 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 123.126 0.57 . . . . 1.93 110.366 172.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -92.5 178.41 5.82 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 108.2 -1.037 . . . . 3.08 108.2 164.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 34' ' ' SER . . . . . 0.41 ' C ' ' O ' ' B' ' 35' ' ' VAL . 28.0 m -154.23 -175.98 5.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 122.077 0.941 . . . . 3.11 110.46 -143.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.41 ' O ' ' C ' ' B' ' 34' ' ' SER . 21.7 t -73.18 -166.15 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 N-CA-C 100.781 -3.785 . . . . 3.73 100.781 141.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.47 51.85 1.93 Allowed 'General case' 0 CA--C 1.552 1.057 0 O-C-N 116.709 -3.744 . . . . 3.92 113.114 -111.038 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -61.58 -59.41 5.25 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 126.796 2.038 . . . . 1.7 108.887 125.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.455 ' CZ ' ' CD2' ' B' ' 76' ' ' TYR . 0.4 OUTLIER -54.96 -44.42 74.35 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 119.727 -0.789 . . . . 3.43 111.786 -163.252 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.87 -35.36 68.83 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.477 -0.764 . . . . 3.84 111.806 176.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -56.39 -31.98 64.37 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.474 0.579 . . . . 3.1 111.726 177.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -64.43 -55.11 23.07 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 119.294 0.952 . . . . 3.7 108.648 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 13.8 m -69.05 -38.47 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 114.486 -1.233 . . . . 2.06 109.256 -170.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 85.5 m -63.63 -57.67 9.33 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.328 1.051 . . . . 2.05 110.958 174.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -76.01 -60.79 2.17 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 122.136 -0.353 . . . . 2.46 111.025 -165.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.81 -47.37 12.93 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 122.314 -0.241 . . . . 3.16 111.096 -171.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 2.1 tp -84.3 -16.44 0.23 Allowed Pre-proline 0 CA--C 1.544 0.738 0 N-CA-C 120.893 3.664 . . . . 2.92 120.893 -151.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -44.4 -50.97 7.45 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 123.51 2.806 . . . . 2.59 116.053 -143.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 42.6 t-80 -76.91 48.95 0.62 Allowed 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.777 0.717 . . . . 4.38 112.215 -176.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 13.2 tp -150.99 -61.62 0.18 Allowed 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 124.257 1.023 . . . . 1.96 109.738 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 96.7 mt -109.59 112.37 24.42 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.378 -0.971 . . . . 2.13 108.378 169.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.3 -165.06 0.71 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 108.779 -0.823 . . . . 5.83 108.779 170.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 64.64 24.84 13.03 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.849 1.26 . . . . 3.97 110.626 169.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 33.0 m -61.62 -18.94 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 125.009 1.324 . . . . 2.42 113.03 -168.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.15 -52.85 49.35 Favored Glycine 0 CA--C 1.53 1.016 0 N-CA-C 110.305 -1.118 . . . . 3.23 110.305 168.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 22.6 t -81.29 34.66 0.37 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.797 1.239 . . . . 2.86 111.534 -171.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -60.03 -25.19 65.12 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.201 1.4 . . . . 2.23 110.246 -174.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -52.29 -33.01 40.25 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.113 1.365 . . . . 3.37 113.215 173.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -58.25 -44.67 88.44 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 120.044 1.293 . . . . 3.46 109.049 175.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -70.73 -49.18 49.73 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 107.419 -1.326 . . . . 5.09 107.419 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 13.9 tpt -39.68 -55.89 1.81 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.687 1.13 . . . . 3.43 110.615 176.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -60.92 -52.46 64.95 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.592 -0.276 . . . . 4.13 111.088 178.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.2 m -58.62 -30.37 67.21 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.082 0.771 . . . . 2.42 113.082 -178.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . 0.413 HD12 ' CE2' ' B' ' 38' ' ' PHE . 60.3 mt -81.67 -55.28 4.75 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 126.183 1.793 . . . . 2.38 109.855 -176.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.26 2.9 t70 -68.72 -10.96 59.47 Favored 'General case' 0 C--O 1.218 -0.602 0 N-CA-C 115.083 1.512 . . . . 2.23 115.083 -170.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 18.9 m -31.98 -23.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 N-CA-C 120.069 3.359 . . . . 2.78 120.069 -134.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -51.43 -34.38 34.67 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 121.106 1.776 . . . . 3.63 110.223 157.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 65.48 47.5 2.25 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.993 1.317 . . . . 3.56 109.163 174.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 27.2 p30 -76.9 -29.13 55.6 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.188 -0.915 . . . . 1.93 108.815 168.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 4.0 m 96.14 -5.98 0.08 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 128.25 2.62 . . . . 2.94 113.503 178.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -101.68 119.13 38.29 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 107.094 -1.447 . . . . 2.77 107.094 170.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.23 112.33 20.65 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.696 -1.224 . . . . 2.16 107.696 178.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.43 173.35 11.58 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.932 2.093 . . . . 3.61 110.719 -177.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -82.72 52.73 2.18 Favored 'General case' 0 C--N 1.345 0.407 0 O-C-N 121.08 -1.013 . . . . 5.07 111.004 176.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -169.58 48.07 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 106.498 -1.667 . . . . 2.79 106.498 125.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -97.38 -64.18 1.06 Allowed 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 119.841 -1.787 . . . . 1.98 109.265 152.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.455 ' CD2' ' CZ ' ' B' ' 38' ' ' PHE . 22.6 t80 -49.07 -48.71 43.89 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 125.327 1.451 . . . . 3.93 110.138 -177.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 0.7 OUTLIER -53.28 -31.64 44.76 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.494 -1.23 . . . . 5.88 110.886 -169.626 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . 0.404 ' HB2' ' CD2' ' B' ' 63' ' ' LEU . 28.4 mmt180 -40.16 -46.71 2.27 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.951 0.9 . . . . 5.26 112.283 170.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 2.8 tp -54.45 -37.18 64.87 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 117.908 0.322 . . . . 2.23 110.886 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 84.3 mt -63.85 -32.93 58.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 108.31 -0.996 . . . . 2.39 108.31 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.54 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -72.24 -40.88 54.78 Favored Glycine 0 CA--C 1.491 -1.459 0 C-N-CA 124.523 1.059 . . . . 1.75 110.688 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -64.67 -64.92 0.75 Allowed 'General case' 0 N--CA 1.433 -1.308 0 N-CA-C 106.075 -1.824 . . . . 2.25 106.075 177.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 3.8 pp -55.44 -34.58 64.58 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 118.533 0.606 . . . . 2.92 112.341 -173.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.65 -62.13 2.08 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 118.346 0.521 . . . . 1.99 111.042 170.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.302 0.0 OUTLIER -63.41 -30.63 71.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 118.219 -0.896 . . . . 3.1 111.428 -173.574 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -54.21 -26.14 26.79 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.15 0.98 . . . . 2.86 111.952 177.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 3.5 tt -59.4 -38.28 74.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 119.802 1.183 . . . . 2.06 110.834 172.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -82.35 -41.84 19.49 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.6 1.96 . . . . 4.65 110.583 176.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.224 -0.247 0 C-N-CA 126.442 1.897 . . . . 5.79 111.011 -165.981 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 . . . . . 0 CA--C 1.538 0.502 0 CA-C-O 117.924 -1.036 . . . . 7.59 110.969 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -71.64 161.98 43.57 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 CA-C-N 121.05 1.411 . . . . 4.39 109.727 170.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.5 mt -130.62 -157.9 0.85 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.716 1.606 . . . . 3.22 108.344 -171.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 57.3 m -60.55 144.79 50.75 Favored 'General case' 0 C--O 1.224 -0.243 0 O-C-N 120.506 -1.371 . . . . 4.72 109.909 176.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -35.58 -66.86 0.18 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.948 1.299 . . . . 3.7 111.756 170.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.21 -32.69 74.15 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.377 -1.297 . . . . 3.45 113.022 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -52.91 -49.5 65.82 Favored 'General case' 0 C--N 1.347 0.477 0 CA-C-N 120.855 1.661 . . . . 2.25 111.515 168.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -49.5 -51.77 34.04 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 108.493 -0.929 . . . . 3.08 108.493 175.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.5 m -60.43 -53.14 61.1 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.647 -0.706 . . . . 2.35 111.862 -175.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.272 2.7 pp -64.88 -38.49 82.9 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 O-C-N 121.577 -0.702 . . . . 1.99 109.741 -176.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -62.47 -50.13 72.65 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.645 -0.66 . . . . 3.03 111.222 175.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 t -58.93 -34.65 71.96 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.073 0.851 . . . . 2.35 111.749 -173.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 23.0 m -77.13 -41.44 30.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 O-C-N 121.171 -0.956 . . . . 1.62 110.878 174.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.9 t -53.91 -47.7 63.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 118.923 0.783 . . . . 1.77 110.81 175.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.9 t -62.67 -43.16 99.51 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.454 -0.779 . . . . 1.93 110.897 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 39.1 m -59.9 -50.2 74.7 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.877 -0.514 . . . . 2.18 109.689 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -47.73 -56.93 6.26 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.461 0.705 . . . . 4.27 110.585 169.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -60.3 -45.32 93.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.077 0.551 . . . . 4.59 111.178 -169.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.4 t -61.31 -32.36 72.22 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 120.061 -0.656 . . . . 3.63 110.789 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -70.19 -43.95 69.69 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-N 119.432 1.015 . . . . 4.34 110.72 168.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.13 -38.59 39.76 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 124.748 1.219 . . . . 1.59 111.797 -171.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.8 ptt85 -75.63 -20.45 58.5 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 117.563 -1.208 . . . . 5.22 113.877 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -47.77 -57.9 5.01 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 120.1 1.318 . . . . 2.84 112.898 -166.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -120.66 93.57 4.08 Favored 'General case' 0 C--O 1.242 0.704 0 C-N-CA 128.541 2.736 . . . . 3.13 106.08 -171.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 48.59 -174.19 0.03 OUTLIER Glycine 0 CA--C 1.526 0.736 0 C-N-CA 125.699 1.619 . . . . 1.72 112.37 -176.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.3 mmt-85 29.74 97.46 0.0 OUTLIER 'General case' 0 C--O 1.24 0.596 0 C-N-CA 126.09 1.756 . . . . 5.45 112.846 164.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . 0.479 ' HZ2' ' CG ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -78.53 40.87 0.38 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.598 1.559 . . . . 6.44 109.167 177.749 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.479 ' CG ' ' HZ2' ' A' ' 30' ' ' LYS . 5.7 m-20 -154.81 -51.87 0.09 Allowed 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 106.285 -1.746 . . . . 4.97 106.285 -145.305 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.5 p -115.16 139.3 50.03 Favored 'General case' 0 C--O 1.246 0.889 0 C-N-CA 125.566 1.546 . . . . 2.94 111.097 172.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -101.4 117.64 35.35 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 113.727 -1.579 . . . . 3.6 108.241 -176.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 19.0 m -88.35 174.98 7.84 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.074 1.75 . . . . 2.56 110.999 178.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.5 m -58.82 -48.82 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 O-C-N 121.395 -0.816 . . . . 3.94 112.979 -172.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -68.35 -47.38 67.62 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-O 118.4 -0.81 . . . . 2.95 109.518 -178.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -41.81 -46.91 4.04 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.059 0.845 . . . . 2.1 112.02 168.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.71 -59.99 4.21 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.168 0.587 . . . . 4.24 110.602 172.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -57.93 -41.18 82.23 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.491 0.716 . . . . 3.54 111.32 -172.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -47.84 -40.63 21.85 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.137 0.975 . . . . 3.19 112.122 174.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.32 -52.47 65.49 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 119.617 1.098 . . . . 4.05 108.113 -178.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.1 m -72.94 -50.87 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 CA-C-N 114.919 -1.037 . . . . 2.49 109.703 -169.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.2 m -57.36 -44.31 84.27 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 125.401 1.48 . . . . 2.56 111.656 178.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -60.22 -62.34 1.94 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.78 0.718 . . . . 3.74 110.999 -173.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -145.15 38.53 1.17 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.493 0.923 . . . . 5.36 113.493 -173.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -129.13 31.75 0.22 Allowed Pre-proline 0 CA--C 1.549 0.934 0 N-CA-C 116.074 1.879 . . . . 2.91 116.074 178.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -62.38 -60.52 0.19 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.852 2.368 . . . . 2.65 114.232 -165.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -66.3 -37.96 86.63 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 121.337 -0.852 . . . . 5.37 111.421 -175.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.416 ' CD2' ' HB2' ' A' ' 83' ' ' LEU . 22.5 tp -65.66 -54.32 29.11 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.993 0.517 . . . . 2.45 110.027 -173.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.5 mt -107.63 87.71 2.56 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-O 121.841 0.829 . . . . 2.5 109.533 169.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.69 160.35 0.66 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 113.981 -1.463 . . . . 6.48 111.645 170.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 57.53 39.66 27.62 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.205 1.002 . . . . 5.39 111.098 168.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -41.28 -34.57 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 128.186 2.594 . . . . 3.72 112.658 177.073 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -39.75 -48.69 3.23 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.153 0.883 . . . . 1.91 112.006 174.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.6 t -91.95 20.72 5.49 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.763 0.825 . . . . 2.54 113.226 -172.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -39.2 -46.38 1.48 Allowed 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 125.642 1.577 . . . . 2.27 111.897 173.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -49.94 -37.5 32.22 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.932 2.093 . . . . 4.56 111.75 -174.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -58.49 -52.9 63.67 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 121.535 0.683 . . . . 2.96 109.781 173.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -49.51 76.05 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 107.933 -1.136 . . . . 3.64 107.933 -178.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -49.51 -54.6 17.02 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.414 0.686 . . . . 2.52 110.651 177.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -59.83 -43.78 94.41 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 122.346 -0.221 . . . . 3.74 111.203 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.6 t -60.24 -44.1 95.53 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.831 0.824 . . . . 2.47 111.185 178.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.0 mt -64.69 -46.3 82.96 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.531 1.133 . . . . 3.25 110.601 -179.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -69.11 77.0 0.34 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.439 1.096 . . . . 1.64 110.629 -177.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.0 m -46.15 -43.35 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 C-N-CA 124.673 1.189 . . . . 2.49 113.648 -172.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -96.82 6.6 48.36 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.436 0.694 . . . . 2.81 112.254 -176.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 37.5 56.8 1.42 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.831 2.053 . . . . 3.76 112.189 -177.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 50.6 p30 -94.42 -5.92 45.22 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.929 1.292 . . . . 1.63 110.565 177.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.9 m 67.8 19.94 9.49 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.892 1.277 . . . . 2.24 111.583 -174.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -131.03 109.39 10.47 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.685 -1.598 . . . . 3.03 106.685 174.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . 0.422 ' N ' ' CD2' ' A' ' 71' ' ' LEU . 0.1 OUTLIER -83.53 105.39 14.42 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 103.86 -2.644 . . . . 2.12 103.86 171.838 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 164.86 1.24 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 108.71 -0.848 . . . . 4.84 108.71 169.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -38.05 -60.55 0.74 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.923 1.289 . . . . 5.94 110.98 175.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -67.78 -26.64 66.2 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.229 1.012 . . . . 2.07 112.264 -175.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -73.36 -59.07 2.88 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.804 0.729 . . . . 2.16 109.067 174.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -51.8 -47.86 64.08 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 109.422 -0.584 . . . . 3.77 109.422 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.675 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 55.4 t90 -46.5 -39.53 10.95 Favored 'General case' 0 N--CA 1.44 -0.94 0 O-C-N 124.312 1.007 . . . . 5.42 111.528 -175.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 70.6 mtt180 -43.43 -40.99 4.04 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.676 0.671 . . . . 4.84 112.756 175.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 28.7 tp -52.55 -44.64 65.97 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.065 0.546 . . . . 2.07 111.149 179.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 55.1 mt -60.23 -28.34 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 N-CA-C 108.0 -1.111 . . . . 2.66 108.0 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.587 ' CA ' ' CZ2' ' B' ' 77' ' ' TRP . . . -68.88 -52.76 22.68 Favored Glycine 0 CA--C 1.492 -1.367 0 C-N-CA 126.547 2.022 . . . . 1.32 111.896 178.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.43 -59.71 5.01 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 105.792 -1.929 . . . . 2.38 105.792 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.416 ' HB2' ' CD2' ' A' ' 49' ' ' LEU 0.298 4.3 pp -54.35 -38.43 66.07 Favored 'General case' 0 CA--C 1.551 1.015 0 O-C-N 121.339 -0.851 . . . . 3.12 112.768 179.016 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.84 -29.01 70.41 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.091 -1.005 . . . . 2.37 113.528 175.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -81.06 -44.16 18.42 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.601 1.56 . . . . 2.64 109.691 174.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -63.29 -25.73 68.45 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.82 1.248 . . . . 2.59 111.162 -175.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.4 tt -48.23 -34.37 4.85 Favored 'Isoleucine or valine' 0 C--N 1.344 0.34 0 CA-C-N 119.259 0.936 . . . . 2.36 112.825 167.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 38.1 ttp180 -96.51 -48.6 5.48 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.611 1.164 . . . . 6.13 108.669 177.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 74.1 tttt . . . . . 0 CA--C 1.539 0.553 0 N-CA-C 113.527 0.936 . . . . 3.82 113.527 -173.197 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.9 mt . . . . . 0 CA--C 1.544 0.72 0 N-CA-C 113.759 1.022 . . . . 5.3 113.759 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 6.8 t -170.09 -175.41 2.0 Allowed 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 120.204 1.366 . . . . 3.29 110.989 -172.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 70.8 tt0 -71.42 -67.25 0.53 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.848 1.204 . . . . 2.71 112.118 -167.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 11.9 mt -48.97 -42.34 37.31 Favored 'General case' 0 C--N 1.34 0.196 0 O-C-N 121.615 -0.678 . . . . 2.28 110.793 173.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -48.94 -61.29 2.14 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 117.76 -1.114 . . . . 5.84 112.472 169.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -51.51 -41.6 61.11 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 121.402 1.91 . . . . 3.75 109.946 178.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.2 t -61.83 -30.4 70.81 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 118.334 -0.841 . . . . 2.58 112.839 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.284 2.7 pp -80.51 -35.68 15.4 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 119.842 1.201 . . . . 2.18 110.892 167.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -52.38 -53.32 46.33 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 108.066 -1.087 . . . . 3.03 108.066 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 7.8 t -55.02 -35.4 64.38 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.115 0.783 . . . . 1.95 113.115 -175.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 20.0 m -80.11 -37.09 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 O-C-N 120.807 -1.183 . . . . 1.79 110.172 175.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 43.4 t -58.65 -45.57 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 123.807 0.843 . . . . 1.93 110.593 177.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 8.9 t -60.79 -44.08 97.29 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 119.853 1.206 . . . . 2.34 110.609 175.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 23.1 m -57.77 -52.16 66.61 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 119.094 0.861 . . . . 1.63 109.733 178.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -46.83 -60.88 2.13 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.186 1.394 . . . . 5.17 110.968 171.281 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -59.49 -49.72 76.68 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.977 1.311 . . . . 4.17 110.975 -171.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 34.6 p -56.15 -56.68 17.96 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 118.915 -0.564 . . . . 2.83 109.819 177.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -52.71 -47.24 67.43 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 119.099 0.863 . . . . 4.06 111.338 175.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.39 -29.7 58.99 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.366 1.467 . . . . 1.99 110.653 -175.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.07 -21.25 58.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 117.435 -1.269 . . . . 6.31 113.289 177.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.08 -65.03 0.71 Allowed 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 118.148 -1.421 . . . . 2.08 114.56 -156.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -88.41 -80.21 0.29 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 119.279 -0.968 . . . . 3.48 112.774 -162.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.34 170.05 29.62 Favored Glycine 0 C--N 1.34 0.774 0 C-N-CA 128.802 3.096 . . . . 2.91 110.834 148.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 61.29 87.58 0.09 Allowed 'General case' 0 C--O 1.241 0.622 0 N-CA-C 112.283 0.475 . . . . 5.76 112.283 140.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -74.83 52.72 0.55 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 125.631 1.572 . . . . 4.43 110.833 174.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -161.94 -58.74 0.05 OUTLIER 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 107.842 -1.17 . . . . 3.92 107.842 -172.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 17.1 m -96.66 142.27 28.9 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 124.135 0.974 . . . . 3.55 110.486 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -83.18 131.96 35.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.313 1.045 . . . . 3.28 109.058 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 1.3 p -114.8 174.44 5.97 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.848 1.259 . . . . 3.51 108.724 171.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.81 51.23 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.338 0.087 0 O-C-N 121.255 -0.903 . . . . 3.37 111.143 -170.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -155.2 53.74 0.63 Allowed 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 105.416 -2.068 . . . . 2.03 105.416 145.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -149.24 -54.45 0.17 Allowed 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 130.683 3.593 . . . . 2.01 104.527 173.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.48 -55.11 28.05 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.174 -0.921 . . . . 3.69 109.192 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 42.5 tttt -61.21 -41.73 97.36 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 120.296 -0.561 . . . . 3.92 111.118 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 83.4 mt-10 -51.41 -40.39 59.22 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 118.134 0.425 . . . . 3.11 111.587 177.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 10.2 tt -67.98 -47.3 68.94 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 109.15 -0.685 . . . . 2.83 109.15 -175.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.4 m -68.52 -47.82 75.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 109.873 -0.417 . . . . 2.18 109.873 -176.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 55.8 m -60.29 -55.26 35.83 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.381 1.072 . . . . 2.16 111.501 178.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -79.02 -58.81 3.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 118.25 0.477 . . . . 2.66 110.52 -171.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -80.98 -50.67 9.41 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 121.203 0.525 . . . . 2.94 110.387 -166.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.79 -16.93 0.23 Allowed Pre-proline 0 CA--C 1.543 0.702 0 N-CA-C 120.158 3.392 . . . . 3.15 120.158 -163.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -39.91 -50.69 3.26 Favored 'Trans proline' 0 CA--C 1.532 0.386 0 C-N-CA 125.038 3.825 . . . . 3.13 116.841 -134.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 13.2 t-160 -66.46 -30.94 71.39 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.968 0.729 . . . . 3.11 112.968 -172.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 29.2 tp -67.64 -73.49 0.14 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.573 0.624 . . . . 2.08 110.096 -170.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 60.6 mt -79.42 78.96 5.91 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 108.218 -1.03 . . . . 2.07 108.218 170.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.18 169.91 0.76 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.67 -0.695 . . . . 5.58 110.243 167.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 66.85 40.03 3.23 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.233 1.413 . . . . 4.76 109.602 -167.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 27.3 m -59.78 -24.3 28.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 C-N-CA 124.188 0.995 . . . . 2.97 111.854 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.6 -67.03 2.28 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 109.408 -1.477 . . . . 2.87 109.408 171.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.8 m -72.02 61.73 0.44 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 127.032 2.133 . . . . 3.83 111.292 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -80.9 -37.62 29.39 Favored 'General case' 0 N--CA 1.439 -1.019 0 C-N-CA 124.449 1.1 . . . . 1.87 109.178 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -54.63 -49.76 69.75 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.55 0.74 . . . . 3.53 111.342 -175.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.63 -38.39 81.22 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 121.872 -0.517 . . . . 4.12 111.348 176.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.23 -54.13 48.05 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.352 0.661 . . . . 4.71 109.392 176.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -52.75 -52.68 55.44 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 126.321 1.848 . . . . 2.36 110.136 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 77.3 mttt -58.33 -45.96 87.1 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.183 0.593 . . . . 5.17 110.358 178.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 12.3 t -57.96 -44.72 87.2 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.095 0.558 . . . . 2.49 110.551 177.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 22.9 mt -63.42 -45.03 92.83 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.136 0.575 . . . . 2.78 111.356 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.328 16.1 t0 -51.66 -8.35 0.06 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 118.799 2.888 . . . . 2.11 118.799 -169.202 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 26.9 m -34.07 -19.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.539 1 C-N-CA 131.982 4.113 . . . . 2.63 119.276 -137.099 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -36.62 62.79 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 120.366 1.439 . . . . 3.95 109.656 160.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 66.62 63.51 0.5 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 125.586 1.555 . . . . 4.42 109.268 -171.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 30.0 p30 -120.35 -16.13 8.48 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.859 2.063 . . . . 2.45 112.668 -175.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.5 m 70.87 22.37 4.74 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.247 1.819 . . . . 3.31 113.093 -176.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -128.5 112.44 14.34 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.16 -1.793 . . . . 3.37 106.16 166.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -81.02 110.57 16.68 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 106.403 -1.703 . . . . 2.57 106.403 174.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 10.5 tppt? -79.0 168.66 19.37 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.518 -0.919 . . . . 4.47 108.518 -173.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 20.0 p90 -91.26 50.42 1.75 Allowed 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.999 -0.438 . . . . 6.7 110.314 174.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -156.7 48.43 0.46 Allowed 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 106.661 -1.607 . . . . 2.6 106.661 119.158 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -94.65 -62.12 1.38 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.897 1.679 . . . . 2.62 109.078 142.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -44.91 -48.73 11.26 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 125.883 1.673 . . . . 4.14 110.078 -173.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.675 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 4.1 t-105 -44.74 -37.13 3.55 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.627 -1.178 . . . . 5.81 111.76 -178.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 1.7 ttt85 -40.11 -47.26 2.32 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 119.987 1.267 . . . . 7.73 110.864 174.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 15.8 tp -44.19 -47.07 9.16 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.637 0.775 . . . . 2.07 110.599 -178.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 53.9 mt -62.76 -34.0 63.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.988 0.899 . . . . 2.68 109.559 -173.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.572 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -72.53 -42.81 46.86 Favored Glycine 0 CA--C 1.487 -1.7 0 N-CA-C 109.544 -1.423 . . . . 1.85 109.544 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.262 5.0 mm-40 -67.07 -48.41 68.34 Favored 'General case' 0 N--CA 1.421 -1.882 0 N-CA-C 105.535 -2.024 . . . . 3.29 105.535 -175.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 7.7 mt -42.9 -58.07 2.55 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 121.262 1.846 . . . . 3.47 111.896 166.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.42 -23.46 49.62 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.618 0.767 . . . . 2.02 112.536 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.01 -57.21 3.74 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.453 1.101 . . . . 3.18 110.581 170.47 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -57.53 -28.03 63.13 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 129.01 2.924 . . . . 2.79 111.68 -168.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 2.9 tt -49.58 -44.17 18.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 O-C-N 122.014 -0.429 . . . . 2.02 110.662 168.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -85.56 -61.65 1.71 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.62 1.568 . . . . 4.88 113.67 167.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 35.3 tttm . . . . . 0 CA--C 1.534 0.329 0 C-N-CA 125.75 1.62 . . . . 8.05 110.947 -173.652 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 . . . . . 0 N--CA 1.45 -0.426 0 CA-C-O 118.995 -0.526 . . . . 4.66 110.565 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.51 113.1 3.63 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 122.346 2.031 . . . . 2.83 109.269 178.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 61.5 mt -69.23 164.2 23.25 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.076 0.55 . . . . 2.51 110.312 177.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.4 t -76.63 162.21 27.93 Favored 'General case' 0 CA--C 1.528 0.109 0 N-CA-C 108.992 -0.744 . . . . 2.25 108.992 176.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.91 -53.28 59.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.171 0.988 . . . . 3.18 111.216 -169.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.5 mt -62.77 -49.87 73.29 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 118.046 -0.978 . . . . 2.46 112.563 178.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -51.1 -54.46 24.81 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 119.687 1.13 . . . . 2.15 110.683 175.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -49.26 -56.18 10.22 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.066 1.347 . . . . 3.84 110.161 174.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.3 t -53.5 -46.97 70.24 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.999 0.92 . . . . 3.2 111.392 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.311 2.8 pp -70.04 -35.49 64.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 O-C-N 120.966 -1.084 . . . . 1.92 111.42 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -59.14 -51.84 68.26 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.2 0.909 . . . . 2.79 109.977 176.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . 0.256 12.5 t -53.26 -38.94 63.49 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 121.801 -0.562 . . . . 2.61 112.177 -176.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 m -72.92 -39.35 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 O-C-N 120.461 -1.399 . . . . 2.36 111.226 175.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.4 t -55.22 -47.3 77.76 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.112 0 CA-C-N 118.252 0.478 . . . . 1.8 110.184 175.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . 0.253 10.2 t -62.11 -48.57 79.56 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 117.937 -1.03 . . . . 2.24 111.334 178.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 16.4 m -49.92 -52.26 34.6 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 120.395 1.452 . . . . 2.98 110.803 173.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -50.92 -60.0 3.55 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.228 0.611 . . . . 4.2 110.163 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -61.89 -45.16 94.95 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.96 0.504 . . . . 4.44 111.384 -170.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -65.3 -19.22 65.86 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 119.252 -0.404 . . . . 3.08 111.902 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -81.54 -44.11 17.78 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 118.401 0.546 . . . . 4.39 111.899 164.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.17 -33.11 67.12 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.453 1.501 . . . . 1.54 111.655 -168.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 34.2 ptt180 -62.73 -34.96 78.27 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.545 1.138 . . . . 5.3 112.439 177.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -40.86 -64.69 0.5 Allowed 'General case' 0 C--N 1.344 0.365 0 CA-C-O 122.139 0.971 . . . . 2.56 113.255 -160.039 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -106.08 81.93 1.7 Allowed 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 103.889 -2.634 . . . . 3.16 103.889 -178.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 48.06 -172.94 0.04 OUTLIER Glycine 0 CA--C 1.53 1.012 0 C-N-CA 126.835 2.16 . . . . 2.68 114.518 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 34.73 88.54 0.01 OUTLIER 'General case' 0 C--O 1.235 0.333 0 C-N-CA 127.267 2.227 . . . . 5.57 112.367 169.05 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -75.97 57.84 1.11 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.955 1.302 . . . . 4.84 112.784 -166.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -163.53 -44.79 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 126.646 1.979 . . . . 4.37 106.906 174.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 m -82.08 113.39 19.91 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 125.479 1.512 . . . . 2.71 109.59 -179.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.8 mp -84.33 136.62 33.82 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.149 -0.478 . . . . 3.8 110.05 168.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.9 t -81.2 174.59 11.4 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.519 1.928 . . . . 3.91 108.625 172.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 11.5 p -62.21 -43.01 97.4 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 O-C-N 122.079 -0.388 . . . . 3.04 110.01 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -67.58 -57.29 6.72 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 118.182 -0.913 . . . . 2.05 109.113 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -37.6 -49.16 1.08 Allowed 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.361 1.464 . . . . 1.83 112.072 169.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -60.03 -59.99 4.53 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.967 -0.458 . . . . 4.79 110.597 174.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -52.92 -40.67 63.78 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.281 0.491 . . . . 4.0 111.671 -176.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -51.82 -39.97 59.68 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 123.968 0.907 . . . . 3.28 110.574 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 57.5 tp -68.58 -45.8 71.08 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 119.543 1.065 . . . . 3.37 109.435 -176.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 35.6 m -69.62 -28.1 36.27 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.123 0 CA-C-O 120.99 0.424 . . . . 2.37 110.4 -175.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 63.7 m -81.09 -40.23 24.42 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 124.383 1.073 . . . . 2.87 111.105 177.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -82.78 -55.86 4.18 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 124.176 0.991 . . . . 2.85 110.067 -172.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.2 mp0 -96.71 -146.51 0.29 Allowed 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 107.616 -1.253 . . . . 4.21 107.616 169.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.0 mp 38.63 44.95 0.68 Allowed Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 126.243 1.817 . . . . 3.53 113.15 -167.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -59.93 -32.86 95.77 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 122.55 2.167 . . . . 1.92 111.966 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.94 -6.33 3.11 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 114.485 1.291 . . . . 4.15 114.485 179.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . 2.134 10.8 mp -2.05 -144.83 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 120.989 3.7 . . . . 3.08 120.989 129.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.454 ' C ' ' H ' ' A' ' 52' ' ' ASP . 6.2 mt -82.73 88.13 6.74 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 113.33 -1.759 . . . . 2.69 107.714 174.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.73 18.88 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.899 1.444 . . . . 5.78 114.899 177.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.454 ' H ' ' C ' ' A' ' 50' ' ' LEU . 64.9 m-20 -115.57 20.67 14.55 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 128.192 2.597 . . . . 5.67 109.289 -172.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.0 m -53.33 -15.18 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 126.681 1.992 . . . . 4.01 114.833 -172.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -56.33 -51.85 53.47 Favored Glycine 0 CA--C 1.529 0.936 0 N-CA-C 110.048 -1.221 . . . . 2.57 110.048 170.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.8 t -84.92 60.45 6.23 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 122.361 1.077 . . . . 3.76 109.826 -173.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -77.38 -36.5 53.46 Favored 'General case' 0 N--CA 1.438 -1.057 0 O-C-N 121.628 -0.67 . . . . 2.34 109.79 -176.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -59.61 -46.7 88.19 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.783 0.719 . . . . 4.67 110.496 178.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -45.04 -57.92 3.53 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.576 1.15 . . . . 3.33 109.413 170.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 6.0 mmpt? -60.28 -45.15 94.32 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 118.735 -0.65 . . . . 6.3 110.78 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -51.34 -54.94 21.4 Favored 'General case' 0 C--N 1.334 -0.087 0 CA-C-N 119.428 1.013 . . . . 2.46 109.59 178.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 44.6 mtmt -57.57 -37.64 73.48 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 122.584 0.354 . . . . 3.76 111.001 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 14.5 m -62.9 -47.75 81.95 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.863 -0.523 . . . . 2.72 112.165 175.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.2 mp -66.77 -60.24 2.86 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 121.27 -0.894 . . . . 3.36 109.32 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -75.98 74.7 2.88 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.175 1.39 . . . . 1.58 109.683 -168.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.1 m -45.55 -37.19 2.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 124.93 1.292 . . . . 2.76 113.17 -175.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 11.0 p-10 -102.37 8.18 40.28 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 113.131 0.789 . . . . 3.47 113.131 -176.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 46.81 59.14 4.14 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.76 1.624 . . . . 3.4 112.359 172.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 40.5 p30 -108.69 -9.57 15.25 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.36 1.464 . . . . 2.0 111.76 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.2 m 62.47 25.7 15.31 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.173 0.989 . . . . 2.04 111.9 -170.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -122.81 100.91 7.15 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 126.194 1.798 . . . . 3.23 107.57 169.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -86.49 79.97 8.79 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 105.926 -1.879 . . . . 1.93 105.926 170.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -69.24 171.78 7.94 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 122.776 0.43 . . . . 4.89 110.706 174.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -37.92 -61.15 0.67 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.563 1.545 . . . . 6.59 112.842 -167.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -68.39 -44.5 74.97 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.582 -0.699 . . . . 3.72 111.432 -177.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -57.53 -33.15 67.79 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.209 0.603 . . . . 2.57 111.203 178.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -78.67 -48.19 15.51 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 118.102 0.41 . . . . 4.47 110.363 175.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.421 ' CD1' ' HA2' ' B' ' 81' ' ' GLY . 44.5 t-105 -48.54 -29.09 3.85 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.823 0.849 . . . . 5.71 111.72 176.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 14.4 mmm180 -37.23 -56.62 0.93 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.347 1.059 . . . . 4.47 110.859 166.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 26.0 tp -49.07 -43.33 40.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 123.905 0.882 . . . . 2.08 111.219 -179.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mp -80.72 -29.64 11.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 107.925 -1.139 . . . . 2.94 107.925 -168.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -56.22 -51.11 58.04 Favored Glycine 0 N--CA 1.439 -1.141 0 N-CA-C 110.259 -1.137 . . . . 1.16 110.259 164.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -63.22 -33.93 76.57 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-O 118.596 -0.716 . . . . 2.43 110.456 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.0 mp -57.84 -55.58 33.04 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 119.793 1.179 . . . . 3.69 109.708 173.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.12 -48.25 64.91 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.346 0.593 . . . . 2.04 109.914 177.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -55.65 -34.65 65.15 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 117.849 -1.072 . . . . 3.38 112.271 174.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -78.91 -14.22 59.35 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 127.406 2.283 . . . . 2.13 112.624 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -91.5 -26.72 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 N-CA-C 113.773 1.027 . . . . 2.75 113.773 157.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -65.5 0.75 Allowed 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 119.851 1.205 . . . . 5.46 111.579 175.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt . . . . . 0 C--O 1.214 -0.784 0 N-CA-C 104.106 -2.553 . . . . 4.45 104.106 145.345 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . 2.316 0.2 OUTLIER . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 112.751 0.648 . . . . 3.62 112.751 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 1.1 t -118.51 -109.68 0.35 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.738 2.015 . . . . 2.59 108.001 178.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -105.75 -68.72 0.85 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 126.351 1.86 . . . . 5.12 107.483 172.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 3.7 mp -65.79 -51.09 61.89 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.807 -0.558 . . . . 4.24 110.032 -177.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -52.25 -39.58 60.52 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 119.22 -0.419 . . . . 3.84 111.375 173.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.57 -56.09 20.12 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.179 -0.675 . . . . 4.95 109.179 172.725 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 35.9 p -71.35 -39.63 71.19 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 119.926 -0.71 . . . . 2.49 110.822 -167.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.3 pp -69.67 -35.54 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 O-C-N 121.261 -0.899 . . . . 2.35 109.863 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -60.83 -55.46 32.86 Favored 'General case' 0 C--N 1.342 0.249 0 CA-C-N 119.199 0.909 . . . . 3.1 109.615 171.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.4 t -55.43 -38.84 69.5 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-O 121.911 0.862 . . . . 2.02 111.564 -170.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 17.0 m -72.89 -39.17 58.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 O-C-N 120.667 -1.271 . . . . 2.4 111.402 174.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 45.2 t -60.85 -44.1 96.98 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 119.447 1.021 . . . . 2.45 111.389 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 10.1 t -62.46 -45.92 90.84 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.725 1.148 . . . . 2.27 110.257 177.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 60.3 m -52.93 -55.18 25.31 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.345 0.593 . . . . 2.36 109.73 174.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -49.99 -49.83 49.19 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.611 1.164 . . . . 5.36 111.101 175.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -62.18 -54.31 42.9 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.889 0.875 . . . . 3.73 110.649 -175.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 15.0 t -62.13 -29.32 70.26 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 119.555 -0.858 . . . . 4.03 110.797 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -63.4 -54.02 43.29 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 118.4 0.545 . . . . 4.44 111.092 167.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.57 -30.28 62.97 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 126.336 1.854 . . . . 2.68 110.407 -172.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -54.85 -26.88 38.3 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.01 0.924 . . . . 4.84 112.657 176.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.419 ' HB3' ' CG ' ' B' ' 37' ' ' GLU . 11.2 tt0 -62.87 -68.64 0.32 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 114.063 1.134 . . . . 5.18 114.063 -157.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . 0.445 ' CD ' ' H ' ' B' ' 28' ' ' GLY . 0.0 OUTLIER -90.2 -74.91 0.47 Allowed 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 115.026 1.491 . . . . 5.07 115.026 -163.245 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . 0.445 ' H ' ' CD ' ' B' ' 27' ' ' GLU . . . -92.08 170.1 32.76 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 127.943 2.687 . . . . 3.22 109.779 154.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 38.41 102.09 0.0 OUTLIER 'General case' 0 C--O 1.24 0.58 0 C-N-CA 125.63 1.572 . . . . 4.67 114.792 142.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -71.09 49.73 0.14 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.631 1.572 . . . . 4.39 112.578 176.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -153.84 -53.67 0.1 Allowed 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.072 1.349 . . . . 3.72 108.17 -172.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.4 p -104.78 157.58 17.1 Favored 'General case' 0 C--O 1.244 0.799 0 C-N-CA 124.219 1.007 . . . . 2.75 113.305 -177.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -111.03 151.34 28.13 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 127.86 2.464 . . . . 3.4 109.39 -173.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 8.2 t -149.95 178.18 9.16 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.378 1.071 . . . . 3.83 108.323 169.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 9.2 p -83.89 53.09 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-O 121.865 0.84 . . . . 3.76 111.127 -171.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.25 56.12 0.51 Allowed 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 105.618 -1.993 . . . . 2.91 105.618 150.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . 0.419 ' CG ' ' HB3' ' B' ' 26' ' ' GLN . 1.3 tt0 -173.78 -59.92 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 104.037 -2.579 . . . . 1.83 104.037 -172.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -57.55 -56.46 21.6 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.33 -0.85 . . . . 3.33 109.52 172.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 16.3 ttmt -57.05 -37.8 72.31 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 122.074 -0.391 . . . . 3.93 111.179 -177.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.74 -30.03 71.12 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.449 -0.782 . . . . 2.93 111.683 177.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.25 -52.54 63.32 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 107.978 -1.119 . . . . 3.64 107.978 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 2.6 m -68.17 -42.55 84.9 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 115.125 -0.943 . . . . 1.74 109.969 -174.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 96.6 m -54.08 -54.16 43.24 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.941 -0.572 . . . . 1.98 110.054 173.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -82.15 -62.78 1.53 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.796 1.035 . . . . 2.72 113.796 -167.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -83.19 -36.13 24.91 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 115.932 1.827 . . . . 4.96 115.932 -163.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -46.67 -38.82 12.7 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 114.027 1.121 . . . . 2.96 114.027 -159.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -64.04 -20.87 68.21 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 C-N-CA 122.191 -2.004 . . . . 2.82 109.978 -62.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -93.09 -56.27 3.03 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.058 0.943 . . . . 3.87 110.986 -169.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . 0.428 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 7.4 tp -30.56 -72.12 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.133 1.773 . . . . 2.07 113.34 -167.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 79.7 mt -90.24 128.74 36.48 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 106.464 -1.68 . . . . 2.49 106.464 169.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.43 -5.28 10.81 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.797 1.239 . . . . 7.93 111.835 -173.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -88.74 16.61 6.51 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 128.168 2.587 . . . . 4.75 111.201 -177.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 14.4 m -52.42 -28.09 11.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 125.259 1.424 . . . . 2.42 111.404 177.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.08 -35.13 8.29 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 124.308 0.956 . . . . 3.39 112.657 172.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.6 t -124.77 47.83 2.07 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 117.817 0.808 . . . . 3.8 109.23 171.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -45.63 -39.69 8.06 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.159 0.984 . . . . 2.24 110.134 172.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -58.38 -25.62 62.28 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.196 0.998 . . . . 4.27 111.854 -174.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -58.53 -54.24 49.22 Favored 'General case' 0 C--N 1.344 0.332 0 O-C-N 121.326 -0.859 . . . . 2.87 109.399 165.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -49.29 75.49 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 108.421 -0.955 . . . . 3.92 108.421 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 16.3 tpt -46.23 -60.24 2.43 Favored 'General case' 0 N--CA 1.462 0.13 0 C-N-CA 123.635 0.774 . . . . 3.19 108.953 177.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -57.46 -42.15 81.96 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 122.516 0.326 . . . . 4.63 111.367 -178.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.5 m -65.48 -34.83 79.19 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.116 0.566 . . . . 3.36 112.442 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 39.2 mt -80.02 -44.91 19.31 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.884 1.274 . . . . 2.77 109.645 -176.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -49.35 -8.76 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 128.346 2.658 . . . . 2.32 117.17 -175.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 19.8 m -33.65 -28.27 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 131.024 3.73 . . . . 2.5 118.923 -124.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -67.4 -20.62 65.56 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 120.724 1.602 . . . . 3.97 110.977 170.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 69.85 65.52 0.24 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.059 1.344 . . . . 4.13 110.617 172.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 48.9 p30 -119.56 -7.39 10.13 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.37 1.868 . . . . 2.82 112.321 -176.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 14.8 m 72.73 18.61 4.17 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.337 1.855 . . . . 3.07 112.673 -174.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -126.11 110.28 13.33 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.362 1.465 . . . . 4.12 108.798 170.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -80.44 104.08 10.74 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 106.813 -1.551 . . . . 2.52 106.813 170.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -91.21 166.64 12.84 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.533 1.933 . . . . 4.87 110.023 -176.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -89.73 56.7 3.61 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.636 -0.665 . . . . 7.12 111.525 179.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -158.52 49.26 0.37 Allowed 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 106.861 -1.533 . . . . 2.99 106.861 109.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 77.7 mt-10 -95.58 -61.32 1.48 Allowed 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.906 2.083 . . . . 2.56 108.843 145.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -48.13 -38.34 17.65 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 125.779 1.632 . . . . 4.05 110.968 -174.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . . . . . . . . . 23.0 t90 -39.75 -41.94 1.18 Allowed 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 124.228 0.955 . . . . 5.96 111.525 176.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 31.8 mmt180 -49.3 -30.28 7.16 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-O 117.666 -1.159 . . . . 6.18 113.095 179.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 18.3 tp -57.66 -44.43 85.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 121.776 2.08 . . . . 2.22 111.184 174.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 1.4 mt -80.94 -26.94 10.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 C-N-CA 124.2 1.0 . . . . 2.66 108.832 178.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.421 ' HA2' ' CD1' ' A' ' 77' ' ' TRP . . . -37.56 -57.02 1.55 Allowed Glycine 0 C--N 1.347 1.159 0 C-N-CA 127.7 2.572 . . . . 2.73 110.189 159.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -82.46 -63.78 1.31 Allowed 'General case' 0 N--CA 1.421 -1.895 0 CA-C-N 111.644 -2.278 . . . . 2.49 108.252 -172.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.428 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 1.7 mp -38.49 -59.6 0.89 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 120.45 1.477 . . . . 3.24 113.428 -169.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.34 -36.1 65.92 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 123.148 0.579 . . . . 2.18 111.365 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 22.0 ttpp -80.69 -39.9 26.35 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.031 0.933 . . . . 2.82 112.329 175.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.45 -25.61 66.13 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 119.757 1.162 . . . . 3.19 112.266 -177.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 1.5 tp -44.1 -44.44 2.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 N-CA-C 109.566 -0.531 . . . . 2.23 109.566 167.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 -85.71 -60.15 2.1 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.805 2.042 . . . . 5.76 113.198 171.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 29.0 tttm . . . . . 0 CA--C 1.531 0.229 0 C-N-CA 125.616 1.566 . . . . 7.28 111.574 -166.9 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 . . . . . 0 N--CA 1.446 -0.625 0 CA-C-O 118.712 -0.661 . . . . 4.92 109.685 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -79.53 98.87 1.18 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.559 2.172 . . . . 2.98 109.575 -177.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.61 177.47 7.47 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.586 -0.524 . . . . 3.54 109.586 170.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.1 m -58.05 147.07 30.75 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.394 -0.816 . . . . 4.73 110.778 -173.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -53.96 -49.38 68.89 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.526 -0.734 . . . . 2.7 110.285 175.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.7 mt -59.22 -39.87 84.07 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 117.98 -1.009 . . . . 2.8 112.891 172.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -54.31 -50.27 67.73 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 120.583 1.538 . . . . 2.62 111.465 170.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.1 mm-40 -50.48 -53.33 30.66 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.322 -0.622 . . . . 4.15 109.322 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.9 p -67.14 -43.53 82.12 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 121.746 -0.596 . . . . 2.03 111.932 -174.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.276 1.8 pp -62.2 -41.04 89.86 Favored 'Isoleucine or valine' 0 C--N 1.342 0.242 0 CA-C-N 119.961 1.255 . . . . 1.95 110.587 176.08 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -58.36 -47.48 83.68 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.285 0.948 . . . . 3.22 110.388 174.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -59.53 -35.32 73.97 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.626 0.602 . . . . 2.07 112.626 -175.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.0 m -80.16 -38.83 18.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 O-C-N 120.541 -1.35 . . . . 1.79 111.187 173.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.5 t -57.95 -44.12 86.09 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 118.708 0.685 . . . . 1.65 110.528 178.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.6 t -61.08 -46.69 89.62 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.375 -0.828 . . . . 1.64 110.075 177.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.7 m -56.68 -49.9 73.73 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.687 0.676 . . . . 2.07 109.778 177.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -47.83 -57.45 5.62 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.986 0.914 . . . . 4.58 110.951 170.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -67.26 -46.83 72.52 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.124 0.57 . . . . 3.89 111.123 -168.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 40.1 p -56.67 -28.49 60.81 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.577 0.751 . . . . 3.33 111.517 176.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -75.49 -55.18 5.94 Favored 'General case' 0 C--O 1.222 -0.384 0 C-N-CA 123.339 0.655 . . . . 3.78 111.969 165.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.61 -28.37 54.82 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 126.907 2.083 . . . . 1.74 112.173 -169.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -74.35 -18.79 60.63 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.563 1.145 . . . . 4.21 113.083 -179.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.66 -67.93 0.22 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.204 0.911 . . . . 3.69 112.516 -175.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -108.48 172.69 6.7 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 126.861 2.064 . . . . 2.6 106.703 -174.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -9.35 116.73 0.01 OUTLIER Glycine 0 CA--C 1.532 1.127 0 C-N-CA 127.481 2.467 . . . . 2.24 114.814 172.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? 64.03 107.34 0.03 OUTLIER 'General case' 0 C--O 1.239 0.529 0 C-N-CA 124.701 1.201 . . . . 5.01 113.279 171.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -65.57 58.82 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.086 0.954 . . . . 4.46 111.298 164.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -166.51 -47.91 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.788 1.635 . . . . 4.46 108.834 -171.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 13.9 p -95.85 129.2 43.16 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 125.446 1.499 . . . . 2.67 109.164 173.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.7 mp -84.11 136.24 34.08 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.018 -1.105 . . . . 3.7 108.018 161.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.1 t -80.24 170.91 15.77 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 125.097 1.359 . . . . 3.55 107.808 167.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.4 p -58.99 -41.33 82.88 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 O-C-N 121.882 -0.511 . . . . 4.04 109.872 176.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -66.33 -59.6 3.56 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 118.481 -0.771 . . . . 2.4 109.211 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -37.51 -54.16 1.14 Allowed 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 124.145 0.978 . . . . 1.92 112.048 169.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -59.88 -51.89 67.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.633 -0.258 . . . . 4.22 111.128 178.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.8 tttm -56.9 -38.96 73.55 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.568 0.622 . . . . 4.76 109.67 -176.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -66.32 -19.94 65.95 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 118.816 -0.611 . . . . 5.02 112.125 -176.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -61.52 -55.82 26.86 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-N 119.638 1.108 . . . . 3.55 108.053 169.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.0 m -71.0 -44.21 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-O 121.811 0.815 . . . . 2.71 109.605 -169.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 38.2 m -68.38 -42.2 79.45 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 124.979 1.312 . . . . 2.21 110.179 -175.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -75.79 -50.76 14.28 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.769 0.713 . . . . 2.85 110.646 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -149.45 73.23 1.18 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.314 0.506 . . . . 4.1 112.185 -173.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.8 tp -154.65 45.79 0.27 Allowed Pre-proline 0 CA--C 1.549 0.904 0 N-CA-C 112.766 0.654 . . . . 3.16 112.766 155.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -62.59 -74.58 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 124.116 3.211 . . . . 1.98 114.726 -162.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 23.0 t-160 -63.62 -24.4 67.78 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 121.47 -0.769 . . . . 5.68 111.107 -169.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.6 tp -74.2 -75.43 0.16 Allowed 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 122.617 0.367 . . . . 1.99 110.447 177.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.6 mt -95.71 65.78 2.64 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 108.636 -0.876 . . . . 3.04 108.636 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.68 -30.75 56.41 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 114.253 -1.34 . . . . 6.72 111.936 178.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -73.35 72.16 1.29 Allowed 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.988 0.899 . . . . 3.47 108.906 162.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.2 t -77.11 -6.52 9.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 127.954 2.501 . . . . 4.0 109.557 161.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.89 -69.56 1.36 Allowed Glycine 0 C--N 1.345 1.041 0 C-N-CA 124.745 1.164 . . . . 2.47 110.493 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.54 52.89 1.47 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 123.159 1.457 . . . . 5.15 109.766 -176.347 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.3 -25.61 59.57 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 126.818 2.047 . . . . 2.8 110.049 -174.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -42.32 -45.67 4.32 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 126.513 1.925 . . . . 4.6 111.576 169.158 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -45.94 -52.83 10.97 Favored 'General case' 0 C--N 1.346 0.433 0 N-CA-C 108.992 -0.744 . . . . 6.39 108.992 177.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -74.83 -63.28 1.29 Allowed 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 106.015 -1.846 . . . . 5.4 106.015 -174.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -47.5 -55.4 9.2 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 123.56 0.744 . . . . 2.7 110.369 -170.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.2 ttpp -73.22 -19.0 61.18 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 115.252 -0.885 . . . . 6.68 111.557 -169.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 44.9 m -82.81 -38.11 23.56 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.365 0.666 . . . . 2.73 112.536 166.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 72.0 mt -69.09 -51.1 42.19 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.391 1.476 . . . . 2.84 109.91 -172.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -72.74 73.35 1.09 Allowed 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.108 -1.071 . . . . 2.27 108.108 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.6 m -52.58 -40.86 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 124.222 1.009 . . . . 3.24 112.512 -170.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -88.99 -2.79 58.75 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.317 0.488 . . . . 2.94 112.317 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 58.07 55.08 5.44 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.001 1.32 . . . . 4.24 110.958 170.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 53.0 p30 -108.48 -3.24 18.31 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.667 1.587 . . . . 2.45 112.378 -177.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.8 m 80.35 0.05 1.96 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.66 1.984 . . . . 2.5 113.511 -178.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -110.4 131.23 55.23 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 119.065 0.848 . . . . 3.05 109.023 168.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -87.9 90.83 8.53 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 105.898 -1.89 . . . . 2.48 105.898 161.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.94 148.78 7.22 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.568 1.076 . . . . 4.36 108.25 169.26 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -38.78 -49.53 1.62 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.026 1.284 . . . . 6.37 113.494 178.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -66.46 -34.9 78.97 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.986 0.736 . . . . 3.58 112.986 177.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.53 -55.31 18.48 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 119.272 0.942 . . . . 2.65 109.476 172.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -45.86 -51.63 12.69 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 123.848 0.859 . . . . 4.16 109.664 175.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.68 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 2.1 t-105 -45.89 -33.56 3.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 117.41 -1.281 . . . . 5.29 112.275 178.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -40.64 -47.97 2.84 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 120.237 1.381 . . . . 6.99 110.471 171.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 28.0 tp -41.7 -50.34 4.23 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 124.528 1.131 . . . . 2.41 111.524 176.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 85.5 mt -62.51 -30.7 49.76 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 N-CA-C 108.888 -0.782 . . . . 2.8 108.888 -172.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.543 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -74.67 -44.97 24.19 Favored Glycine 0 CA--C 1.491 -1.435 0 N-CA-C 109.996 -1.242 . . . . 1.61 109.996 176.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -61.21 -31.03 70.8 Favored 'General case' 0 N--CA 1.436 -1.134 0 N-CA-C 107.752 -1.203 . . . . 2.1 107.752 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.6 mt -71.08 -56.86 5.24 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 119.266 0.939 . . . . 3.24 110.826 172.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.45 -24.75 47.63 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.963 0.905 . . . . 2.05 111.856 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -80.41 -61.01 2.11 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 126.709 2.004 . . . . 2.56 109.013 171.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -50.39 -40.92 51.13 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.978 1.311 . . . . 2.55 111.237 -176.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 10.0 tt -54.85 -34.57 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 O-C-N 120.671 -1.268 . . . . 2.16 112.345 177.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -93.07 -62.56 1.36 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.46 1.504 . . . . 5.56 108.588 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 57.3 tttp . . . . . 0 C--O 1.222 -0.377 0 C-N-CA 125.491 1.516 . . . . 4.87 108.422 168.079 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 49.3 mt . . . . . 0 CA--C 1.547 0.839 0 N-CA-C 114.338 1.236 . . . . 3.42 114.338 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 2.0 t -166.28 -111.02 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 120.944 1.702 . . . . 2.73 112.991 -166.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -125.28 -72.74 0.65 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.762 2.025 . . . . 2.35 110.434 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.9 mt -48.89 -49.51 39.42 Favored 'General case' 0 C--O 1.233 0.209 0 O-C-N 121.656 -0.653 . . . . 2.32 110.798 175.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -44.29 -52.74 7.3 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.185 0.994 . . . . 3.89 112.515 171.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -57.38 -36.81 71.72 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 119.235 0.925 . . . . 4.61 110.396 178.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 3.8 t -63.01 -50.14 71.9 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 122.947 0.499 . . . . 2.98 110.606 178.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.3 2.6 pp -61.44 -35.24 65.37 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 O-C-N 121.335 -0.853 . . . . 2.08 110.979 173.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -58.95 -57.78 11.57 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.874 -0.584 . . . . 3.11 110.145 174.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.8 t -52.49 -38.54 59.71 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.618 1.099 . . . . 2.06 111.685 -170.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 26.2 m -73.93 -39.82 51.96 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 O-C-N 121.414 -0.804 . . . . 2.02 111.492 175.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 38.4 t -57.73 -48.34 83.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 119.092 0.86 . . . . 2.2 111.015 173.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.1 t -64.38 -38.89 92.61 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.567 1.076 . . . . 2.12 110.856 177.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 85.8 m -58.16 -52.95 63.4 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 120.022 1.283 . . . . 2.02 109.666 174.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -47.26 -54.76 10.07 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.208 1.003 . . . . 4.9 110.279 173.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -55.2 -46.47 75.87 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.809 1.244 . . . . 5.17 111.329 -179.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 58.8 m -54.45 -44.27 72.36 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.403 0.681 . . . . 4.25 110.052 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -68.04 -47.3 68.76 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 120.457 -0.497 . . . . 4.39 110.959 171.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.45 -30.68 65.21 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.77 1.628 . . . . 2.19 111.467 -170.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 -19.32 64.79 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 118.153 -0.927 . . . . 4.52 112.665 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.404 ' HB3' ' CG ' ' B' ' 37' ' ' GLU . 2.3 tt0 -56.16 -68.13 0.24 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 117.902 -1.047 . . . . 4.84 111.562 -160.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -74.82 0.47 Allowed 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 114.433 1.272 . . . . 4.49 114.433 -162.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.77 160.16 27.37 Favored Glycine 0 N--CA 1.442 -0.924 0 C-N-CA 127.637 2.542 . . . . 2.31 109.906 156.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 36.56 104.95 0.0 OUTLIER 'General case' 0 C--O 1.237 0.42 0 N-CA-C 115.961 1.837 . . . . 6.22 115.961 140.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -69.01 46.13 0.06 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.866 1.266 . . . . 4.51 114.331 174.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -128.29 -58.2 1.2 Allowed 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 126.481 1.913 . . . . 3.53 106.341 168.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 2.1 p -94.15 146.49 23.95 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 125.209 1.403 . . . . 2.28 112.463 -166.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -102.95 154.27 19.39 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 126.094 1.757 . . . . 2.98 107.894 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 11.1 t -154.49 176.8 11.92 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 107.512 -1.292 . . . . 2.84 107.512 169.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 11.3 p -84.47 53.74 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-O 121.862 0.839 . . . . 3.59 111.188 -170.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.65 54.75 0.48 Allowed 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 105.895 -1.891 . . . . 2.5 105.895 149.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . 0.404 ' CG ' ' HB3' ' B' ' 26' ' ' GLN . 1.8 tt0 -172.38 -52.61 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.292 1.837 . . . . 2.22 106.532 -170.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -55.96 -57.82 10.47 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.564 -1.198 . . . . 3.27 109.771 173.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -56.22 -34.29 66.18 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.882 -0.599 . . . . 5.3 111.302 -175.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -54.31 -38.25 65.75 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.337 0.655 . . . . 3.45 110.765 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tt -67.15 -49.43 64.81 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.83 -0.804 . . . . 3.21 108.83 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 10.7 m -70.27 -35.08 61.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.295 -0.866 . . . . 1.79 110.155 -174.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 86.7 m -69.93 -50.79 38.58 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.018 0.927 . . . . 1.79 110.619 176.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -75.65 -61.52 1.89 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.565 0.746 . . . . 2.44 111.135 -169.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -80.79 -53.48 6.45 Favored 'General case' 0 C--O 1.227 -0.101 0 CA-C-O 121.343 0.592 . . . . 4.39 109.715 -175.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.61 -16.37 0.23 Allowed Pre-proline 0 CA--C 1.541 0.633 1 N-CA-C 121.857 4.021 . . . . 3.08 121.857 -144.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -48.96 -43.22 36.38 Favored 'Trans proline' 0 C--N 1.349 0.576 0 CA-C-N 123.473 2.276 . . . . 3.93 115.56 -149.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 65.4 t-80 -75.41 59.5 1.08 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.938 0.79 . . . . 3.62 110.669 173.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 10.3 tp -164.13 -91.57 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.209 1.404 . . . . 2.99 107.227 175.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 80.5 mt -78.79 86.98 4.68 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 120.968 -1.083 . . . . 2.4 109.126 171.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.33 169.51 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.386 -1.279 . . . . 7.35 111.566 153.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 88.78 5.12 0.19 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 127.446 2.299 . . . . 5.32 112.025 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 24.7 m -50.6 -34.09 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.96 0.904 . . . . 3.09 112.543 -175.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -49.83 -33.62 20.45 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.623 1.106 . . . . 3.25 112.992 175.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 8.3 t -130.71 57.15 1.74 Allowed 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.444 -0.947 . . . . 4.88 108.444 170.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -44.23 -39.18 4.25 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 124.645 1.178 . . . . 1.97 109.878 167.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -30.81 -47.68 0.1 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.331 2.653 . . . . 4.06 113.134 168.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -61.75 -52.47 64.08 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.073 0.464 . . . . 3.17 110.505 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.97 -47.97 81.37 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 107.963 -1.125 . . . . 4.4 107.963 177.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -50.15 -52.49 34.84 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 123.464 0.706 . . . . 2.59 110.295 179.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 17.8 ttmm -60.13 -44.13 95.15 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 122.305 -0.247 . . . . 3.67 110.911 178.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 16.1 m -63.22 -28.79 70.28 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.379 0.672 . . . . 3.06 112.394 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 26.2 mt -80.04 -57.15 3.77 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.353 1.061 . . . . 2.13 110.231 178.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -58.34 -9.76 1.72 Allowed 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 126.96 2.104 . . . . 1.63 116.487 -166.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 27.7 m -34.06 -19.47 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 130.869 3.668 . . . . 2.71 119.705 -140.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 7.8 p-10 -61.61 -22.71 65.48 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 121.314 1.87 . . . . 3.77 111.397 162.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 61.25 62.18 1.42 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 125.979 1.712 . . . . 3.61 111.099 175.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 38.9 p30 -105.84 -15.94 14.79 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.662 1.585 . . . . 2.25 110.954 174.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 74.31 9.42 4.45 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.366 1.466 . . . . 3.01 111.968 -173.3 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -111.03 101.93 10.43 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 105.915 -1.883 . . . . 3.65 105.915 171.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -75.66 108.93 8.84 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 106.653 -1.61 . . . . 2.11 106.653 174.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -83.98 160.28 21.07 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.436 1.894 . . . . 5.0 109.356 -176.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -86.05 52.68 2.55 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.775 -0.578 . . . . 5.42 111.933 172.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -159.37 48.65 0.31 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.881 -1.155 . . . . 2.72 107.881 114.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -93.31 -61.72 1.51 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.685 1.594 . . . . 2.15 107.779 142.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -48.54 -46.05 38.28 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 125.816 1.646 . . . . 4.05 111.011 -175.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.68 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 50.1 t90 -49.79 -36.48 26.41 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 123.883 0.74 . . . . 4.81 112.455 -169.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -42.24 -40.1 2.3 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.969 0.908 . . . . 5.21 111.91 173.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 10.6 tp -53.59 -45.28 69.93 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.212 1.005 . . . . 2.0 111.888 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 59.2 mt -64.3 -31.26 52.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 N-CA-C 107.211 -1.403 . . . . 2.37 107.211 178.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.559 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -64.59 -48.29 74.56 Favored Glycine 0 CA--C 1.492 -1.398 0 C-N-CA 125.894 1.711 . . . . 1.59 112.079 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -66.59 -62.72 1.31 Allowed 'General case' 0 N--CA 1.425 -1.708 0 CA-C-O 117.294 -1.336 . . . . 2.39 107.648 177.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 3.4 pp -54.47 -35.29 62.9 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 120.48 1.491 . . . . 2.96 113.041 -175.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.69 -61.63 2.38 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.347 0.522 . . . . 2.29 110.435 170.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -65.96 -31.95 73.16 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 117.763 -1.113 . . . . 2.75 111.79 -171.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -42.73 -38.09 1.97 Allowed 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 128.335 2.654 . . . . 2.74 111.226 175.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 2.7 tt -50.56 -40.49 19.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 122.622 0.369 . . . . 2.08 110.216 177.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.4 -59.51 2.36 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.983 2.113 . . . . 6.44 112.738 166.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 14.1 tttt . . . . . 0 CA--C 1.535 0.39 0 C-N-CA 129.247 3.019 . . . . 7.54 111.672 -172.022 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 . . . . . 0 N--CA 1.45 -0.427 0 N-CA-C 110.701 -0.111 . . . . 5.36 110.701 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.24 103.62 1.43 Allowed 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.761 2.308 . . . . 3.02 109.128 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -61.41 152.82 28.67 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 108.124 -1.065 . . . . 2.35 108.124 169.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.4 t -71.25 173.51 7.64 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 119.867 -0.733 . . . . 2.1 109.564 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -65.45 -59.76 3.67 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 121.536 -0.728 . . . . 3.01 110.101 -171.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.6 mp -55.33 -42.26 73.55 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 121.628 -0.67 . . . . 2.51 110.188 -176.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -53.25 -54.35 37.5 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.733 2.013 . . . . 2.72 111.655 171.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.03 -49.94 70.31 Favored 'General case' 0 C--N 1.341 0.204 0 N-CA-C 108.877 -0.786 . . . . 5.4 108.877 178.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.1 m -65.6 -46.85 77.78 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 111.765 0.283 . . . . 2.92 111.765 -175.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 pp -65.51 -34.77 72.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 O-C-N 120.969 -1.082 . . . . 2.15 108.878 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -60.3 -55.0 38.99 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.864 0.757 . . . . 2.99 109.351 170.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -51.53 -40.1 58.99 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.857 0.863 . . . . 2.01 111.686 -174.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 m -74.8 -41.18 47.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 O-C-N 120.971 -1.081 . . . . 2.02 111.4 173.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 40.2 t -57.53 -48.24 83.45 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 119.588 1.085 . . . . 1.95 111.535 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -59.32 -43.1 92.73 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 119.666 1.121 . . . . 1.76 110.455 178.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 60.1 m -59.22 -54.71 43.78 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.179 0.514 . . . . 1.82 109.78 176.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -44.15 -52.15 7.53 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.994 1.318 . . . . 4.24 110.676 171.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 26.9 t80 -66.2 -49.35 67.6 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.908 1.283 . . . . 4.04 110.691 -171.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 t -62.91 -36.95 85.07 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 110.093 -0.336 . . . . 2.77 110.093 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -64.52 -48.17 76.11 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 118.539 0.608 . . . . 3.88 111.236 169.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -52.76 -35.37 56.25 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 125.235 1.414 . . . . 1.99 110.998 -171.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -59.16 -34.29 71.93 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 126.427 1.891 . . . . 6.37 112.818 177.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -46.17 -61.63 1.69 Allowed 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.451 1.023 . . . . 2.34 112.738 -167.054 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -104.92 114.02 27.97 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 128.524 2.73 . . . . 2.92 106.375 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 40.17 99.99 0.01 OUTLIER Glycine 0 CA--C 1.533 1.204 0 C-N-CA 126.36 1.933 . . . . 1.81 116.432 162.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 72.93 106.47 0.07 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.554 0.742 . . . . 5.46 112.899 168.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.0 pttt -66.59 18.78 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 115.913 1.82 . . . . 5.59 115.913 178.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.3 p-10 -89.16 -34.32 16.74 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.816 1.246 . . . . 4.26 109.53 162.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.7 p -83.86 128.6 34.65 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.471 1.109 . . . . 3.7 110.834 -171.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -86.09 123.6 31.58 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 107.338 -1.356 . . . . 2.92 107.338 151.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.1 m -109.53 176.05 5.22 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 126.318 1.847 . . . . 3.71 109.074 -171.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 71.4 t -63.69 -49.65 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 O-C-N 121.814 -0.554 . . . . 3.95 111.519 -167.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -70.12 -48.89 55.65 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.272 -1.01 . . . . 3.06 108.272 -176.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -42.67 -53.54 4.44 Favored 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 124.672 1.189 . . . . 1.91 112.343 173.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.01 -56.05 14.41 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.184 -0.673 . . . . 3.77 109.184 176.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 30.4 ttmt -58.61 -39.1 79.49 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 120.283 -0.567 . . . . 3.87 111.766 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -54.55 -38.85 67.11 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.615 0.643 . . . . 3.2 111.755 176.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -61.07 -54.03 49.77 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 107.582 -1.266 . . . . 3.42 107.582 -177.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 16.4 m -68.98 -40.88 81.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 114.581 -1.19 . . . . 2.19 109.852 -170.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 98.1 m -59.99 -51.91 67.65 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 124.197 0.999 . . . . 3.1 110.61 174.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -74.16 -57.18 4.13 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.425 0.29 . . . . 3.23 110.976 -170.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -136.43 68.11 1.44 Allowed 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.669 0.387 . . . . 4.15 111.907 -177.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.3 tp -155.9 56.32 1.28 Allowed Pre-proline 0 CA--C 1.54 0.562 0 O-C-N 121.538 -0.727 . . . . 2.67 111.062 161.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -63.34 -61.12 0.14 Allowed 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 123.835 3.023 . . . . 1.85 112.715 -170.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -84.64 -51.62 6.71 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 119.351 0.978 . . . . 4.87 110.38 -172.261 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -31.9 -62.3 0.21 Allowed 'General case' 0 C--O 1.234 0.28 0 C-N-CA 126.402 1.881 . . . . 2.63 113.506 -172.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.5 mt -125.59 54.5 1.48 Allowed 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.047 1.339 . . . . 2.37 108.399 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.75 3.6 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 116.913 2.19 . . . . 5.81 116.913 -175.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -109.04 46.3 0.99 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.543 1.537 . . . . 4.8 107.331 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.9 m -55.85 -17.52 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 C-N-CA 125.766 1.627 . . . . 3.04 112.567 -176.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -44.43 -44.91 8.22 Favored Glycine 0 CA--C 1.532 1.135 0 N-CA-C 110.912 -0.875 . . . . 1.52 110.912 167.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.7 t -91.84 31.55 1.22 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 117.213 0.507 . . . . 2.85 112.088 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -52.61 -43.75 65.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 121.419 -0.801 . . . . 2.48 109.21 168.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -39.9 -57.35 1.61 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.982 1.313 . . . . 3.55 111.565 170.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.2 tp10 -60.12 -51.33 70.05 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 116.485 -0.325 . . . . 5.26 110.253 -178.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.92 -39.88 75.28 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 118.92 -1.112 . . . . 7.21 110.628 -179.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -57.3 -57.4 12.81 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 122.848 0.459 . . . . 2.54 110.673 176.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.13 -33.48 74.56 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 120.394 -0.522 . . . . 4.75 111.218 -176.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.3 t -59.45 -50.93 72.03 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.289 1.436 . . . . 2.58 110.997 172.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.8 mp -63.76 -50.09 70.4 Favored 'General case' 0 C--O 1.239 0.547 0 O-C-N 121.385 -0.822 . . . . 2.75 111.562 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -80.07 71.5 6.8 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 121.0 -0.28 . . . . 1.72 110.478 -167.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.8 m -49.53 -40.36 14.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.644 1.177 . . . . 2.98 113.525 -174.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -82.5 -8.64 59.61 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 123.519 0.728 . . . . 2.33 112.504 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 55.92 50.39 14.03 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.766 1.626 . . . . 4.39 110.426 168.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.5 p30 -100.49 -12.46 19.3 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.766 1.626 . . . . 2.01 110.96 179.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 20.7 m 72.43 17.41 4.76 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 125.893 1.677 . . . . 2.34 111.864 -179.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -116.06 113.26 22.94 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 106.11 -1.811 . . . . 3.96 106.11 163.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.82 89.07 7.12 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 104.543 -2.391 . . . . 2.21 104.543 173.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.9 tttp -75.87 158.04 32.58 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.921 -0.77 . . . . 5.87 108.921 -176.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -38.63 -61.07 0.75 Allowed 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.099 1.148 . . . . 6.09 114.099 -163.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -69.23 -26.55 64.85 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.684 -0.635 . . . . 2.94 112.209 -177.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -68.52 -59.69 2.97 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.639 -0.874 . . . . 2.07 108.639 171.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -56.37 -38.84 71.99 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 118.786 -0.626 . . . . 4.64 111.057 -175.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.495 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 0.1 OUTLIER -38.19 -45.19 0.92 Allowed 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 116.609 -1.662 . . . . 6.68 107.85 174.75 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 48.3 mtm-85 -38.55 -44.96 1.01 Allowed 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.85 1.659 . . . . 7.05 112.529 -179.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 23.5 tp -52.05 -56.97 11.01 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 120.593 1.542 . . . . 2.02 111.75 174.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 19.1 mm -59.44 -38.97 77.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 C-N-CA 126.403 1.881 . . . . 3.27 108.245 -179.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.58 -56.88 11.7 Favored Glycine 0 N--CA 1.437 -1.245 0 N-CA-C 108.497 -1.841 . . . . 2.28 108.497 172.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -63.51 -49.67 72.62 Favored 'General case' 0 N--CA 1.438 -1.056 0 C-N-CA 125.804 1.642 . . . . 2.65 108.617 -171.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 21.5 mt -42.34 -53.53 4.14 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 119.451 1.023 . . . . 3.22 112.12 -173.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.32 -35.18 62.4 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.97 1.308 . . . . 2.04 112.665 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.4 ttpp -77.7 -51.25 10.88 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.461 -0.774 . . . . 2.93 110.233 172.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.6 mm-40 -60.99 -30.74 70.46 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.059 0.943 . . . . 4.17 112.243 -171.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 5.2 tt -56.61 -40.21 67.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 119.046 0.839 . . . . 2.4 110.736 170.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.92 -55.52 5.69 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.422 -0.955 . . . . 5.82 108.422 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 3.8 tttm . . . . . 0 N--CA 1.441 -0.904 0 C-N-CA 126.617 1.967 . . . . 4.34 109.897 -170.74 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 53.2 mt . . . . . 0 CA--C 1.536 0.442 0 N-CA-C 110.474 -0.195 . . . . 3.6 110.474 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 14.0 t -94.39 -167.98 1.76 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 124.642 1.177 . . . . 2.19 108.971 164.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -71.83 -63.74 1.07 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.598 0.759 . . . . 2.53 112.765 -169.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 28.0 mt -50.77 -51.32 51.49 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 120.62 1.554 . . . . 2.16 111.26 173.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -51.98 -41.37 62.08 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.897 2.479 . . . . 3.39 110.416 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -64.73 -58.57 5.9 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.203 1.401 . . . . 4.35 110.437 171.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 86.0 p -53.89 -36.07 62.28 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.409 -0.807 . . . . 2.19 112.292 -172.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.9 -32.95 46.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 O-C-N 121.952 -0.467 . . . . 2.27 112.185 174.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.97 -54.11 43.52 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 119.261 0.937 . . . . 3.63 109.047 170.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.2 m -38.75 -51.69 1.7 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.498 1.119 . . . . 3.6 111.663 -178.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 34.2 m -70.57 -39.46 76.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 121.098 -1.002 . . . . 1.94 111.99 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 55.6 t -57.1 -54.11 34.52 Favored 'Isoleucine or valine' 0 C--N 1.339 0.114 0 CA-C-N 118.655 0.661 . . . . 2.55 109.859 174.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -59.24 -46.42 88.53 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.47 0.577 . . . . 1.99 110.798 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 96.7 m -55.26 -51.52 66.37 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.014 -1.054 . . . . 2.17 110.627 174.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -51.47 -47.2 63.25 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.67 -0.644 . . . . 8.39 111.442 173.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -57.68 -48.36 79.76 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.586 1.154 . . . . 3.88 111.227 -179.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 81.4 p -57.27 -37.44 72.37 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.767 -0.583 . . . . 2.57 111.143 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -72.44 -40.67 66.89 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 118.145 0.43 . . . . 4.42 110.568 173.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -51.73 -37.56 51.54 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 125.868 1.667 . . . . 1.83 110.025 -176.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -55.18 -29.72 58.44 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 118.081 -0.962 . . . . 4.94 112.088 -178.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.73 -65.61 0.53 Allowed 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 114.786 1.402 . . . . 2.23 114.786 -151.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -91.02 -77.35 0.42 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 119.082 -1.047 . . . . 3.98 113.521 -166.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.71 159.27 24.68 Favored Glycine 0 C--N 1.337 0.593 0 C-N-CA 127.279 2.371 . . . . 2.48 109.86 153.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 80.4 mtt-85 49.51 102.91 0.01 OUTLIER 'General case' 0 C--O 1.242 0.706 0 N-CA-C 115.127 1.529 . . . . 4.74 115.127 142.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -67.99 32.62 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.775 2.03 . . . . 3.83 114.473 173.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -144.41 -58.47 0.37 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 106.911 -1.515 . . . . 4.12 106.911 -164.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 32.4 p -79.18 111.68 15.64 Favored 'General case' 0 N--CA 1.438 -1.042 0 N-CA-C 107.345 -1.354 . . . . 2.86 107.345 168.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -57.55 135.16 56.62 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 106.993 -1.484 . . . . 2.92 106.993 162.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 13.0 m -109.65 152.36 25.68 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.84 1.256 . . . . 3.47 108.952 -174.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 10.4 p -87.6 49.15 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 O-C-N 120.254 -1.529 . . . . 3.6 110.83 -179.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -157.75 52.71 0.46 Allowed 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 106.08 -1.822 . . . . 2.18 106.08 138.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -131.74 -49.32 0.96 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 130.963 3.705 . . . . 2.23 105.233 161.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -50.28 -57.16 8.47 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 120.506 -0.478 . . . . 4.44 110.09 171.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . 0.292 15.7 ttmt -59.73 -41.81 91.75 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-O 117.94 -1.029 . . . . 3.6 111.522 -178.413 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -50.5 -48.71 56.81 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 119.461 1.028 . . . . 3.26 110.267 173.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.97 -46.58 77.55 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.507 -0.923 . . . . 2.87 108.507 -169.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.0 m -68.93 -44.41 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 C-N-CA 120.728 -0.389 . . . . 1.75 110.294 -176.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 86.1 m -58.63 -50.27 74.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.567 0.747 . . . . 2.16 110.466 178.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -80.14 -59.65 2.63 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 123.585 0.754 . . . . 2.22 110.981 -169.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -75.54 -50.58 15.22 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 113.143 0.794 . . . . 4.42 113.143 -169.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.08 -27.91 3.57 Favored Pre-proline 0 CA--C 1.539 0.523 0 N-CA-C 115.248 1.574 . . . . 2.95 115.248 -151.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -63.56 -12.1 29.4 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 121.824 -2.157 . . . . 2.97 111.046 -68.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 35.2 t60 -113.64 -32.44 6.17 Favored 'General case' 0 C--N 1.344 0.347 0 C-N-CA 125.736 1.614 . . . . 3.72 111.373 -174.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 23.3 tp -50.77 -51.99 45.09 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.399 0.545 . . . . 2.25 110.22 -175.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 98.1 mt -99.89 140.77 33.62 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 105.694 -1.965 . . . . 2.1 105.694 153.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.0 28.29 2.13 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 126.756 2.022 . . . . 5.61 108.273 -167.192 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -142.47 32.22 1.48 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 125.858 1.663 . . . . 6.1 108.562 -156.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 11.4 m -74.7 -10.58 13.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 C-N-CA 125.599 1.56 . . . . 2.43 112.711 -173.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.91 -65.32 3.48 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 107.165 -2.374 . . . . 2.89 107.165 162.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 2.4 p -72.01 40.01 0.07 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.016 2.126 . . . . 4.29 112.724 175.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -64.26 -30.01 71.08 Favored 'General case' 0 N--CA 1.441 -0.887 0 O-C-N 120.986 -1.071 . . . . 2.15 108.205 165.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.1 -52.78 32.04 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.942 -0.551 . . . . 4.5 110.302 173.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -47.17 -59.5 3.11 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 124.023 0.929 . . . . 3.3 109.351 175.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 7.6 mmpt? -60.75 -51.38 69.57 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.047 -0.524 . . . . 5.8 109.752 -172.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.5 ttp -56.0 -47.05 78.46 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 123.259 0.624 . . . . 3.29 110.419 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -60.62 -40.8 93.2 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.738 1.215 . . . . 5.25 110.355 179.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 20.0 m -71.43 -31.21 66.95 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.868 0.867 . . . . 2.26 112.269 175.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 22.2 mt -73.04 -55.33 6.67 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.988 0.915 . . . . 2.78 109.54 179.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . 0.411 ' O ' ' N ' ' B' ' 66' ' ' ASN . 23.8 t70 -71.04 -10.45 59.77 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.628 2.371 . . . . 1.55 116.892 -161.162 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 24.7 m -33.26 -17.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 131.626 3.971 . . . . 2.65 119.36 -142.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' B' ' 64' ' ' ASP . 2.3 m120 -40.63 -43.69 1.97 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.831 1.196 . . . . 3.37 110.559 151.366 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 65.53 61.16 0.7 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.324 1.45 . . . . 3.81 109.677 -170.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 18.0 p30 -119.63 -16.45 8.83 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.059 2.144 . . . . 2.27 113.0 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 8.2 t 74.44 5.24 4.55 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.384 1.874 . . . . 4.52 114.47 -178.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -106.21 109.72 21.74 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 124.991 1.316 . . . . 3.52 107.791 166.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -90.63 89.36 7.5 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.681 0.792 . . . . 2.4 108.918 -179.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 3.3 ttpp -84.79 177.48 7.99 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 128.082 2.553 . . . . 4.27 112.08 -171.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -82.03 53.42 2.21 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.493 -1.38 . . . . 5.88 113.869 -168.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -168.19 51.62 0.05 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 124.841 2.258 . . . . 2.83 106.12 122.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -95.6 -63.25 1.18 Allowed 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 126.93 2.092 . . . . 2.13 108.815 150.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -68.8 -26.34 65.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.308 -1.315 . . . . 6.57 112.824 -165.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.504 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 0.0 OUTLIER -45.13 -50.1 11.46 Favored 'General case' 0 C--N 1.347 0.472 0 N-CA-C 107.58 -1.267 . . . . 5.86 107.58 170.7 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 75.5 mtm-85 -48.12 -36.41 13.27 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-O 117.203 -1.379 . . . . 7.41 113.402 -165.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 5.4 tp -53.63 -51.42 63.16 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 120.923 1.692 . . . . 2.13 111.299 174.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 24.5 mt -63.74 -40.18 88.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 126.045 1.738 . . . . 2.27 107.587 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -45.27 -54.79 7.04 Favored Glycine 0 N--CA 1.443 -0.85 0 N-CA-C 108.891 -1.683 . . . . 2.25 108.891 171.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -68.0 -53.71 23.97 Favored 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 125.964 1.706 . . . . 2.18 109.004 -172.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 18.3 mt -40.31 -49.18 2.74 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.18 1.392 . . . . 3.58 111.401 -177.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -47.1 -45.17 21.89 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.489 0.716 . . . . 2.4 111.687 177.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -81.06 -37.98 28.14 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.651 0.612 . . . . 2.38 112.651 172.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -65.68 -21.14 66.52 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.388 0.994 . . . . 3.3 112.508 -172.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 1.9 tp -45.33 -45.31 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 O-C-N 120.92 -1.113 . . . . 2.28 109.217 165.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.4 -54.29 5.59 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.191 0.996 . . . . 7.14 111.035 174.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 68.1 mttt . . . . . 0 C--O 1.219 -0.509 0 C-N-CA 125.454 1.502 . . . . 5.65 112.072 -171.563 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 . . . . . 0 CA--C 1.538 0.489 0 N-CA-C 108.747 -0.834 . . . . 4.35 108.747 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.77 105.48 2.09 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.407 2.071 . . . . 3.46 110.0 -173.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.72 160.71 26.14 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 108.206 -1.035 . . . . 4.1 108.206 168.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.15 154.99 32.99 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 121.056 -1.027 . . . . 3.31 110.388 -174.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -33.47 -48.29 0.25 Allowed 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 125.287 1.435 . . . . 2.48 112.297 160.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.2 mt -67.15 -45.01 78.35 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 118.257 -0.878 . . . . 2.31 110.223 -175.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -58.12 -53.35 59.24 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.519 1.527 . . . . 2.46 111.013 172.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -47.29 -60.35 2.55 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.366 1.066 . . . . 3.36 109.017 176.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.4 p -60.67 -49.12 78.79 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.732 0.642 . . . . 1.89 112.732 -177.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.254 2.4 pp -62.38 -38.79 82.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 O-C-N 120.854 -1.154 . . . . 1.67 109.99 -177.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -62.32 -48.79 78.28 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 119.736 -0.785 . . . . 3.36 110.699 173.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -55.98 -40.66 73.63 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.755 0.788 . . . . 2.12 111.652 -176.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.8 m -75.2 -36.94 38.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 O-C-N 120.573 -1.329 . . . . 1.85 111.088 176.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.4 t -56.42 -46.69 82.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 119.592 1.087 . . . . 1.69 110.648 174.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.3 t -64.76 -43.08 94.47 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.565 -0.709 . . . . 1.84 110.877 178.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.8 m -57.55 -51.99 67.25 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.487 0.585 . . . . 1.85 110.068 176.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -45.74 -56.6 5.1 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 124.052 0.941 . . . . 4.4 109.883 170.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -53.14 -51.61 61.4 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 123.441 0.696 . . . . 4.88 111.543 -175.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.9 t -60.38 -36.72 78.72 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 120.1 -0.64 . . . . 3.64 111.571 -178.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -69.92 -39.91 75.86 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 119.901 1.228 . . . . 3.74 111.096 171.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.02 -31.7 71.32 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 121.072 -1.017 . . . . 1.61 111.525 -168.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -80.02 -18.33 50.49 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 117.494 -1.241 . . . . 4.74 113.537 -178.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -45.24 -60.97 1.84 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.848 1.204 . . . . 2.31 113.787 -170.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -111.42 92.09 3.91 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 127.408 2.283 . . . . 2.93 106.116 -177.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 46.14 -168.21 0.05 OUTLIER Glycine 0 CA--C 1.527 0.821 0 C-N-CA 125.697 1.618 . . . . 1.75 112.693 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 48.7 mtm-85 27.65 91.79 0.01 OUTLIER 'General case' 0 C--O 1.24 0.574 0 C-N-CA 126.456 1.902 . . . . 7.05 112.525 166.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -79.6 53.28 1.55 Allowed 'General case' 0 C--O 1.232 0.142 0 C-N-CA 128.483 2.713 . . . . 5.27 108.662 -172.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -175.51 -60.79 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 106.945 -1.502 . . . . 4.02 106.945 -156.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.2 p -84.52 134.12 34.44 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-O 122.34 1.066 . . . . 2.93 112.141 170.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -95.55 124.59 39.65 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.857 1.263 . . . . 3.57 108.506 176.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.6 t -82.61 173.83 11.59 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.355 1.462 . . . . 3.13 109.058 173.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 32.9 m -70.21 -42.86 79.07 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 O-C-N 122.014 -0.429 . . . . 3.93 110.82 -175.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -67.45 -49.05 65.37 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 118.272 -0.871 . . . . 2.48 109.643 176.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -39.77 -50.64 2.37 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.119 1.367 . . . . 2.22 110.307 168.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -57.67 -59.11 5.69 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.861 -0.609 . . . . 3.96 110.95 175.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -52.09 -42.17 63.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.522 -0.308 . . . . 4.39 111.18 -176.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -51.89 -42.37 62.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 123.256 0.622 . . . . 3.17 111.459 177.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -63.08 -50.14 71.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 119.303 0.956 . . . . 4.01 108.788 -176.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.2 m -72.48 -32.24 41.08 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.168 0 CA-C-N 115.804 -0.635 . . . . 2.02 110.3 -172.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 92.7 m -75.42 -38.71 59.67 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.169 0.987 . . . . 2.33 110.735 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -79.86 -55.67 4.81 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.285 0.634 . . . . 2.5 110.239 -173.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -92.47 -126.74 0.09 Allowed 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.446 -0.946 . . . . 4.38 108.446 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.9 mm? 29.5 63.46 0.82 Allowed Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 127.578 2.351 . . . . 3.82 114.499 179.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -71.58 -44.59 1.0 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.602 2.202 . . . . 1.74 112.298 -179.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -146.05 61.36 1.25 Allowed 'General case' 0 C--N 1.341 0.233 0 CA-C-N 118.907 0.776 . . . . 4.44 109.956 -172.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.436 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 3.8 tp -144.33 -113.67 0.1 Allowed 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 107.726 -1.213 . . . . 2.08 107.726 -176.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 76.9 mt -59.0 162.12 4.49 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.776 0.716 . . . . 2.22 109.186 162.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.38 -159.13 0.56 Allowed 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.889 0.875 . . . . 7.17 109.211 -166.018 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 55.07 37.15 28.45 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.828 1.251 . . . . 3.77 108.866 -175.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.43 -24.42 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 C-N-CA 126.124 1.77 . . . . 4.27 112.505 -167.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.93 -53.72 40.79 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 110.298 -1.121 . . . . 2.03 110.298 171.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 34.0 t -84.17 46.63 1.22 Allowed 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.554 0.742 . . . . 2.59 110.098 -174.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -53.68 -32.54 52.12 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.07 0.948 . . . . 2.21 110.116 -176.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -38.04 -47.72 1.13 Allowed 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 127.321 2.248 . . . . 3.71 113.158 175.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -64.21 -46.24 84.72 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.861 -0.524 . . . . 4.02 109.992 -175.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.29 -52.66 63.78 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.037 -1.097 . . . . 4.53 108.037 175.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -46.52 -56.72 5.57 Favored 'General case' 0 C--O 1.225 -0.196 0 C-N-CA 123.406 0.683 . . . . 2.81 111.061 177.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -66.19 -37.57 85.92 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.103 0.411 . . . . 4.26 111.329 -176.017 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.7 t -58.64 -45.17 89.86 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.982 -0.449 . . . . 2.77 110.602 173.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 19.2 mt -70.2 -58.93 3.23 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.726 0.81 . . . . 2.57 110.417 -176.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -78.61 75.64 5.12 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 124.074 0.949 . . . . 1.88 109.057 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.5 m -51.32 -28.16 7.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 123.417 0.687 . . . . 3.49 112.184 176.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -70.08 -33.6 72.1 Favored 'General case' 0 CA--C 1.529 0.156 0 O-C-N 121.989 -0.444 . . . . 3.96 110.91 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 53.15 53.67 11.54 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.739 1.215 . . . . 4.68 109.29 -161.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -102.35 -13.18 17.42 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.429 1.891 . . . . 1.97 111.525 176.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.9 m 66.17 17.57 10.77 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.073 1.349 . . . . 2.34 112.837 -177.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -111.56 112.12 23.62 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.751 -1.574 . . . . 3.12 106.751 158.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -82.97 93.7 7.6 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 104.256 -2.498 . . . . 1.88 104.256 166.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.14 161.96 25.81 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.346 -0.983 . . . . 3.76 108.346 176.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.63 -60.54 0.95 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.57 1.148 . . . . 6.99 112.955 -169.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -69.15 -22.3 63.95 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.666 0.786 . . . . 2.13 111.68 -175.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -72.69 -56.67 4.95 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 118.448 0.567 . . . . 2.4 109.597 173.017 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -52.72 -48.77 66.44 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.301 -0.629 . . . . 4.11 109.301 178.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.475 ' NE1' ' CA ' ' B' ' 81' ' ' GLY . 58.8 t-105 -46.66 -35.87 6.45 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.693 -1.139 . . . . 6.0 111.257 -179.02 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 77.9 mtt-85 -41.47 -45.86 3.31 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 120.182 1.356 . . . . 5.35 111.568 176.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 7.9 tp -49.94 -40.8 44.76 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 122.764 0.426 . . . . 1.94 110.408 -177.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 25.7 mt -74.79 -26.14 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 N-CA-C 109.09 -0.707 . . . . 2.13 109.09 -174.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.434 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -56.37 -43.69 89.89 Favored Glycine 0 CA--C 1.501 -0.786 0 N-CA-C 109.83 -1.308 . . . . 1.28 109.83 164.453 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -80.6 -30.77 36.83 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 117.687 -1.149 . . . . 3.11 110.546 -178.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.436 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 8.6 mp -54.38 -59.86 4.12 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 122.189 2.268 . . . . 3.37 108.391 167.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.58 -53.66 51.65 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.978 0.894 . . . . 1.74 110.6 -178.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.6 ttpp -63.36 -40.71 98.02 Favored 'General case' 0 C--O 1.211 -0.954 0 CA-C-O 116.683 -1.627 . . . . 2.65 110.746 -178.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -51.09 -51.15 56.19 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 122.233 2.288 . . . . 3.23 108.834 178.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.8 mt -52.57 -47.39 48.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 N-CA-C 111.417 0.154 . . . . 3.03 111.417 171.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . 2.144 41.6 mtt85 -38.98 -58.38 1.12 Allowed 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 115.462 1.653 . . . . 8.69 115.462 161.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 75.3 tttt . . . . . 0 N--CA 1.467 0.412 0 C-N-CA 127.374 2.27 . . . . 5.05 113.737 -127.496 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.538 0.482 0 CA-C-O 118.595 -0.717 . . . . 6.1 109.398 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 13.4 t -82.49 -165.45 1.04 Allowed 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 119.306 0.957 . . . . 1.91 111.016 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -72.62 -60.76 2.08 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 123.633 0.773 . . . . 2.13 111.41 -167.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 10.6 mt -56.68 -37.74 71.27 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 120.492 -1.38 . . . . 2.06 110.617 177.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -59.5 -43.48 93.34 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.757 0.823 . . . . 2.94 111.848 174.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.01 -46.06 86.2 Favored 'General case' 0 C--N 1.339 0.146 0 O-C-N 120.79 -1.194 . . . . 5.11 108.917 177.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -59.03 -46.29 88.58 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.742 -0.663 . . . . 2.74 110.816 -176.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.2 pp -66.98 -40.49 85.74 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 O-C-N 121.529 -0.732 . . . . 1.88 110.997 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.51 -55.14 37.07 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.179 0.899 . . . . 3.2 110.541 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.8 t -52.84 -36.56 58.99 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.103 0.865 . . . . 1.91 111.593 -173.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 24.3 m -78.01 -38.29 24.1 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 O-C-N 121.237 -0.914 . . . . 1.93 111.746 175.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 26.0 t -56.5 -51.0 70.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 119.395 0.998 . . . . 1.72 110.466 173.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 15.3 t -61.36 -40.09 93.02 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.421 1.009 . . . . 1.97 110.85 178.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 68.1 m -57.23 -54.63 44.65 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.421 -0.799 . . . . 2.0 110.278 173.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -45.53 -53.3 9.16 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 123.814 0.846 . . . . 5.25 109.654 172.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -58.73 -52.33 66.14 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.194 1.398 . . . . 3.72 110.721 -174.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 4.6 t -66.41 -26.57 67.3 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.995 -0.526 . . . . 3.31 111.684 -177.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -80.15 -36.95 34.43 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 120.033 1.288 . . . . 4.07 111.422 168.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.32 -32.17 72.89 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 120.833 -1.167 . . . . 1.93 109.927 -173.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -19.54 65.27 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 117.421 -1.276 . . . . 5.42 113.44 178.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -51.1 -64.7 0.73 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 115.168 1.544 . . . . 2.13 115.168 -158.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -91.27 -77.37 0.42 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 119.757 -0.777 . . . . 2.83 112.581 -169.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.99 156.92 23.15 Favored Glycine 0 C--N 1.338 0.652 0 C-N-CA 127.77 2.605 . . . . 2.68 110.368 158.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 48.3 101.32 0.01 OUTLIER 'General case' 0 C--O 1.244 0.81 0 N-CA-C 115.772 1.767 . . . . 4.42 115.772 142.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 7.1 pttt -67.73 55.44 0.06 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 128.113 2.565 . . . . 4.38 112.121 172.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -155.86 -49.05 0.08 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 126.465 1.906 . . . . 3.51 107.156 -157.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 49.0 p -99.75 149.22 23.56 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 125.524 1.53 . . . . 2.24 111.203 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -93.08 117.68 30.34 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 107.168 -1.419 . . . . 3.33 107.168 139.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 4.6 t -83.2 -170.65 3.15 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 126.054 1.741 . . . . 2.84 108.648 161.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.456 ' C ' ' H ' ' B' ' 37' ' ' GLU . 0.1 OUTLIER -64.83 -103.83 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.362 0 C-N-CA 130.252 3.421 . . . . 3.99 102.475 -166.798 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -75.5 55.96 0.85 Allowed 'General case' 0 CA--C 1.551 0.995 0 O-C-N 118.918 -2.364 . . . . 2.76 111.45 -178.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . 0.456 ' H ' ' C ' ' B' ' 35' ' ' VAL . 2.3 tt0 -116.43 -56.89 2.25 Favored 'General case' 0 N--CA 1.448 -0.561 1 C-N-CA 132.68 4.392 . . . . 2.84 103.716 158.404 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.58 -48.58 66.13 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.757 0.823 . . . . 3.83 109.221 173.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -51.18 -42.53 60.91 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 120.635 -0.426 . . . . 4.64 111.118 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -59.26 -37.87 78.68 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 118.111 0.414 . . . . 2.91 111.778 177.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 tt -68.76 -48.96 62.38 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.939 0.79 . . . . 2.94 109.639 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 2.4 m -66.57 -39.5 84.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 120.877 0.37 . . . . 1.82 110.039 -175.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 97.0 m -63.43 -56.5 15.71 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.455 0.702 . . . . 2.0 110.727 174.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -80.36 -57.4 3.62 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.749 0.419 . . . . 2.2 111.617 -164.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -79.46 -46.78 16.82 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 111.826 0.306 . . . . 3.23 111.826 -164.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -59.25 -37.55 53.48 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 113.505 0.928 . . . . 3.41 113.505 -166.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -60.11 -33.82 94.89 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 121.706 -2.206 . . . . 2.36 110.083 -62.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -84.64 -46.41 11.53 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.254 1.021 . . . . 4.74 112.871 -164.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.5 tp -42.02 -59.15 1.83 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.085 1.354 . . . . 1.8 111.428 -176.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 29.7 mt -79.74 66.09 5.1 Favored 'General case' 0 C--N 1.34 0.165 0 CA-C-O 122.111 0.958 . . . . 2.83 110.867 172.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -30.32 137.05 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 125.647 1.579 . . . . 6.55 112.257 152.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 27.1 t0 56.2 71.25 0.57 Allowed 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.924 1.689 . . . . 3.52 110.121 -167.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 24.8 m -72.4 -1.37 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-N 112.262 -2.245 . . . . 2.23 111.462 159.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -80.7 -56.65 3.07 Favored Glycine 0 C--N 1.342 0.898 0 N-CA-C 109.389 -1.485 . . . . 2.66 109.389 -174.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.29 52.04 0.73 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 122.362 1.077 . . . . 3.16 110.618 179.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -61.3 -40.18 93.22 Favored 'General case' 0 N--CA 1.439 -0.992 0 O-C-N 120.891 -1.13 . . . . 2.47 108.933 179.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -54.09 -53.17 56.88 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.398 1.079 . . . . 3.48 111.547 175.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -50.13 -60.16 3.22 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.862 1.265 . . . . 2.41 109.226 176.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.42 -57.31 13.51 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.427 -0.583 . . . . 5.02 109.427 -175.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -43.52 -54.89 4.57 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.912 1.685 . . . . 2.99 110.733 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 16.1 mtpp -56.61 -47.13 80.32 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.767 0.427 . . . . 4.67 111.454 175.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.2 t -60.71 -31.9 71.16 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 118.979 -0.534 . . . . 2.64 112.253 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 7.0 mp -75.54 -53.73 8.15 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.06 0.845 . . . . 3.25 110.061 174.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -53.65 -9.29 0.2 Allowed 'General case' 0 C--O 1.222 -0.374 0 N-CA-C 117.462 2.393 . . . . 2.19 117.462 -167.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.6 m -35.54 -23.04 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 129.649 3.18 . . . . 3.03 119.119 -127.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -51.38 -32.36 25.78 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.429 1.468 . . . . 4.08 111.544 159.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 64.01 55.05 1.61 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.579 0.751 . . . . 3.28 109.155 177.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 51.7 p30 -91.83 -17.67 24.96 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.519 1.128 . . . . 2.27 110.562 173.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 79.95 13.11 1.01 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.455 1.502 . . . . 2.46 112.544 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -124.33 101.81 7.37 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 106.857 -1.534 . . . . 3.0 106.857 167.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.13 106.6 7.82 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 106.684 -1.598 . . . . 2.55 106.684 175.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 48.9 tttt -83.78 178.84 7.76 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.506 1.522 . . . . 4.34 110.652 -162.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -83.53 80.19 9.19 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.994 1.318 . . . . 6.2 110.553 177.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . 0.363 28.4 t-20 123.9 -164.79 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 113.37 -3.205 . . . . 4.84 103.915 -110.082 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -31.86 -37.7 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 124.519 3.327 . . . . 2.39 116.798 -148.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -40.53 -53.97 2.59 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 121.112 1.778 . . . . 4.47 111.503 166.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.47 ' CH2' ' CD1' ' A' ' 77' ' ' TRP . 58.6 t90 -40.1 -32.03 0.15 Allowed 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 126.768 2.027 . . . . 4.99 114.838 173.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -46.54 -45.22 18.51 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 121.114 1.779 . . . . 7.96 110.276 170.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.7 tp -44.82 -49.74 10.61 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 124.725 1.21 . . . . 2.16 111.497 177.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . 0.322 8.7 tt -75.35 -21.84 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 N-CA-C 106.569 -1.641 . . . . 3.87 106.569 -166.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.475 ' CA ' ' NE1' ' A' ' 77' ' ' TRP . . . -59.03 -50.62 65.88 Favored Glycine 0 CA--C 1.491 -1.408 0 C-N-CA 125.003 1.287 . . . . 1.75 110.46 167.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -67.62 -47.39 69.75 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 106.871 -1.529 . . . . 2.19 106.871 -176.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 10.6 mp -44.0 -61.06 1.58 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 120.678 1.581 . . . . 3.19 111.803 171.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.31 -44.42 84.12 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.84 0.856 . . . . 1.96 111.561 -177.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -65.3 -54.04 35.03 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.977 1.311 . . . . 2.62 110.227 -177.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -57.01 -38.91 73.79 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.582 1.553 . . . . 2.46 110.931 -173.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 2.0 tt -51.38 -36.46 17.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 118.814 0.733 . . . . 2.32 111.082 175.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.45 -49.82 10.17 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.736 0.815 . . . . 6.93 109.754 174.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 67.1 mttt . . . . . 0 C--O 1.223 -0.296 0 C-N-CA 126.264 1.826 . . . . 6.71 111.927 -160.168 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.2 mp0 . . . . . 0 N--CA 1.448 -0.557 0 CA-C-O 119.449 -0.31 . . . . 4.5 110.26 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.52 104.81 1.64 Allowed 'Trans proline' 0 N--CA 1.45 -1.032 0 C-N-CA 122.313 2.009 . . . . 2.95 109.564 -179.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 64.5 mt -59.28 152.11 21.7 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 108.951 -0.759 . . . . 2.47 108.951 170.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.3 t -70.17 171.76 9.19 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 120.436 -0.505 . . . . 2.16 110.188 -178.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -63.77 -55.58 22.06 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 121.109 -0.995 . . . . 2.89 110.914 -172.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.1 mp -57.13 -41.33 78.86 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 118.833 -1.147 . . . . 2.75 110.148 -176.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -57.59 -51.15 70.68 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 127.835 2.454 . . . . 2.46 111.284 175.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -52.87 63.83 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 108.665 -0.865 . . . . 5.12 108.665 177.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.9 m -61.09 -46.93 88.65 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 111.805 0.298 . . . . 2.87 111.805 -175.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . 0.401 ' CD1' HG13 ' B' ' 87' ' ' ILE . 2.3 pp -64.1 -41.72 93.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 O-C-N 120.822 -1.174 . . . . 2.02 109.923 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -59.47 -49.25 78.51 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.402 1.001 . . . . 3.58 110.494 177.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.2 -40.52 74.15 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.597 0.713 . . . . 1.81 111.032 -175.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.4 m -75.45 -36.33 35.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 O-C-N 120.696 -1.252 . . . . 1.5 111.413 175.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 45.7 t -58.56 -46.56 89.93 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 CA-C-N 119.684 1.129 . . . . 1.85 110.064 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -63.43 -44.07 95.61 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.54 -0.743 . . . . 1.83 110.47 177.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 76.6 m -54.75 -48.32 72.74 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-N 119.01 0.823 . . . . 1.76 110.262 177.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -54.92 -61.19 2.47 Favored 'General case' 0 C--O 1.226 -0.148 0 N-CA-C 109.818 -0.438 . . . . 4.5 109.818 172.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -60.88 -48.76 80.32 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.261 0.624 . . . . 4.45 110.996 -163.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -62.64 -25.4 68.1 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 119.333 -0.365 . . . . 2.93 111.154 179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -82.7 -58.97 2.67 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 123.407 0.683 . . . . 4.13 111.114 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -45.12 -24.28 0.23 Allowed 'General case' 0 C--O 1.238 0.472 1 C-N-CA 132.647 4.379 . . . . 2.16 115.55 178.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.53 -23.62 51.38 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 123.918 0.761 . . . . 4.32 112.082 169.261 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -38.49 -66.76 0.24 Allowed 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 127.231 2.213 . . . . 2.25 113.435 -163.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -99.99 34.25 2.36 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 108.755 -0.831 . . . . 3.11 108.755 -174.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 65.0 -168.04 29.72 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-O 122.374 0.985 . . . . 2.57 110.707 -164.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? 53.66 72.96 0.4 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.194 -1.039 . . . . 11.35 108.194 -178.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.2 pttt -61.81 -34.9 76.74 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 123.491 0.717 . . . . 5.29 111.876 -170.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -83.93 14.1 4.37 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 118.494 -0.765 . . . . 3.54 111.669 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.3 p -125.69 145.45 50.17 Favored 'General case' 0 C--N 1.348 0.542 0 C-N-CA 124.279 1.032 . . . . 3.28 111.601 175.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mt -102.75 123.41 46.37 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 108.769 -0.826 . . . . 3.56 108.769 149.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.33 177.74 8.37 Favored 'General case' 0 C--O 1.225 -0.231 0 O-C-N 121.223 -0.923 . . . . 3.16 110.15 167.574 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 93.2 t -46.44 -59.31 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 C-N-CA 123.754 0.822 . . . . 3.26 111.167 178.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -58.19 -59.17 5.71 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 118.757 -0.639 . . . . 2.83 109.687 -177.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -39.19 -47.94 1.69 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.777 1.231 . . . . 2.23 111.998 171.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.86 -58.06 10.28 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.707 0.803 . . . . 5.11 110.492 177.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -61.03 -38.66 86.92 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.874 -0.33 . . . . 3.83 110.691 -174.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -51.86 -35.05 43.51 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 118.687 -0.673 . . . . 2.58 111.367 173.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.82 -43.33 75.77 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 119.978 1.263 . . . . 3.18 108.352 -176.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.8 m -65.57 -42.97 94.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 N-CA-C 109.542 -0.54 . . . . 2.89 109.542 -175.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.0 m -57.7 -49.34 76.86 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.807 0.843 . . . . 3.2 111.261 170.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -56.46 12.66 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.769 1.228 . . . . 4.34 111.933 -171.046 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -152.48 70.85 0.92 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 119.02 0.827 . . . . 4.14 111.278 -175.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . 0.414 ' N ' ' CD ' ' A' ' 47' ' ' PRO . 2.7 tp -156.5 31.41 0.04 OUTLIER Pre-proline 0 CA--C 1.542 0.668 0 N-CA-C 114.855 1.428 . . . . 2.59 114.855 174.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.414 ' CD ' ' N ' ' A' ' 46' ' ' LEU . 39.0 Cg_endo -63.03 -64.99 0.06 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 121.916 1.744 . . . . 2.18 113.586 -172.074 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -87.04 41.63 0.98 Allowed 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.096 -1.003 . . . . 4.66 111.611 -160.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.5 tp -141.95 -82.5 0.2 Allowed 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.172 0.989 . . . . 2.48 110.844 -172.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 32.0 mt -87.96 75.39 8.8 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 107.736 -1.209 . . . . 2.01 107.736 -178.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . 0.407 ' NZ ' ' OE1' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -43.13 143.61 0.77 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.568 -1.196 . . . . 7.93 110.33 160.437 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.1 t0 65.31 81.5 0.2 Allowed 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.537 1.535 . . . . 4.4 110.042 -159.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -88.57 3.7 5.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-N 113.539 -1.664 . . . . 3.19 110.681 163.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -94.77 -57.78 1.22 Allowed Glycine 0 C--N 1.342 0.897 0 N-CA-C 109.777 -1.329 . . . . 1.91 109.777 -170.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.5 t -90.9 30.19 1.24 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.096 1.359 . . . . 3.49 110.007 173.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -40.59 -38.25 0.84 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 126.244 1.818 . . . . 2.81 110.963 166.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -42.44 -41.92 3.08 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.328 2.251 . . . . 4.51 111.157 175.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -56.42 -54.65 43.09 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.548 1.139 . . . . 2.79 111.089 173.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.1 -53.79 54.24 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 106.735 -1.58 . . . . 3.91 106.735 -179.291 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -45.62 -52.12 11.14 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.081 0.953 . . . . 2.89 111.147 178.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -64.52 -29.86 70.89 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.611 -0.68 . . . . 4.88 112.493 178.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.8 t -67.83 -48.14 67.05 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.373 0.533 . . . . 2.45 110.438 173.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.1 mp -57.97 -48.45 79.95 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.729 -0.607 . . . . 3.14 110.167 177.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -71.8 81.65 0.88 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.515 -0.311 . . . . 2.72 110.272 -172.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.1 m -47.8 -36.57 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 124.032 0.933 . . . . 2.43 113.499 -174.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.0 p-10 -98.52 -0.12 43.95 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.295 0.85 . . . . 2.91 113.295 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 44.2 58.6 3.64 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 126.985 2.114 . . . . 5.1 112.517 178.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 45.4 p30 -100.14 -3.48 31.66 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.888 1.275 . . . . 1.69 112.317 178.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 28.1 m 65.17 21.92 12.18 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.977 1.311 . . . . 2.36 113.144 -174.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -129.43 100.6 5.62 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 105.329 -2.1 . . . . 4.09 105.329 171.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.62 88.16 6.24 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 103.151 -2.907 . . . . 2.16 103.151 176.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -54.2 155.59 3.61 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.746 -1.205 . . . . 5.13 107.746 176.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -37.18 -55.77 0.96 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.239 1.016 . . . . 6.39 112.815 -173.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -76.31 -18.27 59.03 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.191 0.812 . . . . 4.04 113.191 -175.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -73.79 -60.05 2.43 Favored 'General case' 0 CA--C 1.529 0.161 0 O-C-N 121.364 -0.835 . . . . 2.07 108.905 166.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -43.09 -47.79 6.11 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 124.387 1.075 . . . . 5.0 110.435 176.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.626 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 39.8 t90 -39.77 -41.14 1.06 Allowed 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 124.641 1.176 . . . . 5.73 112.613 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -46.45 -38.33 8.98 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 117.976 -1.012 . . . . 6.91 112.557 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.0 tp -53.2 -48.11 68.35 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 120.082 1.31 . . . . 1.99 110.346 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 53.0 mt -59.14 -30.02 42.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 N-CA-C 108.161 -1.051 . . . . 2.62 108.161 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.569 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -67.13 -50.81 43.09 Favored Glycine 0 CA--C 1.491 -1.444 0 C-N-CA 125.922 1.725 . . . . 1.28 111.399 177.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -67.9 -23.84 65.15 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 107.651 -1.24 . . . . 2.21 107.651 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 13.4 mt -68.01 -54.11 20.88 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 120.636 1.562 . . . . 3.04 111.647 166.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.95 -28.4 62.15 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.906 0.883 . . . . 1.72 111.527 -178.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -79.87 -52.67 7.59 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.727 1.611 . . . . 2.7 107.459 173.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.407 ' OE1' ' NZ ' ' A' ' 51' ' ' LYS 2.099 11.0 pt-20 -31.79 -61.05 0.24 Allowed 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 129.414 3.085 . . . . 2.93 113.42 171.916 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 8.3 tt -56.27 -32.33 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 CA-C-N 115.748 -0.66 . . . . 2.2 112.277 -172.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.33 -57.15 2.88 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.737 0.815 . . . . 5.45 109.506 176.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 56.8 tttp . . . . . 0 CA--C 1.53 0.188 0 C-N-CA 128.866 2.866 . . . . 3.66 113.065 -179.818 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.592 0 CA-C-O 120.035 -0.031 . . . . 4.18 110.99 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 4.7 t -74.17 -168.35 0.63 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.107 1.363 . . . . 2.26 111.286 174.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 62.0 tt0 -67.5 -59.99 2.93 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 122.176 0.989 . . . . 2.44 111.989 -173.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -53.47 -40.73 65.54 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 120.552 -1.342 . . . . 2.02 110.676 176.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -57.81 -49.83 75.31 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.365 0.666 . . . . 2.88 112.208 173.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -61.44 -38.0 85.56 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 120.463 -1.398 . . . . 3.98 110.552 177.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 9.4 t -59.73 -49.29 78.33 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.066 0.546 . . . . 2.6 110.981 177.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.268 2.4 pp -62.49 -35.2 68.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 O-C-N 121.035 -1.041 . . . . 1.94 111.069 173.121 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -54.79 -59.93 4.06 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.077 -0.963 . . . . 2.81 111.063 174.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 12.8 t -50.65 -43.33 57.15 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.758 1.163 . . . . 1.98 112.052 -171.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.3 m -69.74 -43.81 79.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 O-C-N 120.967 -1.083 . . . . 1.97 110.887 177.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 41.1 t -55.06 -53.4 34.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-O 118.669 -0.682 . . . . 2.2 110.465 175.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 9.3 t -58.86 -45.97 88.87 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.334 0.97 . . . . 2.06 110.801 178.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 94.6 m -52.95 -55.29 24.48 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.71 0.686 . . . . 1.84 110.266 177.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -54.54 -44.04 72.5 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.751 -0.593 . . . . 8.65 111.482 174.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -64.95 -26.9 68.5 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.621 1.168 . . . . 3.49 112.299 -177.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 67.2 p -69.88 -61.29 1.84 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.366 0.985 . . . . 2.82 108.644 167.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -54.45 -29.55 49.94 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 113.105 0.78 . . . . 4.14 113.105 -177.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -51.0 -33.02 23.03 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 126.209 1.804 . . . . 2.17 111.017 176.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -37.95 76.03 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 117.337 -1.316 . . . . 6.34 110.825 178.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.468 ' CB ' ' HG2' ' B' ' 37' ' ' GLU . 1.5 tp60 -39.69 -65.82 0.35 Allowed 'General case' 0 C--O 1.24 0.582 0 O-C-N 124.962 1.414 . . . . 3.14 111.974 -143.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -95.24 -73.47 0.58 Allowed 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 125.531 1.769 . . . . 3.72 113.473 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.11 123.43 7.48 Favored Glycine 0 C--N 1.338 0.67 0 CA-C-O 115.584 -2.787 . . . . 2.98 112.811 178.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 53.2 ttt85 52.44 102.83 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 121.752 2.776 . . . . 5.56 115.08 149.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.61 50.32 0.18 Allowed 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 116.231 1.937 . . . . 7.41 116.231 -172.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -137.08 -54.09 0.7 Allowed 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 126.243 1.817 . . . . 3.33 107.618 177.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 56.4 p -73.38 145.84 45.59 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.834 1.253 . . . . 2.27 110.568 175.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.04 -173.3 4.65 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 108.496 -0.927 . . . . 3.03 108.496 157.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . 0.273 3.9 t -157.4 -167.98 2.46 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 122.771 1.272 . . . . 3.02 113.581 -158.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 15.9 t -68.17 -131.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.651 1 N-CA-C 98.204 -4.739 . . . . 3.74 98.204 151.319 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 15.2 t30 -75.26 56.1 0.8 Allowed 'General case' 0 CA--C 1.557 1.217 0 O-C-N 118.062 -2.899 . . . . 2.87 112.323 -160.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . 0.468 ' HG2' ' CB ' ' B' ' 26' ' ' GLN . 58.0 mt-10 -102.85 -50.81 3.43 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 128.971 2.908 . . . . 1.91 107.688 139.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -56.07 -52.16 65.27 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.223 -1.028 . . . . 4.17 108.223 174.023 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . 0.266 53.5 tttm -54.28 -45.7 72.54 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 118.602 -1.239 . . . . 4.77 110.24 -175.113 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -57.93 -39.62 78.48 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 119.116 -0.468 . . . . 2.83 112.219 176.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 4.7 tt -66.87 -46.01 76.33 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 119.626 1.103 . . . . 2.82 109.699 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 27.4 m -69.94 -44.27 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-O 121.551 0.691 . . . . 2.0 109.219 -173.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 86.8 m -66.0 -49.98 65.88 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.262 1.025 . . . . 2.15 109.855 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -80.52 -62.46 1.67 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.256 0.222 . . . . 2.67 111.173 -171.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -83.9 -44.12 14.59 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 122.897 0.479 . . . . 3.09 112.14 -167.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.8 tp -82.71 -18.79 0.26 Allowed Pre-proline 0 CA--C 1.548 0.869 0 N-CA-C 118.768 2.877 . . . . 2.93 118.768 -167.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -46.2 -44.6 19.53 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 124.091 3.194 . . . . 3.25 117.158 -133.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -62.47 -44.26 96.82 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.182 0.808 . . . . 3.2 113.182 -172.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . 0.454 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 12.0 tp -57.34 -77.04 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.604 1.162 . . . . 2.34 112.6 -163.654 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 5.8 mt -67.06 -40.75 87.17 Favored 'General case' 0 C--N 1.339 0.144 0 O-C-N 121.728 -0.608 . . . . 3.97 110.336 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 12.1 tptp 62.82 171.28 0.14 Allowed 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.194 0.998 . . . . 8.64 111.611 -174.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 12.9 t0 46.66 62.41 2.34 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 123.812 1.768 . . . . 3.7 108.623 -160.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 26.9 m -84.19 28.17 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 112.446 -2.161 . . . . 2.73 109.933 162.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -104.61 -63.75 0.66 Allowed Glycine 0 C--N 1.341 0.821 0 N-CA-C 107.654 -2.178 . . . . 2.85 107.654 172.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.75 54.4 1.82 Allowed 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.851 1.261 . . . . 4.06 110.315 -174.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -61.26 -35.68 77.94 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 125.134 1.373 . . . . 2.03 110.224 -172.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -29.26 -57.88 0.15 Allowed 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 126.367 1.867 . . . . 4.0 114.125 171.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -49.09 -60.29 2.91 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.053 0.941 . . . . 2.32 109.528 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 2.9 mtmt -61.1 -49.04 78.91 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.893 -1.049 . . . . 5.39 109.672 -176.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -51.8 -51.96 52.61 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.953 0.797 . . . . 3.42 110.83 178.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -64.94 -34.73 79.11 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 122.729 0.412 . . . . 4.97 110.978 -178.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 5.3 t -67.72 -37.17 81.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.387 0.675 . . . . 2.27 111.774 174.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 79.5 mt -69.13 -58.81 3.57 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.019 0.928 . . . . 2.54 109.482 177.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . 0.417 ' O ' ' N ' ' B' ' 66' ' ' ASN 0.314 2.1 t70 -55.8 -9.51 0.57 Allowed 'General case' 0 C--O 1.221 -0.407 0 N-CA-C 117.461 2.393 . . . . 2.84 117.461 -165.638 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 28.1 m -34.54 -24.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 129.172 2.989 . . . . 2.5 118.717 -127.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . 0.417 ' N ' ' O ' ' B' ' 64' ' ' ASP . 0.3 OUTLIER -53.2 -34.56 57.54 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.816 1.189 . . . . 4.5 111.232 160.784 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 66.07 56.12 0.86 Allowed 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.751 1.621 . . . . 5.13 111.727 171.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -89.96 -33.05 16.53 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 114.651 -1.159 . . . . 3.55 109.374 158.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 4.1 m 101.3 -4.27 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 128.154 2.581 . . . . 2.98 114.005 175.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -101.22 132.54 46.67 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 106.401 -1.703 . . . . 5.28 106.401 164.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -99.79 118.5 36.39 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 106.61 -1.626 . . . . 2.26 106.61 -167.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 6.9 tptm -79.74 176.37 9.78 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.841 0.856 . . . . 3.89 109.104 -171.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -80.4 76.1 7.23 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 107.911 -1.144 . . . . 5.65 107.911 -174.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 97.91 53.98 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.304 1 C-N-CA 133.589 4.756 . . . . 2.68 108.922 -164.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -87.89 -61.84 1.63 Allowed 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 121.092 -1.005 . . . . 1.73 108.6 107.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -45.11 -43.64 9.84 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.651 1.18 . . . . 6.09 114.076 -162.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.626 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 16.9 t-105 -39.94 -36.62 0.48 Allowed 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.416 1.487 . . . . 5.89 112.495 177.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 10.4 mtt180 -38.36 -51.06 1.52 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.434 1.016 . . . . 5.34 111.601 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 2.7 tp -53.36 -38.77 63.6 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 123.099 0.25 . . . . 2.27 110.627 -175.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 70.7 mt -63.42 -25.47 38.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-O 121.729 0.776 . . . . 2.58 109.604 -174.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.552 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -74.48 -40.88 38.24 Favored Glycine 0 CA--C 1.49 -1.531 0 N-CA-C 109.674 -1.37 . . . . 1.64 109.674 179.076 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.94 -52.93 53.67 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 105.559 -2.015 . . . . 2.34 105.559 178.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.454 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 9.5 mp -42.22 -61.56 1.14 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.646 1.112 . . . . 3.24 111.709 172.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.44 -44.38 92.95 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.771 0.796 . . . . 1.9 111.805 -175.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 28.8 ttmt -62.69 -55.0 30.87 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.246 1.419 . . . . 2.8 110.426 -179.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -57.62 -44.62 85.65 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.056 0.942 . . . . 2.4 109.834 -170.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . 0.401 HG13 ' CD1' ' A' ' 13' ' ' ILE . 0.2 OUTLIER -39.89 -48.34 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 125.433 1.493 . . . . 3.08 112.67 166.149 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.54 -34.05 31.38 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.234 1.014 . . . . 4.78 110.606 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 43.4 mttm . . . . . 0 C--O 1.223 -0.305 0 C-N-CA 126.353 1.861 . . . . 6.81 110.731 -163.554 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 . . . . . 0 N--CA 1.443 -0.822 0 CA-C-O 118.939 -0.553 . . . . 6.22 109.967 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.97 96.85 0.79 Allowed 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 122.575 2.183 . . . . 3.12 110.308 179.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 93.4 mt -57.83 157.52 7.44 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.574 0.75 . . . . 2.51 111.033 173.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.4 t -75.24 159.79 31.13 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 108.806 -0.813 . . . . 2.72 108.806 176.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 68.2 tt0 -51.1 -45.95 61.68 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 123.481 0.712 . . . . 4.28 110.803 -177.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.4 mt -64.74 -55.97 16.56 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.396 -0.811 . . . . 2.49 111.028 -177.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -49.24 -54.29 17.44 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.155 1.382 . . . . 2.19 110.678 176.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -50.26 -59.89 3.51 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 124.377 1.071 . . . . 3.9 109.609 174.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.1 p -56.61 -43.75 80.49 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.558 -0.714 . . . . 2.11 111.296 -174.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.308 2.7 pp -66.81 -42.94 89.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-O 118.743 -0.646 . . . . 1.94 110.44 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -61.04 -49.95 75.3 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 119.435 -0.906 . . . . 3.41 109.912 175.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 m -46.02 -51.38 13.69 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.005 1.722 . . . . 2.76 112.64 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 30.1 m -71.64 -40.33 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 O-C-N 120.335 -1.478 . . . . 1.73 110.163 178.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 36.2 t -55.07 -43.03 68.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 123.024 0.53 . . . . 1.99 110.586 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.7 t -61.99 -52.61 63.3 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.276 0.944 . . . . 1.87 110.716 178.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.9 m -57.69 -50.71 72.29 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.584 1.084 . . . . 2.17 110.529 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -45.21 -55.59 5.66 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 124.965 1.306 . . . . 4.25 110.517 171.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -58.16 -51.93 67.69 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.953 0.901 . . . . 5.32 110.58 -177.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 12.4 p -56.69 -38.74 72.69 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 119.41 -0.329 . . . . 3.19 111.306 -179.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -65.32 -52.88 51.01 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 121.386 0.612 . . . . 3.74 110.983 171.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.2 -19.88 65.64 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.143 1.377 . . . . 2.0 112.062 -170.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.31 -33.32 75.57 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 117.977 -1.011 . . . . 6.76 110.148 173.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.99 -77.17 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.86 0.864 . . . . 3.86 112.411 -173.11 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -100.96 173.38 6.51 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 127.203 2.201 . . . . 2.49 106.663 -174.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -33.42 141.29 0.08 OUTLIER Glycine 0 CA--C 1.538 1.49 0 C-N-CA 125.978 1.752 . . . . 2.01 115.214 -173.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? 62.2 105.32 0.03 OUTLIER 'General case' 0 C--O 1.237 0.438 0 C-N-CA 125.22 1.408 . . . . 5.67 111.753 -177.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -73.34 50.6 0.31 Allowed 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.281 0.845 . . . . 4.41 113.281 176.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.7 p-10 -172.31 -32.6 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 127.429 2.292 . . . . 3.85 109.346 171.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.7 m -78.11 130.08 35.96 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.755 -0.831 . . . . 2.59 108.755 170.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -83.54 154.12 24.0 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 106.449 -1.686 . . . . 3.19 106.449 162.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.4 m -122.46 170.88 9.53 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 107.204 -1.406 . . . . 3.57 107.204 161.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.1 p -48.48 -52.1 9.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 N-CA-C 112.804 0.668 . . . . 3.18 112.804 -165.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -62.82 -57.74 9.83 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.555 -0.736 . . . . 2.53 109.798 -178.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -38.47 -51.1 1.57 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.08 1.352 . . . . 1.66 111.413 174.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.77 -49.02 78.03 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 114.966 -1.016 . . . . 4.42 109.716 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -59.95 -39.57 86.03 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 118.671 -0.68 . . . . 4.95 110.33 -176.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -53.66 -44.05 69.33 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 118.259 0.481 . . . . 3.68 110.753 171.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.12 -49.61 73.75 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 108.523 -0.917 . . . . 4.38 108.523 -173.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.5 m -68.95 -52.21 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 N-CA-C 108.852 -0.796 . . . . 2.2 108.852 -175.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.9 m -52.79 -51.56 60.25 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.5 1.12 . . . . 2.78 111.199 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -72.43 -50.89 23.05 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 122.543 0.337 . . . . 3.59 110.268 -175.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -94.69 -26.63 16.23 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.094 0.776 . . . . 4.12 113.094 -161.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.8 mp -107.96 93.42 10.76 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 119.167 0.894 . . . . 3.56 110.11 -175.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -72.07 -44.34 0.91 Allowed 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.24 1.96 . . . . 2.36 111.453 -177.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.2 t-160 -150.63 44.33 0.84 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.161 0.505 . . . . 4.77 110.692 -174.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 19.8 tp -95.48 -80.98 0.41 Allowed 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.01 -1.478 . . . . 2.85 107.01 167.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.3 mt -75.73 84.24 2.72 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.279 -0.637 . . . . 2.69 109.279 172.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.01 143.48 1.12 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.664 -0.698 . . . . 6.47 110.718 163.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 67.43 39.11 3.0 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 125.774 1.63 . . . . 4.19 110.475 177.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -49.83 -25.59 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 125.96 1.704 . . . . 4.2 113.991 -177.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.53 -44.08 21.85 Favored Glycine 0 CA--C 1.532 1.143 0 N-CA-C 111.183 -0.767 . . . . 1.97 111.183 170.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 47.1 t -74.66 45.79 0.26 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.113 1.765 . . . . 2.92 111.038 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -66.04 -49.92 66.0 Favored 'General case' 0 N--CA 1.445 -0.725 0 O-C-N 120.846 -1.159 . . . . 2.41 108.347 174.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.12 -38.15 56.49 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.797 1.639 . . . . 4.11 111.904 -167.429 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -55.41 -53.69 53.03 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.755 -0.591 . . . . 3.26 110.925 170.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.45 -46.06 89.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.974 -0.75 . . . . 3.69 108.974 175.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 18.7 tmm? -44.91 -52.72 8.38 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 123.875 0.87 . . . . 2.69 109.158 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -68.82 -39.89 79.79 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.843 -0.617 . . . . 5.52 111.423 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.1 t -58.73 -30.04 67.17 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.895 0.702 . . . . 3.29 112.895 175.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.43 -45.26 10.11 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.536 -0.727 . . . . 3.03 109.431 175.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -75.2 61.25 1.13 Allowed 'General case' 0 C--N 1.342 0.256 0 C-N-CA 124.775 1.23 . . . . 1.64 111.012 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 25.7 m -58.67 -34.11 50.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.934 0.894 . . . . 2.63 112.281 -174.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -82.74 -8.4 59.59 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.347 0.499 . . . . 2.94 112.347 177.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . 0.266 2.9 tp60 50.93 66.55 1.14 Allowed 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.878 2.071 . . . . 5.35 113.407 178.25 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.8 p30 -113.17 -4.98 13.69 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.685 1.194 . . . . 2.45 111.774 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.4 m 62.53 15.38 7.84 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.304 1.041 . . . . 2.65 113.454 -171.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -112.11 109.6 19.42 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.602 1.561 . . . . 3.47 107.066 165.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -88.35 74.86 8.58 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 105.472 -2.047 . . . . 2.63 105.472 170.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.68 159.91 33.57 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.008 0.433 . . . . 3.96 110.886 177.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 15.5 p90 -37.59 -55.96 1.07 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.888 1.675 . . . . 6.97 114.057 -162.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.11 -40.27 90.59 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.85 0.75 . . . . 2.51 111.721 -177.046 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -76.46 -44.0 37.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 120.087 1.312 . . . . 3.0 109.686 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -44.55 -50.16 9.73 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 118.551 0.614 . . . . 4.8 109.961 167.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.634 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 1.2 t-105 -46.51 -32.23 3.23 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 116.938 -1.506 . . . . 4.96 112.418 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -38.69 -49.08 1.55 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 120.694 1.588 . . . . 5.69 109.939 172.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.8 tp -48.42 -46.04 37.0 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.834 0.854 . . . . 1.92 110.251 -176.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 91.3 mt -62.99 -31.77 53.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 109.12 -0.696 . . . . 2.83 109.12 -171.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.556 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -67.99 -45.71 71.19 Favored Glycine 0 CA--C 1.488 -1.624 0 N-CA-C 109.656 -1.378 . . . . 1.34 109.656 178.046 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -69.33 -49.03 59.51 Favored 'General case' 0 N--CA 1.422 -1.873 0 N-CA-C 105.825 -1.917 . . . . 2.39 105.825 -173.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 9.5 mt -41.26 -59.1 1.62 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 120.881 1.673 . . . . 3.69 111.631 166.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.36 -30.74 63.05 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.513 0.725 . . . . 1.91 111.716 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 -57.23 4.93 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 123.228 0.611 . . . . 2.92 110.439 171.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -50.25 -48.05 54.86 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 128.689 2.796 . . . . 2.22 108.968 -174.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.8 tt -61.6 -21.22 24.97 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 113.849 1.055 . . . . 2.73 113.849 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 49.8 ttt85 -96.8 -60.37 1.61 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.303 1.441 . . . . 6.34 109.129 178.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 40.5 pttt . . . . . 0 CA--C 1.547 0.842 0 C-N-CA 124.432 1.093 . . . . 5.01 113.799 -179.381 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 42.3 mt . . . . . 0 CA--C 1.541 0.615 0 N-CA-C 109.097 -0.705 . . . . 4.62 109.097 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 11.6 t -75.57 178.62 5.87 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 119.123 0.874 . . . . 2.81 109.94 -177.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -61.59 -63.09 1.38 Allowed 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.526 0.679 . . . . 3.41 110.508 -172.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 mp -56.48 -44.13 80.33 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 121.447 -0.783 . . . . 3.11 109.783 -175.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.41 -46.03 69.59 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.541 1.936 . . . . 3.82 112.244 173.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.65 -51.44 69.37 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.468 -0.77 . . . . 4.73 109.225 176.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 91.7 p -65.98 -41.01 91.7 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.074 -0.512 . . . . 2.87 110.721 -171.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.279 2.4 pp -64.16 -39.46 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 CA-C-O 118.264 -0.874 . . . . 2.32 109.299 174.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.0 -45.92 91.48 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 117.564 -1.655 . . . . 4.88 112.469 173.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . 0.266 1.1 t -56.43 -35.27 67.65 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 120.313 1.415 . . . . 2.18 110.98 -174.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 20.7 m -77.0 -34.12 21.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 O-C-N 120.684 -1.26 . . . . 1.93 112.34 171.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 60.2 t -53.82 -51.22 46.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 120.722 1.601 . . . . 2.34 110.496 169.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.3 t -65.03 -43.19 93.23 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.819 0.736 . . . . 2.23 110.348 -177.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 72.0 m -55.94 -53.47 56.42 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.512 0.596 . . . . 1.94 110.28 174.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -47.28 -55.34 8.88 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.975 0.91 . . . . 5.42 109.951 172.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -56.41 -52.89 62.95 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.764 1.626 . . . . 3.73 110.819 -173.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.8 t -63.99 -25.2 68.02 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 122.134 -0.354 . . . . 3.21 111.42 -175.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -80.95 -44.1 18.74 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 119.159 0.89 . . . . 4.21 110.921 168.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.52 -32.59 70.44 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.712 1.205 . . . . 2.29 110.572 -172.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.72 -20.05 63.08 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 117.315 -1.326 . . . . 5.74 113.366 177.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.98 -67.16 0.32 Allowed 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 115.462 1.653 . . . . 2.55 115.462 -155.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -91.92 -77.03 0.44 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 119.394 -0.922 . . . . 2.77 113.062 -168.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.18 169.05 31.62 Favored Glycine 0 C--N 1.336 0.575 0 C-N-CA 127.555 2.502 . . . . 3.01 110.604 160.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 48.29 98.54 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.949 1.092 . . . . 5.6 113.949 137.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 18.0 pttm -77.9 51.18 0.93 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.318 1.847 . . . . 5.29 112.804 -174.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 19.5 p30 -172.36 -51.17 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.102 1.761 . . . . 3.56 108.387 -163.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 53.7 p -74.23 150.06 40.5 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.045 0.538 . . . . 2.12 110.306 170.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 mp -123.71 119.73 30.63 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 123.17 0.588 . . . . 3.99 110.044 161.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 50.1 m -90.35 175.63 7.03 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.869 -0.789 . . . . 2.95 108.869 170.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 11.0 p -84.03 51.77 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 O-C-N 121.004 -1.06 . . . . 3.71 110.709 -175.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -159.93 55.1 0.36 Allowed 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 106.084 -1.821 . . . . 3.57 106.084 159.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -178.49 -56.12 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 127.9 2.48 . . . . 1.94 104.546 -166.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -60.1 -59.38 5.51 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.604 -0.887 . . . . 4.82 108.604 165.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 54.3 tttt -58.18 -35.83 72.17 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 119.903 -0.719 . . . . 3.39 111.365 -174.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -49.56 -42.8 45.15 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 119.302 -0.38 . . . . 4.27 111.9 172.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 tp -66.42 -49.15 67.73 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.773 -0.825 . . . . 2.88 108.773 -172.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 9.4 m -69.09 -38.16 77.79 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.163 0 CA-C-N 116.083 -0.508 . . . . 2.03 110.016 -174.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 94.1 m -61.1 -54.86 39.41 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.124 -0.489 . . . . 2.5 110.134 173.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -82.01 -60.35 2.26 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.686 0.794 . . . . 2.08 112.884 -167.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -81.23 -38.95 26.12 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 114.276 1.213 . . . . 3.16 114.276 -160.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -48.93 -44.3 70.23 Favored Pre-proline 0 CA--C 1.532 0.271 0 N-CA-C 114.922 1.453 . . . . 2.9 114.922 -155.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -77.51 -36.13 1.35 Allowed 'Trans proline' 0 N--CA 1.448 -1.177 0 N-CA-C 108.92 -1.223 . . . . 3.14 108.92 -44.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -88.79 -35.74 16.47 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 125.231 1.412 . . . . 3.98 110.373 -173.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 15.9 tp -42.14 -63.53 0.73 Allowed 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 114.043 1.127 . . . . 1.99 114.043 -172.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 35.4 mt -83.39 162.57 21.0 Favored 'General case' 0 C--N 1.338 0.107 0 CA-C-O 121.459 0.647 . . . . 2.42 109.4 175.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' B' ' 86' ' ' GLU . 0.0 OUTLIER -142.44 154.03 44.21 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 124.762 1.225 . . . . 6.4 108.002 178.315 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 30.2 t0 66.68 82.11 0.19 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 126.486 1.914 . . . . 3.75 109.461 -164.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 34.7 m -93.93 11.5 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 CA-C-N 113.735 -1.575 . . . . 2.68 109.485 162.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.57 -71.17 1.3 Allowed Glycine 0 C--N 1.339 0.738 0 N-CA-C 106.703 -2.559 . . . . 2.94 106.703 174.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.33 55.11 2.16 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 123.13 1.443 . . . . 3.63 109.652 -179.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.66 -34.33 74.15 Favored 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 124.235 1.014 . . . . 1.93 108.774 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -44.69 -46.28 10.23 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.4 1.48 . . . . 4.24 112.075 171.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -55.49 -48.54 74.42 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.635 0.652 . . . . 2.67 110.215 177.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -59.15 -51.67 69.0 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 107.36 -1.348 . . . . 4.14 107.36 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 9.9 tmm? -50.26 -60.57 2.85 Favored 'General case' 0 C--O 1.227 -0.081 0 C-N-CA 124.841 1.256 . . . . 4.04 110.233 -174.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt -59.19 -36.85 76.07 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.591 -0.242 . . . . 5.99 111.6 -175.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -68.93 -38.2 79.36 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.943 0.897 . . . . 2.54 111.348 178.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 24.0 mt -73.4 -54.26 8.74 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.28 1.032 . . . . 2.77 109.992 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -62.88 -10.2 12.45 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 128.009 2.524 . . . . 2.53 116.244 -166.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 21.4 m -33.73 -24.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 119.384 3.105 . . . . 2.69 119.384 -134.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -55.17 -27.43 45.66 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 120.894 1.679 . . . . 3.54 111.106 165.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 74.35 61.15 0.08 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.557 1.143 . . . . 4.59 110.548 164.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 46.8 p30 -117.92 -16.29 9.92 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.053 1.741 . . . . 1.91 112.587 -177.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 1.3 t 69.57 21.33 6.74 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.715 1.143 . . . . 3.3 112.209 -173.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -122.14 99.7 6.57 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 106.124 -1.806 . . . . 3.12 106.124 158.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.41 98.09 1.74 Allowed 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.99 -1.856 . . . . 2.21 105.99 172.089 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -84.65 174.99 9.52 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 118.412 0.551 . . . . 5.42 110.484 -179.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -92.45 58.8 3.26 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.306 0.642 . . . . 7.02 111.768 -173.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -158.28 51.02 0.41 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 108.008 -1.108 . . . . 2.82 108.008 101.248 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -91.04 -62.47 1.44 Allowed 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.043 -1.465 . . . . 2.32 107.043 145.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -52.17 -46.98 65.71 Favored 'General case' 0 CA--C 1.512 -0.509 0 C-N-CA 124.595 1.158 . . . . 5.85 111.163 -167.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.634 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 56.2 t90 -45.08 -37.54 4.32 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 114.437 -1.256 . . . . 5.24 111.724 -175.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -39.69 -45.19 1.65 Allowed 'General case' 0 C--N 1.344 0.33 0 C-N-CA 124.031 0.933 . . . . 5.07 112.483 173.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 17.4 tp -49.59 -45.83 48.44 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.017 0.927 . . . . 2.51 111.551 -178.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 70.3 mt -64.53 -26.18 39.66 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.625 0 N-CA-C 108.052 -1.092 . . . . 2.34 108.052 -177.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.528 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -70.14 -45.28 56.9 Favored Glycine 0 CA--C 1.503 -0.691 0 C-N-CA 127.066 2.269 . . . . 1.62 112.44 177.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -68.53 -53.41 23.27 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 106.73 -1.581 . . . . 2.01 106.73 -177.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . 0.254 3.8 pp -58.22 -37.19 74.38 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 119.962 -0.695 . . . . 2.9 111.585 174.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.78 -57.91 10.95 Favored 'General case' 0 C--N 1.34 0.155 0 O-C-N 121.119 -0.988 . . . . 2.18 111.655 175.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 4.5 ptpt -63.08 -36.71 84.48 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.407 -0.806 . . . . 3.01 110.504 -178.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' B' ' 51' ' ' LYS . 2.2 mm-40 -44.22 -39.26 4.29 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 124.716 1.206 . . . . 4.9 111.908 -173.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 5.2 tt -47.1 -45.32 8.4 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 123.118 0.567 . . . . 1.76 111.677 178.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -84.34 -50.63 7.65 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.034 0.534 . . . . 6.3 111.957 166.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 27.8 mttp . . . . . 0 N--CA 1.452 -0.356 0 O-C-N 121.263 -0.898 . . . . 5.85 111.638 -169.816 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 . . . . . 0 N--CA 1.448 -0.537 0 N-CA-C 110.111 -0.329 . . . . 4.56 110.111 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.65 107.65 2.36 Favored 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 122.467 2.111 . . . . 2.85 109.511 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 77.8 mt -65.47 159.71 23.78 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.554 0.742 . . . . 2.36 110.25 175.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.1 t -76.85 170.0 17.29 Favored 'General case' 0 N--CA 1.458 -0.037 0 N-CA-C 109.271 -0.64 . . . . 2.49 109.271 -179.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -64.49 -42.85 95.62 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 108.477 -0.934 . . . . 2.86 108.477 -171.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.8 mp -63.99 -57.52 9.48 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 118.422 -0.799 . . . . 3.35 111.522 176.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -48.61 -52.6 22.21 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.4 1.48 . . . . 2.76 109.943 178.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -51.99 -59.62 4.14 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.794 1.238 . . . . 3.17 109.527 175.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.0 p -55.38 -43.35 75.06 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.489 -0.757 . . . . 2.24 111.771 -175.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.311 2.7 pp -65.37 -44.23 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 CA-C-O 118.687 -0.673 . . . . 1.87 110.57 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -60.57 -48.79 80.22 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.484 1.038 . . . . 3.87 110.104 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 m -45.65 -46.26 14.51 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.836 1.654 . . . . 3.1 112.613 175.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 23.7 m -80.46 -33.55 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 O-C-N 120.817 -1.177 . . . . 1.74 111.712 177.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.5 t -57.7 -39.32 69.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 121.467 -0.77 . . . . 1.81 110.434 175.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.1 t -64.81 -43.14 94.11 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.975 0.807 . . . . 1.62 111.15 175.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.0 m -55.48 -51.55 66.6 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 120.925 -1.109 . . . . 1.87 110.161 173.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -48.23 -60.17 2.86 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 109.698 -0.482 . . . . 5.07 109.698 173.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -54.16 -53.31 55.2 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.636 0.774 . . . . 5.29 111.225 -173.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 22.0 p -57.08 -60.39 3.66 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 122.551 0.341 . . . . 3.27 110.451 -178.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -56.15 -40.58 74.06 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-O 121.178 0.513 . . . . 3.99 111.231 178.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.2 -26.92 68.35 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 121.093 -1.005 . . . . 2.07 110.735 -174.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 52.6 ttp180 -79.62 -19.21 49.78 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 117.724 -1.131 . . . . 7.87 112.448 -177.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -41.16 -67.34 0.26 Allowed 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.505 1.048 . . . . 2.1 113.623 -173.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -98.43 79.81 2.55 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 104.138 -2.541 . . . . 2.56 104.138 178.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 38.86 -155.51 0.02 OUTLIER Glycine 0 CA--C 1.525 0.709 0 C-N-CA 127.01 2.243 . . . . 3.35 112.586 -176.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 74.9 mtp85 31.66 87.37 0.01 OUTLIER 'General case' 0 C--O 1.24 0.558 0 C-N-CA 126.681 1.992 . . . . 5.78 110.716 165.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.21 43.87 0.83 Allowed 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 127.517 2.327 . . . . 5.71 109.025 -168.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -155.51 -52.84 0.09 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 105.521 -2.029 . . . . 4.06 105.521 -142.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 16.5 p -106.72 136.78 45.93 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 125.732 1.613 . . . . 2.62 109.917 169.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -83.82 130.31 34.93 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 105.98 -1.859 . . . . 2.98 105.98 157.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 21.2 t -81.32 177.39 9.02 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.332 1.453 . . . . 3.53 107.62 169.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 76.5 t -62.2 -52.1 64.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 121.728 -0.607 . . . . 3.89 110.03 -174.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -60.67 -55.74 29.58 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 118.701 -0.666 . . . . 2.74 109.62 177.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -39.0 -54.24 1.69 Allowed 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 126.028 1.731 . . . . 1.99 111.968 173.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -57.0 -54.18 49.63 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.434 0.693 . . . . 4.17 109.291 177.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 48.4 tttt -56.81 -39.19 73.71 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.258 0.466 . . . . 3.29 112.258 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -49.9 -33.07 16.16 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 119.41 1.005 . . . . 3.0 111.882 177.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -63.38 -46.13 87.88 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 108.256 -1.016 . . . . 3.32 108.256 -178.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.4 m -75.77 -38.9 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-N 115.771 -0.65 . . . . 2.28 109.913 -174.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 50.0 m -61.45 -44.47 97.05 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.875 0.87 . . . . 2.97 111.378 174.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -76.44 -57.88 3.61 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.88 -0.415 . . . . 2.97 109.88 -170.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -100.81 -124.65 0.17 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.074 -0.713 . . . . 3.52 109.074 -175.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.4 mp 24.22 64.21 0.41 Allowed Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 127.625 2.37 . . . . 2.9 113.762 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -78.59 -49.49 0.08 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.221 1.947 . . . . 1.77 111.331 -171.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -112.48 -28.68 7.77 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.277 1.431 . . . . 4.43 111.335 -173.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.418 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 6.5 tp -65.03 -79.52 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.061 1.344 . . . . 1.96 110.997 -171.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.1 mt -78.46 165.34 23.88 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 108.345 -0.983 . . . . 3.08 108.345 165.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.74 161.1 9.09 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 105.816 -1.92 . . . . 7.17 105.816 -166.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 46.7 t0 60.11 78.27 0.28 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 123.057 1.408 . . . . 5.01 108.82 -163.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.1 m -85.3 12.42 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 113.552 -1.658 . . . . 3.88 110.089 166.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.97 -66.48 1.66 Allowed Glycine 0 C--N 1.34 0.779 0 N-CA-C 106.444 -2.662 . . . . 2.19 106.444 167.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.3 t -78.23 61.0 2.62 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 122.291 1.043 . . . . 2.89 110.841 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -79.77 -39.68 30.42 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 125.471 1.508 . . . . 2.05 108.513 169.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -40.7 -53.2 2.84 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.853 1.661 . . . . 4.88 112.167 171.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -48.81 -56.61 8.18 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.193 1.397 . . . . 3.02 111.094 174.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.56 -51.94 65.4 Favored 'General case' 0 C--O 1.225 -0.235 0 N-CA-C 108.406 -0.961 . . . . 3.86 108.406 177.016 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -47.75 -52.24 19.3 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 123.941 0.896 . . . . 2.44 110.12 -176.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -62.95 -39.4 94.51 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 118.08 0.4 . . . . 3.7 111.685 178.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.4 t -60.13 -37.06 78.92 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.934 -0.479 . . . . 2.18 111.567 175.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.6 mp -77.42 -55.56 5.29 Favored 'General case' 0 CA--C 1.528 0.103 0 O-C-N 121.141 -0.975 . . . . 3.25 110.93 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -76.45 69.72 2.94 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.076 0.95 . . . . 1.78 110.035 -174.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 20.5 m -49.36 -33.09 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 124.534 1.134 . . . . 2.53 112.827 -176.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -96.44 0.78 50.91 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.196 0.813 . . . . 3.36 113.196 -176.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 44.93 65.49 1.08 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.885 1.674 . . . . 5.64 112.541 176.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 30.6 p30 -107.48 -8.34 16.28 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.614 1.166 . . . . 2.09 111.089 171.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 44.0 m 61.08 23.82 13.97 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.523 1.129 . . . . 2.06 112.438 -171.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -120.39 108.94 14.74 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 106.691 -1.596 . . . . 3.25 106.691 163.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -80.53 89.16 5.64 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 103.686 -2.709 . . . . 2.37 103.686 177.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.8 ttpm? -68.49 161.17 28.35 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.734 1.214 . . . . 4.85 108.945 -174.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -37.7 -62.04 0.57 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.403 1.081 . . . . 6.66 113.279 -168.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -70.25 -33.33 71.49 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 111.701 0.26 . . . . 2.1 111.701 -176.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -61.84 -60.01 4.29 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 108.826 -0.805 . . . . 1.99 108.826 177.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -48.34 -52.92 19.41 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 124.048 0.939 . . . . 3.61 109.505 174.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.554 ' CE2' ' CZ2' ' B' ' 77' ' ' TRP . 12.8 t-105 -51.01 -29.38 12.34 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 117.498 -1.239 . . . . 5.63 111.435 -178.195 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.431 HH21 ' CD ' ' A' ' 82' ' ' GLU . 36.6 ttt180 -43.75 -43.81 6.27 Favored 'General case' 0 C--N 1.351 0.659 0 CA-C-N 120.471 1.487 . . . . 6.53 110.712 171.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.5 tp -44.53 -45.54 9.38 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 122.851 0.46 . . . . 2.1 110.854 178.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.5 mp -69.51 -32.74 54.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 108.961 -0.755 . . . . 2.92 108.961 -175.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.431 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -58.74 -44.84 95.55 Favored Glycine 0 CA--C 1.506 -0.469 0 N-CA-C 110.175 -1.17 . . . . 1.51 110.175 169.346 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.431 ' CD ' HH21 ' A' ' 78' ' ' ARG . 5.1 mm-40 -76.53 -33.61 58.57 Favored 'General case' 0 N--CA 1.438 -1.029 0 N-CA-C 108.653 -0.869 . . . . 2.35 108.653 -169.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.418 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 9.1 mp -52.77 -54.71 30.07 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.042 0.837 . . . . 3.25 109.786 161.078 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.36 -26.88 66.94 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.889 0.475 . . . . 2.39 111.9 -178.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -61.1 1.97 Allowed 'General case' 0 C--O 1.217 -0.628 0 O-C-N 121.579 -0.701 . . . . 3.32 109.628 162.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -53.14 -43.61 67.13 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.634 1.574 . . . . 3.51 112.062 -164.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 11.7 tt -53.29 -37.12 27.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-O 121.816 0.817 . . . . 2.86 111.366 173.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.08 -63.51 1.27 Allowed 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 126.288 1.835 . . . . 6.41 110.167 -171.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 35.6 tttp . . . . . 0 N--CA 1.449 -0.522 0 C-N-CA 126.609 1.964 . . . . 5.2 113.585 -162.447 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 13.1 mt . . . . . 0 CA--C 1.544 0.733 0 CA-C-O 118.396 -0.812 . . . . 4.28 112.714 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 4.7 t -110.68 -80.83 0.58 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.619 1.34 . . . . 2.51 114.619 -161.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -162.58 -72.23 0.05 OUTLIER 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.935 0.894 . . . . 3.25 108.658 -173.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.5 mt -56.41 -50.03 72.79 Favored 'General case' 0 C--N 1.338 0.102 0 N-CA-C 109.215 -0.661 . . . . 2.05 109.215 171.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -43.66 -62.6 1.04 Allowed 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 124.269 1.028 . . . . 4.72 111.092 167.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -48.42 -42.61 32.65 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.262 0.553 . . . . 4.0 109.768 -177.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 14.7 m -62.84 -36.92 84.83 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.154 0.981 . . . . 2.19 112.617 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.272 1.9 pp -75.7 -37.39 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 118.913 0.779 . . . . 2.11 111.029 171.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -57.71 -59.09 5.74 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 118.895 0.77 . . . . 2.38 109.602 177.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.4 t -47.32 -44.84 23.9 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.005 0.821 . . . . 2.19 112.097 -174.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.1 m -73.03 -43.83 57.84 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 O-C-N 120.987 -1.071 . . . . 1.76 110.843 178.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 37.1 t -53.69 -51.28 45.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 O-C-N 121.405 -0.809 . . . . 2.19 110.617 175.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 13.7 t -60.05 -48.91 79.74 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 117.457 -1.258 . . . . 2.31 110.355 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 99.0 m -46.14 -57.67 4.3 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 120.634 1.561 . . . . 2.22 109.671 175.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 10.5 m-30 -55.63 -61.28 2.46 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.343 0.497 . . . . 8.55 112.343 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -69.49 -33.95 73.62 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 119.165 0.893 . . . . 5.97 112.025 -169.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 64.6 p -61.44 -55.53 30.31 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 108.449 -0.945 . . . . 4.54 108.449 170.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -55.44 -38.11 68.59 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.046 0.839 . . . . 4.18 112.038 -177.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.32 -19.7 9.44 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 127.417 2.287 . . . . 2.31 112.323 176.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -17.54 10.17 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.609 1.163 . . . . 4.29 112.444 170.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . 0.416 ' CB ' ' HG3' ' B' ' 37' ' ' GLU . 0.0 OUTLIER -47.68 -65.62 0.54 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 115.082 1.512 . . . . 2.24 115.082 -173.925 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . 0.342 17.4 mt-10 -82.42 -17.65 44.63 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 118.621 2.823 . . . . 3.22 118.621 -161.574 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.21 -107.16 0.58 Allowed Glycine 0 C--N 1.338 0.655 1 C-N-CA 133.601 5.381 . . . . 5.14 114.093 -4.521 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.26 86.6 0.13 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 107.525 -1.287 . . . . 5.26 107.525 -175.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 14.6 pttm -81.95 14.47 2.74 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 115.558 1.688 . . . . 4.79 115.558 -157.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 21.5 p-10 -120.11 -49.19 2.3 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 124.131 0.972 . . . . 3.09 109.158 171.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 85.1 p -68.63 131.38 45.11 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 123.404 0.682 . . . . 2.01 110.458 -179.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.6 mp -94.04 112.34 24.16 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 106.675 -1.602 . . . . 3.96 106.675 164.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 42.0 m -81.69 -174.36 4.96 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 128.183 2.593 . . . . 3.33 107.775 178.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 75.5 t -68.15 -95.5 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.432 0 N-CA-C 103.575 -2.75 . . . . 4.05 103.575 -171.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -72.44 70.12 0.87 Allowed 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 120.659 1.572 . . . . 2.88 108.724 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . 0.416 ' HG3' ' CB ' ' B' ' 26' ' ' GLN . 25.8 tt0 -159.0 -56.0 0.06 Allowed 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 131.54 3.936 . . . . 2.53 104.282 178.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . 0.405 ' CE2' ' CE2' ' B' ' 76' ' ' TYR . 0.8 OUTLIER -60.19 -51.74 68.31 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.478 -0.934 . . . . 3.68 108.478 166.996 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 50.2 tttt -59.42 -32.64 70.37 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 119.285 -0.966 . . . . 3.71 111.894 -169.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -55.3 -34.46 64.15 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.705 -0.622 . . . . 3.31 112.424 174.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.4 tt -69.73 -45.17 68.76 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.111 0.869 . . . . 3.05 109.262 -176.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 30.4 m -68.12 -36.9 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 N-CA-C 109.447 -0.575 . . . . 2.13 109.447 -175.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 99.4 m -62.51 -60.51 3.43 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 122.639 0.376 . . . . 2.33 111.268 169.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -82.47 -59.11 2.64 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.759 0.824 . . . . 2.46 112.938 -164.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -81.67 -32.75 31.64 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.022 0.929 . . . . 3.52 112.34 -165.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 13.6 tp -82.82 -14.61 0.21 Allowed Pre-proline 0 CA--C 1.545 0.753 0 N-CA-C 118.816 2.895 . . . . 2.45 118.816 -164.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -40.14 -62.95 0.32 Allowed 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 125.277 3.985 . . . . 2.77 117.857 -132.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 12.4 t-160 -88.8 54.0 2.88 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 119.975 1.261 . . . . 4.64 110.534 -156.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 14.2 tp -145.57 -107.24 0.1 Allowed 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 123.727 0.811 . . . . 2.07 109.981 -166.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 2.4 mp -69.42 92.95 0.63 Allowed 'General case' 0 CA--C 1.531 0.242 0 O-C-N 120.913 -1.117 . . . . 3.34 110.483 178.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.01 149.47 0.04 OUTLIER 'General case' 0 C--O 1.237 0.42 0 C-N-CA 125.443 1.497 . . . . 6.98 113.476 174.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 19.4 t0 54.8 41.65 31.75 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 123.205 1.479 . . . . 5.0 107.335 176.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 17.0 m 35.8 45.93 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 C-N-CA 127.739 2.416 . . . . 4.18 113.093 -170.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 68.33 8.2 54.47 Favored Glycine 0 CA--C 1.526 0.735 0 C-N-CA 125.414 1.483 . . . . 8.43 114.865 177.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . 0.274 0.5 OUTLIER 49.35 66.07 1.22 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 123.493 1.616 . . . . 4.23 110.044 -175.525 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.32 -26.49 3.14 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.11 1.764 . . . . 3.18 114.123 -178.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -50.03 -74.33 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.983 0.913 . . . . 4.15 112.35 166.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -50.28 -45.35 54.34 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 119.211 0.914 . . . . 3.34 109.585 173.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.23 -39.21 85.86 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 118.834 -0.603 . . . . 3.57 111.644 -172.612 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 5.0 ttt -55.3 -45.15 76.28 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 119.4 1.0 . . . . 2.87 108.744 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.48 -43.13 98.18 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.112 -0.993 . . . . 5.64 111.121 175.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 2.6 m -58.72 -41.67 86.9 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.859 0.754 . . . . 2.44 112.853 176.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 33.3 mt -82.68 -60.13 2.28 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.886 1.674 . . . . 2.67 111.457 -172.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.282 4.3 t0 -64.85 -7.21 10.35 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.662 2.385 . . . . 2.48 116.506 -157.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.1 m -36.61 -25.36 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 130.985 3.714 . . . . 2.9 117.841 -154.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 35.8 p30 -65.8 -20.69 66.35 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 120.088 1.313 . . . . 4.16 112.332 175.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 112.57 -43.72 0.0 OUTLIER 'General case' 0 C--N 1.344 0.354 0 C-N-CA 129.331 3.052 . . . . 5.72 111.169 164.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -46.56 117.82 1.76 Allowed 'General case' 0 C--O 1.232 0.183 0 C-N-CA 123.763 0.825 . . . . 3.87 109.441 173.085 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 7.8 t -70.04 63.74 0.22 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.515 1.926 . . . . 3.28 110.637 -176.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -161.26 118.9 2.32 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 127.769 2.427 . . . . 3.26 105.251 -171.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -87.96 110.77 20.82 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.082 -1.081 . . . . 2.86 108.082 174.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -82.33 158.76 23.28 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 107.377 -1.342 . . . . 7.74 107.377 170.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -86.04 56.89 4.18 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.171 -0.956 . . . . 5.37 111.566 169.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -152.82 49.3 0.73 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 119.987 -0.685 . . . . 2.87 109.868 111.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -93.28 -61.94 1.47 Allowed 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 127.437 2.295 . . . . 2.53 107.678 134.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.405 ' CE2' ' CE2' ' B' ' 38' ' ' PHE . 16.2 t80 -46.23 -40.79 11.97 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 127.584 2.354 . . . . 4.51 111.99 -174.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.554 ' CZ2' ' CE2' ' A' ' 77' ' ' TRP . 41.7 t90 -50.91 -35.41 32.93 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 112.668 0.618 . . . . 5.3 112.668 -175.348 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -45.18 -33.79 2.44 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 122.893 0.477 . . . . 5.16 111.943 174.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 17.7 tp -60.86 -48.12 83.26 Favored 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 124.645 1.178 . . . . 2.37 108.89 -175.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . 0.296 5.2 pt -71.78 -18.01 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.376 0 C-N-CA 117.6 -1.64 . . . . 4.05 108.477 -175.384 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.47 ' HA2' ' CE2' ' A' ' 77' ' ' TRP . . . -67.7 -47.49 61.27 Favored Glycine 0 N--CA 1.443 -0.857 0 C-N-CA 125.108 1.337 . . . . 1.91 110.241 172.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -56.66 -63.13 1.3 Allowed 'General case' 0 N--CA 1.44 -0.956 0 CA-C-O 117.089 -1.434 . . . . 3.22 107.756 168.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 8.6 mp -41.76 -56.24 2.74 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 121.0 1.727 . . . . 3.18 113.286 -177.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.87 -28.01 63.78 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 125.159 1.383 . . . . 2.17 112.198 -176.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.77 -60.84 2.22 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 118.145 -0.931 . . . . 3.37 109.941 164.556 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -59.3 -24.35 63.22 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.807 0.843 . . . . 2.29 112.465 -158.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 11.4 tt -45.85 -53.09 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 CA-C-N 118.569 0.622 . . . . 2.04 111.249 164.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 49.5 ttt85 -85.21 -61.47 1.76 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.407 1.883 . . . . 6.52 113.957 171.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 49.8 tttp . . . . . 0 CA--C 1.538 0.484 0 C-N-CA 124.316 1.046 . . . . 5.41 111.749 -166.803 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 N--CA 1.446 -0.64 0 CA-C-O 119.527 -0.273 . . . . 4.91 110.777 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.64 110.52 2.91 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 122.888 2.392 . . . . 3.01 110.452 -177.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.2 mt -70.58 159.72 33.82 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.141 0.976 . . . . 2.58 109.614 173.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.6 t -72.89 165.74 24.35 Favored 'General case' 0 N--CA 1.464 0.264 0 O-C-N 121.545 -0.722 . . . . 2.11 109.457 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -57.19 -47.12 82.06 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 118.991 0.814 . . . . 4.07 109.657 -177.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mp -57.45 -58.39 8.48 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 117.755 -1.117 . . . . 2.85 111.222 178.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -49.25 -56.03 10.72 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.097 1.359 . . . . 2.56 110.419 177.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.1 tp10 -52.55 -52.37 55.23 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.922 1.689 . . . . 3.23 110.379 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.2 p -67.05 -45.2 78.14 Favored 'General case' 0 C--O 1.234 0.245 0 O-C-N 121.762 -0.587 . . . . 2.22 111.261 -176.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.296 2.9 pp -62.88 -36.55 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 O-C-N 121.421 -0.8 . . . . 1.96 109.432 177.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -60.11 -57.83 11.12 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 118.863 0.756 . . . . 2.84 109.94 171.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -54.37 -36.33 63.77 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.42 1.009 . . . . 2.14 111.989 -171.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.3 m -73.92 -47.4 43.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 O-C-N 121.467 -0.77 . . . . 1.71 110.833 172.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.8 t -50.59 -50.21 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-N 119.309 0.959 . . . . 1.68 111.622 177.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.4 t -60.03 -44.28 94.73 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.941 0.791 . . . . 2.26 110.479 176.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 63.7 m -52.67 -51.89 58.26 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.641 1.109 . . . . 2.16 109.215 174.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -56.6 -55.67 31.03 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 122.995 0.518 . . . . 8.65 110.732 178.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -68.06 -44.49 76.25 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 125.298 1.439 . . . . 4.07 110.646 -166.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 66.4 p -56.17 -57.82 10.56 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.389 -0.967 . . . . 4.64 108.389 170.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -52.7 -40.91 63.41 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 122.662 0.385 . . . . 4.08 111.959 -178.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.89 -16.83 32.37 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 128.323 2.649 . . . . 2.21 112.802 -178.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.5 -28.94 67.49 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 118.24 -0.886 . . . . 4.29 111.625 169.012 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -41.92 -62.89 0.82 Allowed 'General case' 0 C--N 1.344 0.348 0 C-N-CA 124.289 1.035 . . . . 2.49 113.055 -167.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 63.5 mt-10 -124.11 177.49 5.79 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 126.193 1.797 . . . . 2.89 107.502 -177.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -15.2 125.28 0.01 OUTLIER Glycine 0 CA--C 1.533 1.176 0 C-N-CA 127.852 2.644 . . . . 1.73 115.187 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? 64.1 105.53 0.03 OUTLIER 'General case' 0 C--O 1.237 0.43 0 C-N-CA 124.482 1.113 . . . . 4.84 112.214 177.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -67.15 60.02 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.856 0.862 . . . . 4.82 111.18 166.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -164.37 -64.83 0.04 OUTLIER 'General case' 0 N--CA 1.458 -0.066 0 C-N-CA 125.593 1.557 . . . . 3.71 107.322 -177.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 p -85.52 159.72 19.84 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 125.157 1.383 . . . . 2.11 110.836 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -100.12 175.66 5.67 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 107.761 -1.2 . . . . 3.24 107.761 172.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.9 t -144.33 179.78 7.03 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 126.781 2.033 . . . . 2.66 106.277 177.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 67.7 t -47.81 -64.02 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 123.533 0.733 . . . . 3.29 111.467 -175.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -66.57 -50.76 62.05 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 119.163 -0.446 . . . . 2.75 110.267 -176.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -39.01 -50.67 1.8 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.169 0.988 . . . . 2.19 113.139 170.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -65.27 -51.63 59.52 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.953 0.901 . . . . 4.05 109.169 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 41.6 tttm -56.98 -42.25 79.87 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 120.64 -0.424 . . . . 4.33 110.171 -175.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -50.3 -42.2 52.13 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.49 0.716 . . . . 3.24 111.604 174.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 tp -61.47 -48.15 82.43 Favored 'General case' 0 CA--C 1.527 0.076 0 O-C-N 120.663 -1.273 . . . . 3.82 109.357 -175.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.5 m -72.75 -45.71 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 CA-C-O 121.681 0.753 . . . . 2.07 109.43 -172.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 84.2 m -64.71 -45.37 86.85 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.211 1.004 . . . . 2.03 110.035 -177.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -81.18 -60.33 2.32 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.109 0.964 . . . . 3.46 110.734 -174.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -111.97 57.11 0.64 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.853 0.861 . . . . 5.53 112.478 -175.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 tp -159.1 81.17 2.65 Favored Pre-proline 0 CA--C 1.542 0.647 0 O-C-N 121.057 -1.027 . . . . 2.8 109.428 167.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -75.35 -44.41 0.31 Allowed 'Trans proline' 0 N--CA 1.452 -0.943 0 C-N-CA 123.302 2.668 . . . . 2.14 112.048 -167.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 35.8 t-80 -109.79 -74.88 0.64 Allowed 'General case' 0 C--N 1.343 0.319 0 CA-C-N 118.499 0.591 . . . . 4.25 110.523 176.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 7.2 tp 8.45 -91.78 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.969 2.508 . . . . 2.08 116.972 -166.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.4 mt -79.67 -27.66 40.79 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.382 1.073 . . . . 3.06 111.707 -178.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 42.5 mmtt 53.33 -166.42 0.07 Allowed 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 125.092 1.357 . . . . 9.33 110.073 -156.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.4 t0 58.7 52.08 7.11 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-O 125.021 2.343 . . . . 3.85 109.705 172.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.57 -1.17 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 CA-C-N 111.529 -2.578 . . . . 4.09 110.318 163.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.87 -66.37 1.45 Allowed Glycine 0 C--N 1.342 0.888 0 C-N-CA 125.527 1.536 . . . . 1.88 110.747 171.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 t -78.1 68.22 4.09 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.486 1.143 . . . . 2.44 108.964 -176.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -81.29 -36.08 30.26 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 125.118 1.367 . . . . 2.28 110.98 -172.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -53.96 -44.04 70.39 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.693 -0.629 . . . . 3.97 112.014 -175.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -57.53 -42.64 83.3 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.36 -0.838 . . . . 3.88 111.912 174.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.82 -49.41 76.4 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.217 -0.927 . . . . 4.04 109.043 172.383 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 10.3 ttt -49.66 -45.83 49.07 Favored 'General case' 0 C--O 1.22 -0.453 0 N-CA-C 110.055 -0.35 . . . . 2.68 110.055 178.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -62.68 -37.69 87.42 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.251 0.62 . . . . 4.21 111.224 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.8 t -58.15 -40.69 82.01 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 118.667 0.667 . . . . 4.03 110.358 170.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.7 mt -73.94 -78.84 0.09 Allowed 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.671 -0.643 . . . . 3.63 111.003 178.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -77.77 67.87 3.73 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.803 2.041 . . . . 2.14 110.006 -174.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 15.5 m -57.26 -19.65 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 113.349 0.87 . . . . 4.01 113.349 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -92.54 -9.69 40.33 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.898 1.279 . . . . 3.65 113.259 176.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 48.81 56.6 7.44 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.644 1.111 . . . . 4.21 111.624 -176.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 56.8 p-10 -95.36 -9.87 31.68 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.004 0.522 . . . . 2.25 110.265 170.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.2 m 63.61 20.73 12.39 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.595 1.158 . . . . 2.87 111.912 -173.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.63 111.49 16.28 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 105.346 -2.094 . . . . 3.25 105.346 171.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -84.84 93.64 8.55 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.025 -1.842 . . . . 2.28 106.025 173.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.22 155.6 4.79 Favored 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 123.565 0.746 . . . . 4.91 109.225 174.087 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -46.27 -55.54 7.05 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 119.099 0.863 . . . . 6.31 112.916 -172.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -60.09 -42.34 94.44 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.126 0.965 . . . . 2.31 111.472 176.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -59.89 -42.52 93.98 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.025 1.73 . . . . 3.13 110.066 -176.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -66.73 -52.59 42.64 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 124.956 1.302 . . . . 3.65 109.63 172.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.506 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 1.7 t-105 -42.99 -42.95 3.97 Favored 'General case' 0 C--N 1.344 0.365 0 O-C-N 123.735 0.647 . . . . 5.52 109.819 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 44.0 mtt180 -37.0 -50.3 0.88 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.302 1.041 . . . . 5.22 111.447 -174.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.2 tp -45.36 -48.92 13.32 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 123.611 0.764 . . . . 1.99 110.941 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.0 mp -69.02 -34.2 62.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 C-N-CA 124.91 1.284 . . . . 3.15 109.055 -173.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -63.55 -43.97 97.27 Favored Glycine 0 N--CA 1.442 -0.902 0 N-CA-C 110.733 -0.947 . . . . 1.32 110.733 172.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -59.89 -49.32 78.16 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 118.796 -0.621 . . . . 3.02 109.692 173.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 29.3 mt -49.25 -48.42 45.75 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.789 1.177 . . . . 3.45 112.448 -179.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.18 -25.92 35.69 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.416 0.686 . . . . 1.98 112.217 177.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -81.25 -58.26 3.13 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.292 1.837 . . . . 3.53 109.848 168.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -49.71 -38.89 35.09 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.662 1.585 . . . . 2.54 113.048 -172.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.6 tt -49.42 -37.03 10.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 112.223 0.453 . . . . 2.15 112.223 176.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -98.43 -44.85 6.35 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.961 1.304 . . . . 6.89 110.451 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 35.8 tttp . . . . . 0 CA--C 1.535 0.376 0 C-N-CA 126.114 1.766 . . . . 3.61 109.792 178.278 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 38.9 mt . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 111.717 0.265 . . . . 3.36 111.717 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 6.5 t -90.9 -66.6 0.91 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.39 2.276 . . . . 2.71 115.07 -173.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -169.9 -75.66 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.92 0.888 . . . . 2.18 108.69 -162.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mt -56.83 -45.44 82.35 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 120.828 -1.17 . . . . 2.26 109.774 165.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -50.77 -48.78 59.25 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.932 0.893 . . . . 3.13 110.768 170.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -58.18 -45.74 87.0 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.085 -1.009 . . . . 3.64 110.791 176.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -60.24 -47.68 84.96 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 124.255 1.022 . . . . 2.32 110.752 -177.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.285 2.9 pp -61.68 -33.21 56.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 120.322 -0.551 . . . . 2.04 110.319 174.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.7 -58.97 5.96 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 118.687 0.676 . . . . 2.64 111.404 172.351 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 t -51.02 -40.1 57.39 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.386 0.994 . . . . 1.84 111.559 -168.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.16 -43.58 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 O-C-N 121.366 -0.834 . . . . 1.96 111.802 174.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 37.9 t -54.31 -58.37 3.91 Favored 'Isoleucine or valine' 0 C--N 1.341 0.21 0 CA-C-N 118.572 0.624 . . . . 1.9 110.334 174.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 13.8 t -56.23 -47.22 78.88 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 118.667 -0.682 . . . . 2.01 110.562 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 98.3 m -58.49 -44.34 89.36 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 119.651 1.114 . . . . 2.14 111.82 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -66.06 -43.82 86.32 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 117.952 -1.499 . . . . 5.56 110.131 175.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -57.81 -46.49 84.59 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.119 0.968 . . . . 4.27 111.824 -174.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 31.4 p -62.28 -25.43 67.85 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.392 -0.817 . . . . 2.8 111.654 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -80.52 -46.17 16.26 Favored 'General case' 0 C--O 1.224 -0.254 0 O-C-N 121.978 -0.451 . . . . 4.59 110.491 170.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.03 -25.41 58.57 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 127.787 2.435 . . . . 1.95 111.938 -178.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -45.09 -37.37 4.22 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.783 1.233 . . . . 5.31 111.021 171.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.93 -70.02 0.2 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 116.708 2.114 . . . . 3.29 116.708 -142.032 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -92.53 -74.3 0.52 Allowed 'General case' 0 C--N 1.34 0.185 0 C-N-CA 119.089 -1.044 . . . . 3.59 113.463 -166.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.38 152.86 22.95 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 126.384 1.945 . . . . 2.37 109.17 164.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 29.9 ttt180 43.37 100.64 0.0 OUTLIER 'General case' 0 C--O 1.241 0.63 0 C-N-CA 125.158 1.383 . . . . 4.66 113.992 146.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 59.9 pttt -61.06 -22.32 64.49 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 114.538 1.31 . . . . 4.18 114.538 -168.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -77.59 -25.52 50.0 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.488 0.551 . . . . 4.09 112.488 177.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 96.4 p -83.84 141.78 31.09 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 117.88 -1.057 . . . . 2.8 110.836 -172.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -93.31 115.34 27.92 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 106.124 -1.806 . . . . 3.1 106.124 149.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 9.1 t -99.92 177.67 5.04 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.047 0.539 . . . . 2.47 109.671 161.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 11.5 p -85.76 50.81 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 O-C-N 120.724 -1.235 . . . . 3.59 111.423 -173.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -159.75 53.28 0.36 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 107.38 -1.341 . . . . 2.74 107.38 147.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -160.48 -55.39 0.05 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 130.08 3.352 . . . . 1.83 103.444 -174.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.3 -50.58 73.43 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.401 -1.272 . . . . 3.42 109.643 169.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -62.65 -47.59 83.04 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 120.215 -0.594 . . . . 3.8 109.546 -171.235 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -39.91 -48.35 2.32 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.233 0.613 . . . . 4.26 112.078 167.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.8 tp -58.63 -49.27 78.13 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.906 -0.775 . . . . 2.87 108.906 -172.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 4.6 m -74.25 -54.56 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-N 115.703 -0.68 . . . . 1.81 109.933 -173.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 63.5 m -53.03 -46.12 68.3 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.599 1.16 . . . . 1.83 110.878 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -80.84 -62.39 1.68 Allowed 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 122.989 0.516 . . . . 2.2 111.156 -173.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -84.28 -42.28 16.0 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 115.633 1.716 . . . . 4.51 115.633 -163.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -44.31 -46.2 23.15 Favored Pre-proline 0 N--CA 1.474 0.736 0 N-CA-C 115.576 1.695 . . . . 3.18 115.576 -155.282 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -77.74 -29.45 4.48 Favored 'Trans proline' 0 N--CA 1.449 -1.13 0 CA-C-N 120.827 1.331 . . . . 2.89 109.477 -42.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 19.6 t60 -89.02 -49.69 6.62 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 125.224 1.41 . . . . 3.66 110.844 -168.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . 0.445 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 6.3 tp -34.24 -60.27 0.41 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.853 2.061 . . . . 2.28 113.852 -171.042 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 54.9 mt -96.16 111.82 23.74 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 108.239 -1.023 . . . . 2.03 108.239 172.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -64.49 154.46 35.82 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 120.237 -0.585 . . . . 6.18 109.582 165.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 17.0 t0 61.17 82.94 0.16 Allowed 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.425 1.49 . . . . 4.6 109.684 -168.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 29.5 m -96.78 21.94 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.786 0 CA-C-N 113.542 -1.663 . . . . 3.22 109.601 166.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -110.79 -65.93 0.53 Allowed Glycine 0 C--N 1.343 0.954 0 N-CA-C 109.605 -1.398 . . . . 3.71 109.605 -174.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -81.67 46.3 0.96 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.131 0.972 . . . . 5.18 109.803 -179.01 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -55.09 -42.28 72.67 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.189 0.996 . . . . 3.1 109.519 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -25.78 -51.26 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.348 1.859 . . . . 4.37 113.69 164.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -52.88 -56.51 15.32 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.986 0.812 . . . . 3.28 111.448 174.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -53.79 51.65 Favored 'General case' 0 C--O 1.224 -0.262 0 N-CA-C 108.236 -1.024 . . . . 5.6 108.236 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -50.67 -53.21 32.98 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 125.386 1.474 . . . . 4.14 111.015 -178.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -61.07 -30.8 70.55 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.366 0.666 . . . . 4.69 111.235 -178.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.2 t -71.82 -55.22 7.98 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 109.831 -0.433 . . . . 2.84 109.831 173.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 33.6 mt -51.9 -44.13 63.64 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.599 1.56 . . . . 2.77 111.446 -179.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.271 22.9 t0 -50.23 -8.7 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 118.105 2.631 . . . . 1.88 118.105 -173.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 23.3 m -32.92 -20.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.755 1 C-N-CA 132.074 4.15 . . . . 3.4 119.14 -133.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -50.02 -39.81 42.66 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 119.792 1.178 . . . . 3.29 109.544 156.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 62.3 63.43 1.05 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.633 1.573 . . . . 4.03 109.021 -171.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -116.93 -8.57 11.27 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.333 2.253 . . . . 2.7 112.754 -175.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 2.1 t 92.19 -7.42 0.2 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.068 2.147 . . . . 3.53 113.239 178.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -129.65 119.56 23.75 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 119.207 0.912 . . . . 4.42 110.736 -175.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.59 105.72 14.74 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 107.634 -1.247 . . . . 2.36 107.634 176.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -84.0 175.06 9.81 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.852 1.661 . . . . 4.31 110.971 -175.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -81.61 56.7 3.08 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.668 0.787 . . . . 5.72 110.643 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -168.83 45.89 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.855 0.836 . . . . 3.12 110.178 110.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -90.73 -61.36 1.69 Allowed 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 127.006 2.122 . . . . 2.21 107.779 153.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -50.87 -38.17 47.79 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 114.648 -1.16 . . . . 4.31 111.224 -170.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.464 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 5.1 t90 -38.86 -48.17 1.51 Allowed 'General case' 0 CA--C 1.541 0.604 0 O-C-N 124.562 1.164 . . . . 5.54 109.906 177.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 14.1 mmt-85 -42.02 -39.12 1.82 Allowed 'General case' 0 C--O 1.223 -0.311 0 CA-C-O 118.317 -0.849 . . . . 7.78 112.959 -176.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 6.5 tp -55.5 -47.68 75.81 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.091 1.314 . . . . 2.05 111.732 177.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 1.4 mt -69.93 -34.88 62.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 O-C-N 120.92 -1.113 . . . . 2.89 108.701 178.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -41.32 -52.31 4.32 Favored Glycine 0 C--N 1.345 1.029 0 C-N-CA 126.075 1.798 . . . . 2.07 110.216 168.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -76.67 -60.31 2.4 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 112.031 -2.085 . . . . 2.71 108.842 -175.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . 0.445 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 6.5 mp -37.44 -58.46 0.85 Allowed 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 120.767 1.621 . . . . 3.35 112.688 -172.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.91 -28.62 69.65 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.347 1.059 . . . . 2.25 112.67 -176.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -80.32 -51.79 8.47 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.668 0.787 . . . . 2.72 110.092 172.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -51.48 -44.47 62.48 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.292 1.037 . . . . 3.52 112.028 -176.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 8.9 tt -52.92 -38.59 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 118.926 0.785 . . . . 1.82 111.722 175.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.75 -30.75 26.42 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.827 1.651 . . . . 4.19 113.892 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 53.2 tttp . . . . . 0 CA--C 1.536 0.43 0 C-N-CA 125.785 1.634 . . . . 5.46 111.936 -163.469 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 . . . . . 0 N--CA 1.442 -0.869 0 CA-C-O 118.316 -0.849 . . . . 5.39 109.117 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -70.04 140.77 42.43 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 121.96 1.773 . . . . 2.71 108.769 175.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.0 mt -99.3 176.03 5.67 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.394 -0.965 . . . . 2.59 108.394 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.5 t -70.47 162.74 28.19 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 120.952 -1.092 . . . . 2.12 109.749 178.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -56.44 -50.19 72.4 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.649 0.738 . . . . 2.02 110.474 -170.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.6 mt -60.74 -46.55 90.0 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 117.251 -1.357 . . . . 2.63 111.945 176.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -49.65 -55.13 14.83 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 120.656 1.571 . . . . 2.24 112.171 172.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -50.55 -52.53 38.0 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.663 0.744 . . . . 4.04 109.299 176.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.4 t -57.6 -50.86 71.75 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.285 -0.87 . . . . 2.52 111.441 -176.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.2 pp -66.37 -39.05 83.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 CA-C-O 118.169 -0.92 . . . . 1.83 111.07 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -58.89 -55.61 32.85 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 119.619 1.1 . . . . 2.98 109.93 178.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 15.0 t -54.13 -38.84 65.9 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.625 0.648 . . . . 2.26 112.456 -174.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 m -75.03 -40.54 45.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 O-C-N 120.714 -1.241 . . . . 1.94 111.148 175.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.2 t -57.83 -49.54 80.65 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 CA-C-N 119.196 0.907 . . . . 1.9 110.461 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.2 t -60.12 -44.94 94.5 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.828 0.74 . . . . 1.66 110.538 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 62.0 m -58.02 -56.47 21.56 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.759 -0.588 . . . . 1.81 110.192 177.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -43.63 -56.3 3.81 Favored 'General case' 0 N--CA 1.458 -0.065 0 C-N-CA 125.009 1.324 . . . . 4.48 110.299 172.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -58.1 -52.86 63.77 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.076 0.95 . . . . 4.08 110.261 -174.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.5 t -65.15 -33.22 75.51 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.195 -0.602 . . . . 2.62 111.538 -177.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -61.47 -50.94 70.72 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.842 0.746 . . . . 3.96 110.473 168.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.01 -19.68 63.11 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.712 1.605 . . . . 1.86 112.26 -175.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.68 -18.96 58.24 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.557 1.543 . . . . 4.72 112.054 176.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.71 -69.39 0.13 Allowed 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.953 0.797 . . . . 3.88 112.171 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -111.26 171.25 7.59 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 125.73 1.612 . . . . 2.61 107.082 -172.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -20.75 131.57 0.01 OUTLIER Glycine 0 CA--C 1.53 1.019 0 C-N-CA 127.338 2.399 . . . . 1.9 114.333 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.3 mmm-85 64.92 103.25 0.04 OUTLIER 'General case' 0 C--O 1.237 0.438 0 C-N-CA 124.699 1.2 . . . . 7.78 111.502 178.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.9 pttm -73.21 56.2 0.46 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.85 0.86 . . . . 4.31 111.439 173.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -163.38 -54.62 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.309 1.443 . . . . 3.64 108.229 -176.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 97.8 p -83.91 150.29 25.79 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-O 121.213 0.53 . . . . 2.32 111.295 175.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -96.51 126.27 41.58 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 107.611 -1.255 . . . . 2.98 107.611 168.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 t -83.37 177.42 8.5 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 109.554 -0.536 . . . . 2.86 109.554 164.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.7 p -61.42 -49.62 83.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 O-C-N 121.963 -0.46 . . . . 3.02 111.517 -171.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -63.49 -54.2 40.05 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 108.333 -0.988 . . . . 3.64 108.333 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -36.97 -51.83 0.93 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 125.238 1.415 . . . . 1.93 111.53 172.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -61.87 -53.97 48.54 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.511 -0.768 . . . . 3.55 110.791 177.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.6 ttmm -56.32 -41.8 76.61 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.944 -0.472 . . . . 3.27 110.219 -176.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -55.41 -36.31 66.31 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 122.768 0.427 . . . . 3.3 111.145 178.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.1 tt -68.17 -48.26 65.8 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 119.403 1.001 . . . . 3.54 109.737 -178.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.1 m -67.15 -39.94 84.18 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 N-CA-C 109.507 -0.553 . . . . 1.88 109.507 -176.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 95.0 m -63.37 -52.94 59.62 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 124.011 0.924 . . . . 2.13 110.69 176.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -78.34 -54.78 5.82 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.505 0.722 . . . . 2.72 111.257 -167.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -120.32 43.11 2.8 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.498 0.719 . . . . 3.57 111.045 -163.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 tp -153.18 61.07 3.48 Favored Pre-proline 0 CA--C 1.542 0.671 0 O-C-N 121.885 -0.509 . . . . 2.56 111.013 177.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -66.72 -43.82 6.77 Favored 'Trans proline' 0 N--CA 1.453 -0.858 0 C-N-CA 124.169 3.246 . . . . 2.02 115.385 -165.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -132.27 26.98 4.49 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 120.008 1.276 . . . . 4.35 112.281 -166.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 11.5 tp -99.93 -75.99 0.56 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 122.566 0.347 . . . . 2.35 110.796 -168.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.0 mp -91.74 -175.94 4.31 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.639 1.175 . . . . 3.01 108.604 166.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -134.74 -160.76 1.08 Allowed 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 106.93 -1.507 . . . . 6.41 106.93 159.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 69.15 26.94 5.38 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.639 1.575 . . . . 3.78 111.291 171.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -68.38 -8.97 10.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.939 1.295 . . . . 2.98 112.962 -174.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.65 -64.28 4.24 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 108.792 -1.723 . . . . 2.02 108.792 166.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.89 53.65 0.12 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 129.191 2.996 . . . . 3.21 111.646 178.384 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -74.31 -26.36 60.12 Favored 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 124.985 1.314 . . . . 1.91 109.33 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -54.14 -46.36 72.22 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.663 1.185 . . . . 4.23 111.224 176.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -50.12 -54.85 17.78 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.788 0.804 . . . . 2.87 109.7 174.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.02 -47.93 83.44 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.412 -0.813 . . . . 6.02 109.966 -177.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 7.4 tmm? -51.12 -58.42 6.16 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.965 1.306 . . . . 3.22 109.455 176.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.9 mttt -52.83 -44.18 66.51 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.422 1.089 . . . . 4.2 110.983 178.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.1 m -65.68 -38.99 90.8 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.173 0.589 . . . . 2.91 111.839 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 34.8 mt -77.9 -47.09 19.53 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.501 1.12 . . . . 2.87 111.708 -175.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -72.47 91.46 1.38 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 123.455 0.702 . . . . 2.34 110.194 -170.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.2 m -55.38 -37.55 45.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 C-N-CA 122.796 0.438 . . . . 3.25 112.143 -167.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -97.26 -0.88 45.9 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.762 0.653 . . . . 2.84 112.762 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 46.21 48.74 13.02 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.489 1.515 . . . . 5.24 111.806 -178.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.4 p30 -90.84 -12.62 35.76 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.207 1.003 . . . . 1.78 110.685 168.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 35.4 p 70.47 7.05 6.07 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 127.52 2.328 . . . . 3.29 114.074 -176.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -95.06 112.82 24.48 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 104.741 -2.318 . . . . 2.93 104.741 160.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -80.74 96.67 7.01 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 103.766 -2.679 . . . . 2.29 103.766 171.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.15 158.32 2.27 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.481 -0.933 . . . . 4.54 108.481 171.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.1 p90 -38.94 -52.41 1.78 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.879 1.271 . . . . 7.57 111.915 -179.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -70.36 -35.17 73.39 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.181 0.592 . . . . 2.07 112.494 -179.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -65.13 -51.73 59.52 Favored 'General case' 0 C--O 1.227 -0.129 0 O-C-N 121.643 -0.661 . . . . 2.15 109.257 176.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -56.1 -49.86 72.68 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.788 0.435 . . . . 4.42 110.058 178.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 0.7 OUTLIER -40.02 -44.0 1.66 Allowed 'General case' 0 CA--C 1.535 0.402 0 O-C-N 124.164 0.915 . . . . 5.19 110.691 179.169 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -42.58 -40.49 2.7 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 114.176 1.176 . . . . 4.46 114.176 178.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 60.4 tp -46.19 -51.23 14.59 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 119.252 0.933 . . . . 2.0 111.107 175.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 78.1 mt -57.38 -28.94 31.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 124.656 1.182 . . . . 2.64 107.824 -175.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.503 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -76.99 -48.89 8.03 Favored Glycine 0 N--CA 1.44 -1.071 0 N-CA-C 109.607 -1.397 . . . . 1.26 109.607 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -48.61 -52.61 22.16 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-O 117.752 -1.118 . . . . 4.14 108.291 169.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 11.6 mt -49.48 -52.78 26.98 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 120.077 1.308 . . . . 3.68 111.712 178.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.4 -21.32 24.3 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.9 0.88 . . . . 1.85 112.386 176.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.62 -61.5 1.95 Allowed 'General case' 0 C--O 1.221 -0.437 0 CA-C-O 117.434 -1.27 . . . . 3.44 112.956 162.349 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . 0.446 ' CD ' ' HZ2' ' A' ' 89' ' ' LYS . 8.8 mm-40 -54.91 -33.83 62.5 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 125.834 1.654 . . . . 2.93 112.119 -166.103 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.7 tp -38.39 -44.3 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 124.808 1.243 . . . . 2.44 111.465 167.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 51.4 mtt85 -104.67 -58.47 1.88 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 127.044 2.138 . . . . 8.93 110.665 178.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . 0.446 ' HZ2' ' CD ' ' A' ' 86' ' ' GLU . 3.3 ttpm? . . . . . 0 CA--C 1.543 0.695 0 C-N-CA 125.717 1.607 . . . . 4.23 112.784 -175.075 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.0 mt . . . . . 0 CA--C 1.53 0.205 0 N-CA-C 108.68 -0.859 . . . . 3.45 108.68 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 6.4 t -69.15 -65.59 0.69 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.062 0.764 . . . . 2.71 113.062 -174.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -168.82 -75.97 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 108.78 -0.822 . . . . 1.96 108.78 -162.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 mt -57.3 -45.29 84.32 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 120.98 -1.075 . . . . 2.0 109.366 167.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -56.06 -39.11 71.54 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.867 1.267 . . . . 3.46 110.52 174.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -50.89 28.05 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 108.852 -0.795 . . . . 4.46 108.852 -176.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 5.4 p -61.3 -35.48 77.45 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.445 -0.798 . . . . 2.12 110.747 -172.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.332 2.9 pp -62.38 -42.41 95.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-O 118.395 -0.812 . . . . 1.97 111.311 173.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -67.2 -42.94 83.29 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-N 120.763 1.62 . . . . 3.75 110.419 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 16.9 m -43.77 -47.68 8.01 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 119.261 0.937 . . . . 3.5 112.304 175.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 35.2 m -74.02 -37.16 46.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 O-C-N 120.777 -1.202 . . . . 2.09 111.431 177.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 95.6 t -54.85 -49.68 67.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 119.308 0.958 . . . . 2.57 110.242 173.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -64.24 -39.26 93.59 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.494 -0.754 . . . . 2.17 110.656 179.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 34.6 m -58.9 -38.72 79.54 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.78 0.718 . . . . 2.29 111.076 174.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . 0.406 ' CE1' ' CE2' ' B' ' 76' ' ' TYR . 0.0 OUTLIER -60.28 -52.57 64.7 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.183 -0.948 . . . . 5.47 109.165 169.325 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -55.01 -41.04 70.79 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.499 0.72 . . . . 4.31 112.672 -172.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 16.6 p -57.93 -30.26 65.8 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 118.722 -0.656 . . . . 3.43 112.197 177.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -82.07 -34.62 29.3 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 119.376 0.989 . . . . 4.12 112.514 167.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -51.05 -44.6 61.13 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 124.167 0.987 . . . . 2.07 109.949 -174.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -51.49 -38.55 54.5 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 124.545 1.153 . . . . 3.89 112.96 178.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.47 -69.17 0.14 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 116.89 2.181 . . . . 2.18 116.89 -136.574 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -93.15 -76.91 0.46 Allowed 'General case' 0 C--N 1.341 0.204 0 CA-C-O 122.216 1.008 . . . . 3.73 113.652 -173.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.06 153.53 22.37 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 127.593 2.521 . . . . 2.88 109.767 167.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.6 ttt85 45.06 101.63 0.0 OUTLIER 'General case' 0 C--O 1.245 0.824 0 C-N-CA 125.706 1.602 . . . . 5.06 114.028 153.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 58.7 pttt -73.09 59.6 0.53 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.712 1.205 . . . . 4.83 112.113 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -160.98 -61.19 0.06 Allowed 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.173 1.389 . . . . 3.71 108.501 -168.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 55.2 p -97.44 158.71 15.33 Favored 'General case' 0 C--O 1.245 0.842 0 C-N-CA 123.418 0.687 . . . . 2.35 109.648 -173.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 62.6 mt -107.91 157.06 18.51 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 124.491 1.12 . . . . 3.6 109.187 164.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 7.9 t -152.26 178.62 9.31 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 106.684 -1.599 . . . . 3.92 106.684 167.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 3.2 t -83.85 56.84 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 118.743 0.701 . . . . 3.75 112.008 -161.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -156.5 56.4 0.56 Allowed 'General case' 0 C--O 1.225 -0.211 0 N-CA-C 106.782 -1.562 . . . . 2.74 106.782 141.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -173.87 -52.09 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 125.842 1.657 . . . . 1.74 106.703 -166.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -61.6 -53.06 61.34 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.461 -0.79 . . . . 3.52 108.968 168.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 38.4 tttt -57.93 -37.06 73.42 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.57 -0.286 . . . . 3.6 111.08 -174.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -47.35 -36.86 10.09 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.806 0.669 . . . . 3.49 112.806 173.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 6.6 tt -66.45 -51.28 58.56 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 107.799 -1.185 . . . . 3.52 107.799 -175.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 14.3 m -67.4 -46.14 84.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 109.802 -0.444 . . . . 1.88 109.802 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 99.0 m -55.73 -50.73 69.57 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 123.93 0.892 . . . . 2.01 111.517 176.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -76.1 -61.62 1.88 Allowed 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 118.302 0.501 . . . . 3.28 111.111 -174.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 40.4 mm-40 -81.36 -46.44 14.66 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 112.833 0.679 . . . . 3.42 112.833 -157.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -57.77 -36.71 48.17 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 122.874 0.469 . . . . 3.35 111.893 -162.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -45.1 -57.25 2.19 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 119.767 -3.014 . . . . 2.36 108.871 -83.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -55.13 -42.74 73.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 125.251 1.42 . . . . 3.55 112.55 -175.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 35.7 tp -52.09 -47.4 65.24 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 120.951 0.405 . . . . 1.99 110.69 -169.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . 0.4 ' C ' ' H ' ' B' ' 52' ' ' ASP . 92.6 mt -114.96 69.58 0.72 Allowed 'General case' 0 C--O 1.228 -0.067 0 C-N-CA 125.341 1.456 . . . . 2.86 109.067 163.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.94 8.59 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 115.752 1.76 . . . . 5.9 115.752 178.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.4 ' H ' ' C ' ' B' ' 50' ' ' LEU . 30.8 t0 -105.05 89.82 3.25 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 104.733 -2.321 . . . . 3.33 104.733 163.669 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 19.7 m -93.52 14.81 2.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 114.991 -1.004 . . . . 2.44 108.944 166.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -83.36 -73.49 1.24 Allowed Glycine 0 N--CA 1.443 -0.892 0 N-CA-C 107.345 -2.302 . . . . 2.71 107.345 176.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 55.6 m -80.06 54.33 1.9 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.516 1.127 . . . . 3.2 112.076 -169.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.09 -40.89 87.01 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 124.811 1.245 . . . . 2.22 109.143 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -29.43 -66.52 0.09 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 127.164 2.186 . . . . 4.25 114.208 165.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -47.66 -53.11 15.87 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.854 0.835 . . . . 2.86 110.007 177.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -38.28 78.19 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-O 118.427 -0.796 . . . . 5.4 111.12 178.714 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.7 ttp -60.59 -45.64 93.22 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 119.881 1.218 . . . . 4.17 109.843 178.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -61.71 -42.81 99.44 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 120.56 -0.456 . . . . 5.23 110.278 174.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 11.4 m -62.67 -30.47 71.41 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 122.86 0.464 . . . . 2.18 112.029 176.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 8.4 mt -76.45 -59.52 2.73 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.928 1.691 . . . . 2.26 109.627 -178.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.344 2.7 t70 -57.18 -14.42 4.11 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 116.571 2.063 . . . . 2.92 116.571 -159.233 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 28.8 m -34.61 -19.92 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 130.635 3.574 . . . . 3.54 118.951 -132.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -48.98 -42.78 38.87 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 120.531 1.514 . . . . 4.64 110.092 151.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 70.98 55.01 0.23 Allowed 'General case' 0 C--N 1.34 0.189 0 CA-C-O 122.14 0.971 . . . . 4.72 109.23 168.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 16.7 p30 -87.15 -133.21 0.07 Allowed 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 104.636 -2.357 . . . . 4.17 104.636 158.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 61.8 m -146.14 29.11 1.09 Allowed 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.123 -1.611 . . . . 3.62 110.945 165.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -129.94 110.78 11.95 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 127.49 2.316 . . . . 6.28 105.646 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.24 108.39 7.0 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 104.421 -2.437 . . . . 1.97 104.421 177.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.12 175.11 6.9 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.257 1.423 . . . . 4.51 108.947 -178.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 18.9 p90 -86.9 53.05 2.69 Favored 'General case' 0 C--O 1.224 -0.281 0 O-C-N 120.434 -1.417 . . . . 6.7 113.793 -169.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.57 51.64 0.45 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 105.325 -2.102 . . . . 2.77 105.325 127.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.2 -63.94 1.22 Allowed 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.776 -0.824 . . . . 3.11 108.776 152.624 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . 0.406 ' CE2' ' CE1' ' B' ' 20' ' ' PHE . 0.0 OUTLIER -53.55 -35.79 61.13 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.684 0.394 . . . . 8.75 110.865 -170.32 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 67.3 t-105 -38.62 -51.72 1.64 Allowed 'General case' 0 N--CA 1.439 -1.018 0 O-C-N 124.646 1.216 . . . . 5.71 110.744 173.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 -45.99 -48.09 16.64 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.623 -0.673 . . . . 4.93 111.429 177.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 6.7 tp -58.03 -41.28 82.86 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.197 0.599 . . . . 2.05 111.104 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 55.9 mt -64.8 -35.46 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.006 0 N-CA-C 105.945 -1.872 . . . . 2.33 105.945 -176.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.575 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -66.09 -48.2 67.11 Favored Glycine 0 CA--C 1.494 -1.224 0 N-CA-C 110.209 -1.156 . . . . 1.69 110.209 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -62.44 -61.48 2.42 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-O 117.89 -1.053 . . . . 2.31 108.213 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . 0.262 3.8 pp -53.98 -36.22 62.68 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.949 1.25 . . . . 2.93 112.573 -178.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.41 -61.68 2.37 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 119.183 0.901 . . . . 2.19 110.804 170.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 18.3 ttpp -52.92 -41.16 64.16 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.356 1.863 . . . . 2.7 111.594 -175.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -51.08 -33.73 27.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 127.47 2.308 . . . . 3.75 111.463 178.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 7.1 tt -52.7 -40.43 34.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 118.607 0.639 . . . . 2.33 110.226 -176.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -84.85 -61.09 1.86 Allowed 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 121.431 0.634 . . . . 7.43 110.84 164.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 33.5 mttp . . . . . 0 CA--C 1.53 0.186 0 C-N-CA 124.047 0.939 . . . . 6.42 111.486 -168.643 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 . . . . . 0 CA--C 1.538 0.481 0 N-CA-C 108.885 -0.784 . . . . 5.57 108.885 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -76.49 158.19 36.38 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.746 2.297 . . . . 2.99 110.323 -178.424 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 72.3 mt -128.57 166.72 18.3 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.179 1.391 . . . . 2.82 107.925 179.329 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.3 t -72.95 174.48 7.75 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 118.588 0.631 . . . . 2.53 110.163 -179.747 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -68.18 -43.76 77.42 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 122.535 1.159 . . . . 2.74 109.211 -177.25 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.8 mp -61.1 -41.57 96.91 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.361 -0.836 . . . . 3.48 109.962 178.571 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -62.53 -49.12 76.58 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.475 1.11 . . . . 2.52 111.299 175.241 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.72 -52.83 63.82 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 108.359 -0.978 . . . . 5.31 108.359 -179.816 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.4 p -61.68 -40.62 95.6 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.575 -0.284 . . . . 1.99 110.913 -170.317 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.28 2.8 pp -67.1 -39.66 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 O-C-N 121.78 -0.575 . . . . 1.8 110.209 177.974 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -60.89 -51.65 68.4 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.867 0.758 . . . . 3.69 110.018 174.513 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.5 m -44.09 -47.4 8.89 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.697 1.999 . . . . 3.05 112.354 175.625 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 30.4 m -76.33 -35.03 26.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 O-C-N 120.348 -1.47 . . . . 1.78 111.568 177.695 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.6 t -59.97 -42.79 90.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 119.484 1.038 . . . . 1.85 111.148 174.562 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.2 t -61.64 -49.07 78.02 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 120.812 -1.18 . . . . 1.8 109.532 175.201 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.1 m -52.51 -43.4 65.07 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 118.473 0.578 . . . . 1.74 110.613 176.269 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.458 ' HA ' ' CZ ' ' A' ' 23' ' ' PHE . 41.5 t80 -48.43 -57.08 6.61 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 123.683 0.793 . . . . 4.55 110.548 174.767 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -59.56 -41.78 90.93 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 119.724 -0.79 . . . . 4.82 111.388 177.468 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.9 m -53.33 -43.86 67.97 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.576 0.584 . . . . 3.49 112.576 177.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . 0.458 ' CZ ' ' HA ' ' A' ' 20' ' ' PHE . 22.8 p90 -81.58 -43.49 18.59 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 119.324 0.965 . . . . 8.35 113.201 176.158 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.16 -20.73 65.66 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 125.806 1.642 . . . . 1.78 112.16 -169.617 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -17.86 64.45 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 117.571 -1.205 . . . . 5.65 113.622 172.571 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -50.99 -58.18 6.71 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.925 1.239 . . . . 3.37 112.512 -172.308 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -121.6 171.12 9.06 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.286 1.834 . . . . 2.54 107.285 -179.371 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -1.59 106.57 0.01 OUTLIER Glycine 0 CA--C 1.53 0.995 0 C-N-CA 127.443 2.449 . . . . 2.01 114.268 170.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . 0.278 30.5 mtt85 66.11 109.45 0.04 OUTLIER 'General case' 0 C--O 1.239 0.544 0 N-CA-C 114.732 1.382 . . . . 5.87 114.732 167.244 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -62.22 59.95 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.936 0.894 . . . . 6.49 112.051 163.28 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -165.38 -57.82 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 127.048 2.139 . . . . 3.26 106.725 -171.587 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.8 p -84.92 122.75 29.64 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 125.079 1.352 . . . . 3.37 109.382 177.137 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -90.83 156.59 17.92 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 107.715 -1.217 . . . . 3.34 107.715 160.312 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.7 t -152.42 177.91 10.1 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.912 0.885 . . . . 4.26 108.784 172.021 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -39.93 -64.74 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 125.487 1.515 . . . . 3.82 112.955 -168.474 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -60.49 -60.19 4.2 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.195 0.452 . . . . 2.17 110.416 -175.767 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -38.77 -52.28 1.71 Allowed 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.601 1.56 . . . . 1.84 112.296 175.472 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -63.99 -51.74 62.86 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 114.803 -1.09 . . . . 3.97 108.726 -179.416 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -52.56 -44.95 66.2 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.898 0.479 . . . . 4.75 111.185 178.017 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -54.26 -41.44 68.79 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.626 0.648 . . . . 2.23 111.448 175.416 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.4 tp -64.67 -49.73 69.8 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.632 -0.877 . . . . 3.65 108.632 -176.445 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.8 m -65.8 -52.88 44.61 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 108.528 -0.915 . . . . 2.04 108.528 -174.661 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 96.5 m -52.18 -53.18 46.34 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.936 1.294 . . . . 2.9 111.511 178.669 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -75.62 -53.37 8.69 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.42 0.288 . . . . 2.7 110.285 -171.545 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -85.4 -33.66 21.91 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 117.717 -1.135 . . . . 5.88 112.446 -169.789 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.0 mt -103.17 98.3 11.63 Favored Pre-proline 0 CA--C 1.538 0.494 0 CA-C-N 120.368 1.44 . . . . 3.96 111.633 -171.914 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -71.38 -39.15 3.97 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 121.911 1.741 . . . . 1.81 111.918 -178.025 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -141.81 -12.29 0.87 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.477 1.288 . . . . 6.28 114.477 -170.8 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 28.0 tp -66.32 -68.79 0.34 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 119.032 0.833 . . . . 2.69 110.728 -171.353 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 36.9 mt -93.01 100.39 12.83 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 106.252 -1.759 . . . . 2.46 106.252 163.63 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 62.4 mttt -69.12 174.99 4.08 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 120.213 -0.595 . . . . 6.44 109.962 165.405 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 25.4 t0 59.49 50.48 7.46 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 124.593 2.14 . . . . 4.13 108.963 177.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.7 m -58.47 -35.69 55.57 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 CA-C-N 112.338 -2.21 . . . . 2.98 108.414 161.551 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -40.75 -61.69 1.84 Allowed Glycine 0 C--N 1.342 0.91 0 C-N-CA 125.937 1.732 . . . . 1.6 111.783 174.519 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 52.5 m -103.76 43.49 1.08 Allowed 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.755 0.822 . . . . 3.32 111.602 177.397 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -41.05 -43.74 2.25 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 124.252 1.021 . . . . 2.61 109.608 162.611 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -39.41 -41.49 0.96 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 127.88 2.472 . . . . 3.72 112.231 179.083 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -62.09 -54.36 42.43 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 121.686 -0.633 . . . . 5.06 110.561 175.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.95 -50.33 66.72 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 108.304 -0.999 . . . . 3.55 108.304 176.54 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -47.29 -58.16 4.43 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.064 1.745 . . . . 3.44 110.188 -176.766 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.53 -35.16 69.93 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.514 -0.312 . . . . 5.86 111.58 -179.49 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.4 t -73.17 -46.81 48.64 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.864 0.866 . . . . 3.48 111.468 -178.528 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.5 mp -59.26 -48.37 81.87 Favored 'General case' 0 C--O 1.232 0.173 0 O-C-N 121.843 -0.536 . . . . 3.18 109.629 176.584 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -71.21 83.41 0.74 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 120.802 0.334 . . . . 1.86 110.786 -171.549 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.3 m -45.97 -41.32 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 C-N-CA 125.761 1.624 . . . . 3.9 113.941 -173.547 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -96.19 -9.06 31.41 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.26 1.024 . . . . 3.33 111.845 -179.869 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 53.02 35.34 19.2 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.356 1.462 . . . . 4.59 111.67 177.206 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 57.6 p30 -65.96 -16.64 64.05 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.277 1.031 . . . . 2.06 110.765 170.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m 83.73 11.3 0.43 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.616 2.366 . . . . 3.3 112.472 -179.064 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -111.06 132.34 54.32 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 106.884 -1.524 . . . . 3.05 106.884 164.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -95.68 102.46 14.26 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 104.563 -2.384 . . . . 2.37 104.563 163.042 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -100.12 171.36 7.86 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 118.96 0.8 . . . . 4.14 109.88 170.929 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -38.68 -60.33 0.84 Allowed 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.267 1.581 . . . . 6.19 115.267 -155.033 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -70.01 -26.95 64.31 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.567 0.621 . . . . 2.37 112.09 -174.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -73.14 -57.53 3.96 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 107.746 -1.205 . . . . 2.26 107.746 176.24 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -50.88 -42.52 59.15 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 124.18 0.992 . . . . 4.72 110.827 177.423 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.433 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 3.1 t90 -40.03 -44.79 1.81 Allowed 'General case' 0 CA--C 1.538 0.509 0 O-C-N 124.131 0.894 . . . . 6.21 109.815 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.4 mtt-85 -43.58 -33.96 1.29 Allowed 'General case' 0 C--O 1.226 -0.169 0 N-CA-C 113.227 0.825 . . . . 5.3 113.227 -178.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.3 tp -51.92 -49.62 62.71 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-O 117.616 -1.183 . . . . 2.16 111.388 174.767 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.4 mt -71.31 -36.5 61.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 C-N-CA 124.96 1.304 . . . . 3.01 108.826 179.059 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -39.22 -56.78 2.24 Favored Glycine 0 C--N 1.344 1.02 0 C-N-CA 126.01 1.767 . . . . 1.92 111.214 170.057 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -74.17 -52.86 11.19 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-N 110.723 -2.738 . . . . 2.72 109.344 179.386 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.6 tp -39.25 -56.12 1.57 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.024 1.729 . . . . 4.03 112.517 -172.934 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.65 -33.24 71.28 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.129 0.571 . . . . 2.35 112.504 179.003 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.572 ' CE ' ' HB2' ' B' ' 74' ' ' ASN . 0.7 OUTLIER -73.36 -44.86 57.87 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.868 1.267 . . . . 3.19 110.451 173.782 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -67.42 -16.16 64.08 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 125.173 1.389 . . . . 3.28 113.089 -174.021 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 5.3 tt -58.94 -36.73 63.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 O-C-N 121.435 -0.79 . . . . 2.69 111.076 165.73 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.97 -52.68 3.36 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 126.72 2.008 . . . . 5.15 109.678 -170.404 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.9 tttm . . . . . 0 CA--C 1.53 0.211 0 C-N-CA 125.908 1.683 . . . . 4.62 106.962 163.541 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 25.6 mt . . . . . 0 CA--C 1.542 0.638 0 CA-C-O 120.305 0.097 . . . . 4.84 111.234 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 9.3 t -95.78 163.75 13.04 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 125.173 1.389 . . . . 2.3 110.457 -176.016 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -48.07 -55.73 9.49 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.568 1.147 . . . . 2.16 112.471 -171.701 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 11.4 mt -58.53 -38.23 77.32 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.419 -0.355 . . . . 1.96 111.358 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -59.92 -60.18 4.24 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 119.056 -0.497 . . . . 5.71 110.474 169.169 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -45.23 -42.16 9.11 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 119.752 1.16 . . . . 4.26 110.645 -176.75 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 22.3 p -64.01 -31.64 72.89 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.12 1.526 . . . . 2.25 115.12 177.082 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 12.6 pt -76.04 -41.28 38.2 Favored 'Isoleucine or valine' 0 C--N 1.344 0.366 0 CA-C-N 121.95 2.159 . . . . 2.57 109.955 164.107 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -47.11 -56.11 7.16 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 121.045 1.748 . . . . 2.88 109.981 -174.004 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 15.3 t -48.22 -43.37 32.06 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.485 1.136 . . . . 1.88 111.733 178.234 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . 0.412 HG13 ' CE2' ' B' ' 20' ' ' PHE . 0.5 OUTLIER -72.99 -38.31 55.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 C-N-CA 124.271 1.028 . . . . 3.03 110.126 -177.923 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 69.2 t -61.92 -50.61 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 123.831 0.852 . . . . 2.37 109.303 175.455 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.1 t -61.59 -43.67 98.43 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.839 0.745 . . . . 2.5 110.665 178.486 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 98.7 m -47.95 -58.16 4.77 Favored 'General case' 0 C--N 1.346 0.449 0 CA-C-N 118.595 0.634 . . . . 1.99 109.482 170.354 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . 0.412 ' CE2' HG13 ' B' ' 16' ' ' VAL . 16.8 m-30 -55.02 -44.64 74.79 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 112.786 0.662 . . . . 8.04 112.786 178.514 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -60.26 -53.54 56.4 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 119.716 1.144 . . . . 6.03 110.12 -176.815 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 6.7 t -65.87 -40.74 91.92 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 119.52 -0.872 . . . . 4.13 110.08 -179.439 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -62.8 -61.73 2.21 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 121.517 -0.74 . . . . 6.72 111.55 -179.754 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.14 -19.72 65.48 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 125.808 1.643 . . . . 2.29 111.951 -172.409 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.07 -26.86 11.99 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 118.431 -0.795 . . . . 5.06 111.167 169.192 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -39.28 -69.05 0.14 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 115.994 1.85 . . . . 2.22 115.994 -156.742 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -92.14 -77.7 0.43 Allowed 'General case' 0 C--N 1.341 0.206 0 C-N-CA 118.889 -1.125 . . . . 2.85 112.688 -171.289 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.04 161.16 25.39 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 127.929 2.68 . . . . 2.32 110.614 152.959 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.0 ttm180 55.96 102.34 0.01 OUTLIER 'General case' 0 C--O 1.24 0.601 0 N-CA-C 115.116 1.525 . . . . 4.98 115.116 135.719 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.47 6.6 5.49 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 115.135 1.531 . . . . 7.45 115.135 -174.256 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -123.77 11.44 9.07 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.231 0.923 . . . . 4.08 110.961 178.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 29.0 p -142.57 142.4 32.17 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 109.321 -0.622 . . . . 1.8 109.321 172.87 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -101.29 154.18 19.0 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.303 -0.999 . . . . 3.24 108.303 167.361 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 68.6 m -136.46 168.72 18.93 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 107.003 -1.48 . . . . 2.81 107.003 173.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 10.8 p -84.04 53.9 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 121.725 0.774 . . . . 3.37 111.202 -172.454 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 38.2 t30 -157.21 51.08 0.47 Allowed 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 105.881 -1.896 . . . . 3.53 105.881 150.038 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -168.41 -62.41 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 104.583 -2.377 . . . . 2.08 104.583 -166.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -48.61 -49.19 38.0 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.689 0.796 . . . . 4.08 111.036 178.32 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 31.3 tttt -57.44 -29.27 64.05 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.081 0.552 . . . . 3.42 111.586 -177.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -70.17 -25.6 63.52 Favored 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 121.535 -0.728 . . . . 4.59 110.587 -174.696 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 14.8 tp -70.16 -43.2 71.34 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 119.015 0.825 . . . . 2.9 109.716 178.016 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 6.0 m -69.89 -41.27 79.57 Favored 'Isoleucine or valine' 0 C--N 1.339 0.147 0 N-CA-C 109.099 -0.704 . . . . 1.78 109.099 -178.501 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 87.6 m -67.42 -60.78 2.3 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 116.029 -0.532 . . . . 1.97 111.071 -178.782 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -82.82 -62.81 1.5 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.839 0.456 . . . . 2.11 111.897 -170.821 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -70.61 -48.2 56.32 Favored 'General case' 0 CA--C 1.528 0.096 0 O-C-N 122.16 -0.338 . . . . 4.88 111.782 -169.651 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 tp -71.58 -19.89 0.44 Allowed Pre-proline 0 CA--C 1.536 0.429 0 N-CA-C 114.666 1.358 . . . . 2.94 114.666 -161.627 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -34.42 -65.92 0.11 Allowed 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 121.895 1.73 . . . . 2.4 114.806 -110.593 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -73.65 -59.6 2.64 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 113.358 0.873 . . . . 3.45 113.358 -158.544 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 29.5 tp 0.53 -85.04 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 127.949 2.499 . . . . 1.98 115.613 176.238 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.88 64.52 1.21 Allowed 'General case' 0 CA--C 1.522 -0.122 0 N-CA-C 108.05 -1.092 . . . . 3.87 108.05 166.82 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.28 123.31 7.22 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.573 -0.899 . . . . 7.43 108.573 166.995 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -165.96 51.43 0.09 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 105.999 -1.852 . . . . 5.13 105.999 -169.02 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 34.4 m -88.5 -12.25 10.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 113.698 -1.592 . . . . 2.96 111.102 -173.679 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -71.42 -77.19 0.53 Allowed Glycine 0 C--N 1.338 0.669 0 N-CA-C 107.416 -2.274 . . . . 3.29 107.416 165.654 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.1 43.72 0.37 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.863 1.665 . . . . 3.88 112.65 -177.765 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -67.82 -28.48 67.61 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 108.549 -0.908 . . . . 2.43 108.549 169.18 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.9 -53.17 61.42 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.097 0.862 . . . . 4.48 110.044 173.521 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -47.22 -56.06 7.41 Favored 'General case' 0 C--N 1.342 0.259 0 C-N-CA 124.003 0.921 . . . . 2.48 109.508 173.002 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -56.61 -61.46 2.4 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 120.812 -0.355 . . . . 5.58 110.193 -176.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -45.03 -55.25 5.74 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 125.242 1.417 . . . . 2.4 110.271 179.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -60.98 -41.1 95.79 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 125.168 1.387 . . . . 4.55 110.528 -177.178 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 50.5 m -64.96 -31.7 73.07 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.017 0.527 . . . . 2.57 111.82 175.43 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 mp -74.42 -52.83 10.94 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.809 0.731 . . . . 2.89 111.133 173.357 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.256 19.8 t0 -57.88 -8.62 1.02 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.969 2.907 . . . . 1.66 117.635 -164.451 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 8.8 m -33.6 -18.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.472 1 C-N-CA 132.776 4.431 . . . . 2.52 119.344 -139.8 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.6 -37.75 58.74 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 120.145 1.339 . . . . 3.48 109.616 158.114 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 67.44 68.12 0.38 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 126.744 2.018 . . . . 3.93 108.95 -171.87 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 28.4 p30 -128.03 -10.47 5.38 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.373 1.869 . . . . 1.97 113.494 -172.652 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 17.9 m 72.14 4.04 4.88 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.311 1.444 . . . . 2.53 114.589 -178.578 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . 0.419 ' OE1' ' NZ ' ' B' ' 72' ' ' LYS . 1.8 mt-10 -99.12 103.35 15.25 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 106.321 -1.733 . . . . 3.79 106.321 156.245 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.26 94.43 1.19 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 104.331 -2.47 . . . . 2.37 104.331 158.975 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . 0.419 ' NZ ' ' OE1' ' B' ' 70' ' ' GLU . 20.6 ttmm -81.78 172.48 13.31 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.973 0.909 . . . . 4.04 110.429 -170.272 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -87.83 56.06 3.73 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.0 -1.063 . . . . 5.87 111.257 177.178 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . 0.572 ' HB2' ' CE ' ' A' ' 85' ' ' LYS . 0.5 OUTLIER -161.35 55.72 0.28 Allowed 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 107.32 -1.363 . . . . 3.08 107.32 100.263 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -90.9 -60.97 1.77 Allowed 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 124.741 1.216 . . . . 2.09 108.808 139.562 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -56.77 -37.05 70.55 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 124.09 0.956 . . . . 6.39 112.177 -161.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.566 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 1.6 t-105 -45.46 -39.74 7.52 Favored 'General case' 0 C--O 1.219 -0.512 0 O-C-N 123.565 0.541 . . . . 6.43 109.987 175.727 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -39.62 -48.46 2.1 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 120.965 -1.084 . . . . 5.19 112.038 -169.105 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 13.1 tp -49.53 -46.71 48.88 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.421 0.688 . . . . 2.15 111.244 177.445 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 8.5 mm -58.37 -42.25 83.5 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.103 0 C-N-CA 127.284 2.233 . . . . 4.04 108.169 -178.824 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -64.5 -51.18 54.5 Favored Glycine 0 N--CA 1.441 -1.019 0 N-CA-C 109.971 -1.252 . . . . 1.8 109.971 178.166 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -50.89 -47.47 60.59 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 118.235 -0.888 . . . . 2.17 110.712 178.166 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 22.1 mt -39.14 -54.5 1.75 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.598 1.09 . . . . 2.91 113.214 -178.25 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.78 -26.25 68.62 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.917 1.287 . . . . 2.32 112.143 -176.55 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -80.72 -53.42 6.53 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.131 0.973 . . . . 2.82 109.526 171.648 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -57.6 -40.42 79.03 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.993 0.917 . . . . 2.55 111.718 -171.113 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 10.8 tt -50.01 -36.68 12.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 118.568 0.622 . . . . 1.9 111.885 174.758 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -49.11 11.23 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.518 0.727 . . . . 6.16 109.726 174.774 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 32.2 mttm . . . . . 0 CA--C 1.536 0.442 0 C-N-CA 125.886 1.674 . . . . 5.96 112.144 -166.16 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 . . . . . 0 N--CA 1.451 -0.391 0 N-CA-C 109.093 -0.706 . . . . 4.82 109.093 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -70.54 146.94 56.72 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 121.859 1.706 . . . . 3.28 108.385 175.373 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 51.9 mt -101.15 173.14 6.6 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.256 -1.016 . . . . 2.73 108.256 -176.178 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.9 t -71.14 161.47 31.05 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 120.573 -1.329 . . . . 3.29 110.001 178.548 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -48.34 -43.77 33.72 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 124.072 0.949 . . . . 2.73 111.382 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.6 mp -63.29 -54.46 36.84 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 109.308 -0.627 . . . . 3.23 109.308 -177.265 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -49.64 -57.71 6.67 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.586 1.554 . . . . 2.7 110.898 174.975 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -49.93 -51.13 43.36 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.889 0.876 . . . . 3.59 109.94 177.966 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.8 p -64.3 -47.86 77.86 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.543 -0.723 . . . . 2.12 112.21 -178.124 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.276 2.6 pp -63.13 -31.57 53.15 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 O-C-N 121.131 -0.981 . . . . 1.79 110.283 -179.577 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -65.73 -57.07 8.89 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 120.026 -0.669 . . . . 3.14 109.404 169.281 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -48.38 -43.52 33.92 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.983 0.81 . . . . 2.65 111.616 -171.764 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.4 m -69.75 -39.39 77.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 121.402 -0.811 . . . . 1.95 111.568 177.413 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.8 t -63.73 -48.17 87.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.729 0.812 . . . . 2.02 110.572 177.614 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.7 t -60.89 -44.04 97.66 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 120.981 -1.075 . . . . 1.95 110.741 174.398 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 61.1 m -57.34 -45.08 84.68 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.327 0.967 . . . . 1.93 110.264 176.433 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -53.33 -60.07 3.76 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.178 0.591 . . . . 4.49 110.235 172.4 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -58.76 -48.0 82.74 Favored 'General case' 0 C--O 1.232 0.169 0 O-C-N 121.693 -0.63 . . . . 5.43 112.185 -174.125 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -63.47 -23.11 67.26 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 118.639 -0.696 . . . . 2.65 111.243 -178.186 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -80.05 -42.03 24.54 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 118.462 0.574 . . . . 4.27 111.185 167.78 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.93 -32.19 65.72 Favored 'General case' 0 C--O 1.238 0.474 0 O-C-N 120.68 -1.263 . . . . 2.39 112.579 -175.539 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.255 0.0 OUTLIER -77.14 -15.17 59.64 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.804 1.641 . . . . 4.28 113.971 179.546 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.04 -65.08 0.4 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.457 1.026 . . . . 2.42 112.03 177.248 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -141.21 -175.31 4.29 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 125.72 1.608 . . . . 5.46 109.226 -170.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 25.12 92.76 0.01 OUTLIER Glycine 0 C--N 1.341 0.858 0 C-N-CA 127.197 2.332 . . . . 2.92 113.179 157.841 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 62.44 102.01 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.55 1.14 . . . . 6.07 110.35 178.854 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.9 pttt -79.03 50.99 1.09 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.115 1.366 . . . . 7.46 112.074 -166.404 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -172.01 -55.15 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 107.815 -1.18 . . . . 5.6 107.815 -156.839 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.7 p -84.74 153.81 22.81 Favored 'General case' 0 C--O 1.244 0.799 0 C-N-CA 124.058 0.943 . . . . 2.85 110.886 170.486 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -94.67 119.08 32.74 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.094 -1.076 . . . . 3.11 108.094 172.843 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.4 m -82.41 166.28 19.54 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.345 -0.983 . . . . 3.26 108.345 171.778 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.0 t -60.99 -57.96 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 O-C-N 121.139 -0.976 . . . . 3.49 111.275 -171.558 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -61.33 -43.25 99.19 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.096 0.474 . . . . 4.69 110.888 -179.665 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -50.83 -50.6 56.22 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.668 1.187 . . . . 2.8 110.324 176.188 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -62.94 -44.11 96.97 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.829 -0.544 . . . . 4.91 110.933 173.71 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -49.22 -38.81 27.58 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.641 -0.695 . . . . 4.71 111.234 -178.292 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -46.06 -48.76 16.9 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 118.807 0.731 . . . . 2.87 112.085 172.754 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -59.32 -51.37 70.23 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 108.949 -0.76 . . . . 3.38 108.949 -173.167 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.99 -33.66 48.18 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 CA-C-N 115.87 -0.605 . . . . 2.56 110.012 -173.769 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 91.1 m -69.33 -32.77 72.09 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.896 0.878 . . . . 2.07 111.124 174.012 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -81.16 -58.84 2.88 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 125.002 1.321 . . . . 3.33 109.878 -174.392 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -99.95 -135.26 0.29 Allowed 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 108.898 -0.779 . . . . 3.85 108.898 176.322 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 mm? 29.98 51.75 0.46 Allowed Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 127.309 2.244 . . . . 3.24 113.949 -170.688 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -66.95 -40.08 12.74 Favored 'Trans proline' 0 N--CA 1.448 -1.201 0 C-N-CA 121.97 1.78 . . . . 1.73 111.175 178.424 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 20.6 t-160 -116.71 -28.05 6.48 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-O 119.216 -0.421 . . . . 5.24 111.636 -165.166 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 tp -64.53 -74.75 0.1 Allowed 'General case' 0 C--O 1.232 0.174 0 CA-C-N 119.481 1.037 . . . . 2.29 110.832 179.903 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 85.2 mt -119.54 83.63 2.07 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.338 1.455 . . . . 2.87 107.362 -174.406 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -178.34 0.31 Allowed 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 114.976 -1.011 . . . . 6.39 109.433 167.626 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 80.97 44.2 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 125.192 1.397 . . . . 4.0 110.053 -179.8 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -59.99 -21.5 22.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 C-N-CA 124.833 1.253 . . . . 4.42 111.188 175.873 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -56.18 -53.97 38.92 Favored Glycine 0 CA--C 1.528 0.899 0 N-CA-C 110.736 -0.945 . . . . 1.78 110.736 169.439 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 56.0 p -80.14 40.71 0.49 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.062 0.931 . . . . 3.68 111.726 -172.132 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -57.21 -36.92 71.46 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 120.811 -1.181 . . . . 2.57 110.501 -172.373 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.09 -34.95 58.9 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.689 0.996 . . . . 4.57 113.689 177.459 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -57.99 -51.97 67.45 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.571 0.701 . . . . 3.15 109.219 174.313 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.75 -51.07 70.89 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.574 -1.269 . . . . 4.66 107.574 -178.694 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -46.35 -60.88 2.06 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 123.922 0.889 . . . . 2.36 109.988 176.93 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -67.32 -28.34 67.91 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.055 0.843 . . . . 4.97 112.396 -176.645 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 49.5 m -61.74 -32.04 72.26 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.647 0.658 . . . . 3.02 111.804 169.543 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 12.1 mt -91.24 -64.38 1.13 Allowed 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 124.714 1.206 . . . . 2.45 111.305 -175.52 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -74.48 71.61 1.83 Allowed 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.242 1.417 . . . . 2.15 109.96 -173.803 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -33.1 8.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 124.934 1.294 . . . . 4.58 112.766 -177.507 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -85.14 -10.2 57.0 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.214 1.006 . . . . 2.54 113.095 -179.203 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.86 39.85 26.67 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.862 1.265 . . . . 6.42 110.693 179.372 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 31.0 p30 -88.62 -14.53 37.27 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.006 0.922 . . . . 2.16 109.92 174.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.2 m 69.34 15.75 8.43 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.942 1.297 . . . . 1.96 112.974 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -121.66 105.61 10.58 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.609 1.563 . . . . 3.96 107.474 167.24 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.14 109.32 16.34 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 105.976 -1.861 . . . . 2.07 105.976 -175.154 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -85.06 148.54 26.1 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.435 1.094 . . . . 4.27 108.149 177.048 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -39.69 -56.37 1.72 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.012 1.325 . . . . 6.56 114.159 -173.44 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -68.06 -29.08 67.96 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.451 -0.781 . . . . 2.63 112.173 -178.609 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -66.13 -51.36 58.69 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 107.975 -1.12 . . . . 2.19 107.975 173.104 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.98 -44.44 64.02 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.315 1.046 . . . . 6.83 110.395 177.948 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.679 ' CZ2' ' CE2' ' B' ' 77' ' ' TRP . 23.5 t90 -40.63 -38.71 0.92 Allowed 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 117.705 -1.14 . . . . 6.32 113.061 -171.615 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 15.3 ttt180 -39.24 -49.49 1.9 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.61 1.096 . . . . 7.18 111.012 175.805 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 9.6 tp -46.97 -46.47 21.6 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 123.368 0.667 . . . . 1.91 110.27 -177.751 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 53.2 mt -66.31 -33.0 60.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 121.829 0.823 . . . . 2.84 109.319 -174.066 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.551 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -63.6 -48.87 73.65 Favored Glycine 0 CA--C 1.492 -1.373 0 C-N-CA 126.888 2.185 . . . . 1.66 110.073 176.728 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -69.89 -53.07 19.67 Favored 'General case' 0 N--CA 1.433 -1.298 0 N-CA-C 106.002 -1.851 . . . . 2.42 106.002 -173.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mt -40.13 -59.39 1.26 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.913 1.285 . . . . 3.61 111.375 168.835 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.72 -41.35 77.3 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.43 0.692 . . . . 2.23 110.943 -179.485 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.92 -52.19 66.79 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 121.896 -0.503 . . . . 3.22 110.184 174.091 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -52.42 -46.31 66.3 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.409 1.883 . . . . 2.31 110.288 -168.143 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.8 tt -53.77 -29.99 18.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 N-CA-C 112.52 0.563 . . . . 2.03 112.52 178.246 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -88.68 -45.48 9.79 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.109 0.964 . . . . 7.18 111.25 174.15 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.3 tttt . . . . . 0 CA--C 1.535 0.404 0 C-N-CA 128.233 2.613 . . . . 4.39 114.299 -165.124 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.3 mt . . . . . 0 CA--C 1.548 0.869 0 CA-C-O 119.153 -0.451 . . . . 4.06 109.821 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 4.0 t -69.13 -70.56 0.27 Allowed 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 115.221 1.563 . . . . 2.36 115.221 -165.766 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -171.93 -73.45 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.411 1.484 . . . . 2.39 108.334 -168.094 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 17.4 mt -56.47 -41.24 76.23 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.574 -1.328 . . . . 1.99 110.064 167.798 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -54.59 -41.8 70.33 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.52 0.728 . . . . 3.51 111.319 171.964 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -63.42 -43.54 97.2 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 120.891 -1.131 . . . . 4.31 110.43 173.974 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.2 t -59.58 -45.42 91.92 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.305 0.642 . . . . 3.09 110.624 -178.259 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.8 pp -66.46 -38.0 80.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 118.151 0.432 . . . . 2.11 110.4 172.869 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -56.09 -60.34 3.63 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-O 117.894 -1.051 . . . . 2.73 109.764 178.929 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.1 t -56.93 -28.82 62.51 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 120.182 1.355 . . . . 2.17 113.455 -170.516 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 27.2 m -81.05 -44.66 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 O-C-N 121.426 -0.797 . . . . 1.85 109.626 -178.669 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 85.9 t -54.38 -35.46 30.95 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.407 0 N-CA-C 108.405 -0.961 . . . . 2.14 108.405 165.748 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . 2.238 1.5 t -54.59 -63.76 1.05 Allowed 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 126.543 1.937 . . . . 4.4 110.834 -178.72 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 49.8 m -51.32 -59.66 3.98 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 110.805 -2.907 . . . . 2.08 110.166 176.598 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -58.91 -54.55 45.81 Favored 'General case' 0 C--O 1.223 -0.331 0 O-C-N 122.108 -0.37 . . . . 8.48 110.815 -178.946 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -57.72 -45.76 85.32 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.895 1.278 . . . . 4.34 111.768 -176.52 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 2.7 t -65.72 -52.9 47.54 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.082 -0.71 . . . . 4.1 109.082 177.158 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -55.5 -38.95 69.84 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.696 0.76 . . . . 4.96 111.046 -179.031 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.93 -24.2 36.43 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.153 2.181 . . . . 1.72 110.6 -179.42 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -19.24 34.67 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 117.844 -1.074 . . . . 4.92 111.841 175.783 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -50.57 -67.52 0.25 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.881 1.067 . . . . 2.61 113.881 -160.96 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 68.4 mt-10 -90.14 -44.48 9.75 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 125.931 1.692 . . . . 3.72 111.977 -179.091 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.5 -143.48 1.12 Allowed Glycine 0 CA--C 1.536 1.36 0 CA-C-N 115.269 -0.878 . . . . 3.75 113.546 -166.052 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 16.2 mtt-85 50.35 99.45 0.01 OUTLIER 'General case' 0 C--O 1.237 0.404 1 C-N-CA 131.755 4.022 . . . . 4.3 112.464 27.349 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 10.4 ptpp? -66.42 -177.72 0.59 Allowed 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 119.092 -1.043 . . . . 4.96 109.195 148.946 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 9.1 t70 78.31 -59.83 0.42 Allowed 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 127.593 2.357 . . . . 4.15 109.846 179.809 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 25.8 p -88.12 134.66 33.71 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.471 0.653 . . . . 1.98 110.201 175.857 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.14 141.89 32.71 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 106.84 -1.541 . . . . 3.09 106.84 167.056 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 4.5 t -92.79 -172.32 2.99 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 125.086 1.354 . . . . 2.44 109.998 165.771 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . 0.453 ' C ' ' H ' ' B' ' 37' ' ' GLU . 70.9 t -67.53 -112.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.431 2 N-CA-C 99.47 -4.27 . . . . 4.69 99.47 -179.354 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.75 53.78 0.75 Allowed 'General case' 0 CA--C 1.556 1.202 0 CA-C-N 123.505 2.866 . . . . 2.9 112.136 -172.171 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . 0.453 ' H ' ' C ' ' B' ' 35' ' ' VAL . 3.3 tt0 -105.4 -58.0 1.96 Allowed 'General case' 0 N--CA 1.448 -0.552 1 C-N-CA 132.292 4.237 . . . . 1.67 104.099 150.38 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -57.68 -40.16 78.8 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.716 0.806 . . . . 3.36 110.161 -178.767 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.7 ttpm? -58.02 -37.06 73.6 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 119.126 -1.03 . . . . 5.4 109.981 179.647 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -73.83 -25.58 60.16 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 116.413 -0.358 . . . . 4.9 110.687 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 tt -67.57 -48.76 65.98 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.484 -0.932 . . . . 3.62 108.484 172.558 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 2.1 m -65.24 -51.09 69.51 Favored 'Isoleucine or valine' 0 C--N 1.34 0.166 0 N-CA-C 109.344 -0.613 . . . . 2.16 109.344 -177.858 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 94.6 m -51.31 -56.6 12.18 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.722 0.809 . . . . 2.05 111.576 176.557 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -80.87 -54.37 5.65 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.757 0.28 . . . . 2.13 111.757 -169.612 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 26.5 mm100 -80.11 -40.23 27.92 Favored 'General case' 0 C--O 1.227 -0.131 0 N-CA-C 113.573 0.953 . . . . 3.58 113.573 -164.64 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.62 -41.89 92.01 Favored Pre-proline 0 N--CA 1.467 0.393 0 CA-C-N 118.937 0.79 . . . . 2.86 112.47 -168.237 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -70.61 -54.4 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.926 0 N-CA-C 107.631 -1.719 . . . . 3.41 107.631 -41.91 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 50.7 t60 -66.44 -43.62 85.11 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.786 1.234 . . . . 4.65 112.046 -175.311 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 27.0 tp -33.85 -62.96 0.28 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.123 1.769 . . . . 1.98 113.257 -168.635 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 35.2 mt -81.34 97.59 7.77 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 107.76 -1.2 . . . . 2.34 107.76 167.152 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -49.44 145.07 5.02 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.081 -0.711 . . . . 6.89 109.081 171.065 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 40.7 t0 63.38 60.19 1.17 Allowed 'General case' 0 C--N 1.339 0.134 0 CA-C-O 123.987 1.851 . . . . 4.31 109.191 171.29 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 33.7 m -56.07 -21.27 11.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 112.36 -2.2 . . . . 3.36 111.245 164.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -64.34 -60.52 7.0 Favored Glycine 0 C--N 1.341 0.82 0 C-N-CA 124.455 1.026 . . . . 3.42 111.378 178.367 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.2 t -77.21 66.68 3.04 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 122.396 1.094 . . . . 3.18 109.675 -175.846 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.09 -34.88 71.56 Favored 'General case' 0 N--CA 1.44 -0.926 0 C-N-CA 125.274 1.43 . . . . 2.29 109.917 -174.162 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -18.08 -70.35 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 127.128 2.171 . . . . 4.19 115.508 167.194 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -38.77 78.67 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.705 1.139 . . . . 3.63 111.635 -175.676 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.98 -60.08 4.35 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.203 -1.036 . . . . 4.6 108.203 172.734 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -46.16 -51.43 14.11 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-N 118.962 0.801 . . . . 3.15 110.982 -178.36 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -63.0 -42.21 99.79 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.74 -0.6 . . . . 4.38 111.954 178.827 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 24.8 t -61.16 -39.67 90.97 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.7 0.682 . . . . 3.16 111.828 174.763 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 34.4 mt -80.83 -61.19 2.04 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.478 1.111 . . . . 2.59 110.669 -171.822 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -71.11 -10.12 59.22 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 128.888 2.875 . . . . 2.94 115.101 -162.636 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -37.72 -19.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 C-N-CA 131.143 3.777 . . . . 5.41 117.441 -160.698 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -61.12 -19.42 61.48 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 120.192 1.36 . . . . 3.51 111.747 171.845 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 101.16 -25.3 0.02 OUTLIER 'General case' 0 C--N 1.343 0.309 0 C-N-CA 127.605 2.362 . . . . 4.52 111.32 166.982 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -61.62 139.32 58.29 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 118.457 -1.297 . . . . 2.99 107.546 164.848 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 1.7 p -78.33 12.9 1.71 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 127.929 2.492 . . . . 3.73 112.987 -179.576 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -87.63 116.76 25.98 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 104.389 -2.449 . . . . 3.26 104.389 162.839 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.05 90.59 0.09 Allowed 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 104.924 -2.25 . . . . 2.82 104.924 157.463 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 36.6 tptt -80.02 168.45 19.17 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.331 -0.989 . . . . 5.85 108.331 -165.564 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -91.61 61.02 4.17 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.22 -0.659 . . . . 6.16 109.22 175.627 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -154.89 50.94 0.6 Allowed 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 119.096 -1.042 . . . . 4.2 112.661 87.203 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -86.42 -55.92 3.67 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.691 1.597 . . . . 2.2 108.288 153.798 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -50.62 -39.95 51.59 Favored 'General case' 0 C--N 1.344 0.354 0 C-N-CA 123.021 0.528 . . . . 6.91 110.427 -174.377 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.679 ' CE2' ' CZ2' ' A' ' 77' ' ' TRP . 27.8 t90 -47.44 -38.49 13.62 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 123.651 0.781 . . . . 5.37 111.206 -179.808 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 54.5 mtp85 -43.05 -38.79 2.45 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.681 1.193 . . . . 5.09 111.716 177.079 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 13.7 tp -51.62 -47.45 63.66 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 117.915 0.325 . . . . 1.83 111.05 177.686 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 65.3 mt -65.74 -26.04 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 109.133 -0.691 . . . . 2.92 109.133 -176.252 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.574 ' N ' ' CZ2' ' A' ' 77' ' ' TRP . . . -67.15 -51.64 37.43 Favored Glycine 0 CA--C 1.501 -0.829 0 C-N-CA 126.907 2.194 . . . . 2.03 108.112 176.104 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -51.99 -60.95 2.59 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.168 -1.049 . . . . 4.39 108.168 169.411 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.4 mt -48.09 -51.96 22.33 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 120.526 1.512 . . . . 3.71 113.121 -175.701 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.0 -33.93 62.99 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.26 1.024 . . . . 2.91 110.548 178.647 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.89 -56.39 5.8 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 117.284 -1.341 . . . . 3.21 111.423 165.538 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -52.73 -36.15 57.17 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 120.295 1.407 . . . . 2.54 112.894 -164.092 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 3.0 tt -55.61 -38.2 49.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 O-C-N 121.598 -0.689 . . . . 2.25 111.446 175.222 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -84.06 -61.66 1.76 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.248 1.419 . . . . 7.93 113.463 169.949 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 10.8 pttp . . . . . 0 C--O 1.223 -0.302 0 O-C-N 120.804 -1.185 . . . . 7.21 111.83 -169.555 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 . . . . . 0 N--CA 1.444 -0.728 0 N-CA-C 108.82 -0.807 . . . . 4.44 108.82 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -67.53 141.98 57.49 Favored 'Trans proline' 0 N--CA 1.45 -1.079 0 N-CA-C 107.522 -1.761 . . . . 2.67 107.522 171.028 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.6 mt -96.84 173.9 7.07 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 107.4 -1.333 . . . . 2.48 107.4 179.324 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.9 t -72.47 166.63 22.23 Favored 'General case' 0 CA--C 1.529 0.173 0 O-C-N 120.804 -1.185 . . . . 2.11 110.534 -177.824 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -52.8 -57.42 10.23 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.961 0.886 . . . . 2.19 111.39 -169.019 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 mt -66.63 -31.2 71.74 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 117.436 -1.269 . . . . 2.76 112.08 178.679 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 77.6 mt-10 -55.67 -55.97 25.95 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.84 1.654 . . . . 1.95 110.92 168.482 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -48.56 -51.44 27.7 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 122.028 0.918 . . . . 3.39 109.18 174.748 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.2 t -60.01 -53.58 56.15 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.279 -0.873 . . . . 2.76 112.42 -173.787 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.356 0.1 OUTLIER -71.29 -33.24 49.8 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 119.404 1.002 . . . . 2.89 110.415 -178.584 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -53.44 -53.3 53.25 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.081 0.855 . . . . 2.67 109.693 173.293 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.5 t -59.22 -25.38 63.96 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.953 1.094 . . . . 2.6 113.953 -173.686 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.7 m -81.24 -42.22 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 120.286 1.403 . . . . 1.79 110.776 169.498 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.1 t -56.05 -46.05 80.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 123.89 0.876 . . . . 2.2 111.018 179.62 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.3 t -60.65 -47.08 87.82 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.174 0.897 . . . . 1.82 110.632 177.309 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.3 m -58.26 -47.12 84.59 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.358 -0.839 . . . . 2.15 110.073 179.275 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -52.34 -56.98 11.27 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.566 1.146 . . . . 4.19 110.696 171.171 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -68.62 -39.56 80.77 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 123.91 0.884 . . . . 3.85 110.928 -166.506 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.3 p -57.92 -60.35 3.85 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.621 -0.881 . . . . 3.47 108.621 169.762 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -49.04 -41.39 34.8 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 118.874 0.761 . . . . 4.41 113.044 -179.75 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.68 -25.75 19.57 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 127.037 2.135 . . . . 2.48 111.711 -174.774 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -34.1 70.73 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.999 1.32 . . . . 4.96 112.367 176.575 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -52.85 -52.03 58.73 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-O 121.642 0.734 . . . . 2.37 112.53 -157.323 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -119.34 165.3 14.48 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 127.839 2.456 . . . . 2.7 105.923 176.033 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 9.19 106.98 0.0 OUTLIER Glycine 0 CA--C 1.536 1.372 0 C-N-CA 126.798 2.142 . . . . 1.79 115.768 165.593 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? 66.38 105.41 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.848 1.259 . . . . 6.71 113.904 165.552 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.3 pttp -65.29 63.99 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.499 0.72 . . . . 4.12 111.245 164.529 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -171.67 -53.59 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 126.9 2.08 . . . . 3.68 106.965 -175.987 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 m -84.4 128.0 34.33 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 124.345 1.058 . . . . 2.91 109.803 174.283 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -82.56 145.88 29.49 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 107.378 -1.342 . . . . 3.42 107.378 172.499 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.3 m -121.02 164.47 16.71 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 125.179 1.392 . . . . 4.29 107.815 -169.183 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.7 p -68.94 -36.16 72.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 O-C-N 120.707 -1.245 . . . . 3.94 112.193 -167.819 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -69.26 -48.84 60.65 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 107.551 -1.277 . . . . 2.31 107.551 179.648 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -44.74 -54.66 6.04 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.911 0.884 . . . . 2.06 111.021 171.396 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -51.22 -57.03 9.89 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.67 -0.695 . . . . 4.08 110.498 177.637 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -59.52 -42.02 91.28 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.249 0.477 . . . . 4.87 111.874 179.785 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -56.83 -39.7 74.69 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.277 -0.89 . . . . 2.48 110.452 176.946 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -63.41 -47.33 82.41 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 108.024 -1.102 . . . . 3.05 108.024 -174.846 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.53 -54.24 27.76 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 N-CA-C 109.995 -0.372 . . . . 1.92 109.995 -179.103 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 92.3 m -50.0 -48.31 52.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.745 1.218 . . . . 1.97 110.877 -179.717 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -76.74 -45.41 29.31 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.35 0.66 . . . . 3.11 110.862 -174.643 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -135.01 10.67 3.58 Favored 'General case' 0 C--N 1.343 0.311 0 N-CA-C 116.527 2.047 . . . . 3.51 116.527 -161.214 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -120.47 69.89 16.25 Favored Pre-proline 0 N--CA 1.469 0.517 0 CA-C-N 121.133 1.788 . . . . 2.86 109.567 164.1 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.28 -39.86 9.39 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 123.242 2.628 . . . . 1.8 111.391 -178.171 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -97.95 -50.38 4.43 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 118.476 0.58 . . . . 4.89 109.749 -177.442 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . 0.448 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 0.9 OUTLIER -55.47 -64.56 0.81 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 121.361 0.601 . . . . 2.05 111.673 -167.914 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' A' ' 52' ' ' ASP . 84.6 mt -116.99 56.52 0.81 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.861 1.265 . . . . 2.97 108.375 -171.326 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.3 31.94 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.262 1.425 . . . . 5.99 112.776 171.394 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . 0.425 ' OD2' ' NZ ' ' A' ' 59' ' ' LYS . 33.5 t70 -110.88 29.45 7.75 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 127.899 2.48 . . . . 4.87 108.174 -175.376 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 27.7 m -56.93 -30.02 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 123.588 0.755 . . . . 3.96 111.758 -173.215 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -56.91 -38.29 83.62 Favored Glycine 0 CA--C 1.532 1.154 0 N-CA-C 111.277 -0.729 . . . . 2.39 111.277 174.058 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.8 m -110.86 46.69 1.04 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.299 1.839 . . . . 2.78 109.054 178.759 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -77.39 -50.54 12.53 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.561 1.144 . . . . 1.98 110.127 171.809 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -64.6 -37.15 86.58 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.426 -0.796 . . . . 5.01 110.694 -162.999 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.59 -40.74 84.04 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.749 0.82 . . . . 4.42 111.664 167.705 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.425 ' NZ ' ' OD2' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -58.97 -49.66 77.02 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 107.524 -1.287 . . . . 3.71 107.524 173.789 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.57 -52.19 31.76 Favored 'General case' 0 C--O 1.226 -0.18 0 N-CA-C 109.183 -0.673 . . . . 2.7 109.183 177.996 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -55.0 -45.37 75.05 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 122.395 0.278 . . . . 4.65 110.651 177.178 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.8 t -60.57 -41.76 95.27 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 122.081 -0.387 . . . . 3.59 111.776 179.717 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.5 mp -70.43 -53.15 17.59 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 118.515 0.598 . . . . 2.88 110.042 177.959 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -73.44 75.5 1.42 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.71 0.804 . . . . 2.0 109.342 179.079 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 25.8 m -50.34 -27.67 4.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 124.211 1.004 . . . . 3.03 112.591 179.322 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -77.42 -30.74 53.6 Favored 'General case' 0 CA--C 1.529 0.16 0 O-C-N 121.933 -0.48 . . . . 3.49 111.505 179.106 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 58.39 52.86 6.79 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.868 1.267 . . . . 5.38 109.534 -163.382 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.6 p30 -108.98 -13.25 14.76 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.676 1.991 . . . . 2.57 112.617 -179.362 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.6 m 74.71 2.99 4.17 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.486 1.914 . . . . 2.79 114.161 -176.136 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -86.0 115.95 23.92 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 105.936 -1.876 . . . . 4.13 105.936 152.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.27 84.28 7.15 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 102.576 -3.12 . . . . 2.31 102.576 154.26 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.36 155.0 15.52 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 107.774 -1.195 . . . . 6.42 107.774 177.727 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -39.83 -54.69 2.09 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.009 0.924 . . . . 6.65 112.337 -175.685 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -65.08 -31.95 73.41 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.692 0.797 . . . . 3.0 113.041 -179.833 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -70.03 -60.95 1.98 Allowed 'General case' 0 C--O 1.233 0.191 0 N-CA-C 108.377 -0.972 . . . . 2.01 108.377 174.712 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -49.64 -44.09 47.32 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 124.864 1.266 . . . . 4.37 111.065 -178.588 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.408 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.6 OUTLIER -40.02 -40.79 1.11 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 116.235 -1.841 . . . . 6.2 110.125 178.977 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.76 -44.33 3.2 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 121.758 2.072 . . . . 7.79 111.85 -178.267 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 12.4 tp -53.3 -49.38 67.11 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.502 1.046 . . . . 2.08 111.371 179.663 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 60.7 mt -73.65 -37.4 49.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 125.536 1.534 . . . . 2.52 108.1 -174.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -42.98 -58.32 3.76 Favored Glycine 0 N--CA 1.44 -1.036 0 N-CA-C 109.66 -1.376 . . . . 1.78 109.66 165.165 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 46.3 mm-40 -79.91 -36.05 37.0 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 127.607 2.363 . . . . 2.42 110.153 -160.928 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . 0.448 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 4.9 mp -39.19 -54.93 1.73 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.938 0.895 . . . . 3.36 110.252 170.014 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.13 -24.85 66.58 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.341 1.056 . . . . 1.78 113.449 -178.518 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' A' ' 82' ' ' GLU . 16.7 ttpp -82.76 -50.59 8.52 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.731 1.213 . . . . 2.58 110.737 173.14 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -56.4 -40.18 74.23 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 125.666 1.586 . . . . 2.76 111.852 -174.542 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 10.3 tt -44.68 -29.07 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 N-CA-C 113.291 0.849 . . . . 2.19 113.291 175.376 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -101.76 -63.01 1.19 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.546 0.739 . . . . 5.22 109.785 166.995 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.9 tttt . . . . . 0 CA--C 1.533 0.292 0 N-CA-C 113.892 1.071 . . . . 4.2 113.892 -164.356 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.549 0.922 0 CA-C-O 118.72 -0.657 . . . . 3.69 111.519 . . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 5.2 t -90.54 -174.97 4.29 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.336 1.054 . . . . 2.42 113.581 -173.65 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -46.77 -73.9 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.287 2.235 . . . . 3.22 112.67 -172.872 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 25.9 mt -55.42 -37.67 67.97 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 121.236 -0.915 . . . . 2.38 111.297 179.359 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -59.76 -36.22 76.22 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 122.779 0.432 . . . . 3.69 111.013 173.572 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -66.13 -46.99 75.58 Favored 'General case' 0 C--N 1.344 0.351 0 O-C-N 120.135 -1.603 . . . . 3.99 109.155 172.077 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -56.27 -42.8 78.03 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.099 0.559 . . . . 2.32 110.287 -175.778 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.263 2.5 pp -70.6 -42.7 78.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 O-C-N 121.622 -0.674 . . . . 2.0 111.033 171.721 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -54.71 -42.41 71.47 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.607 1.094 . . . . 4.34 112.07 179.127 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.1 t -63.18 -31.6 72.79 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.109 -0.994 . . . . 2.32 112.096 -177.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 m -80.15 -36.76 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 O-C-N 120.899 -1.125 . . . . 2.11 109.916 173.866 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 58.8 t -57.77 -45.0 87.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 C-N-CA 122.937 0.495 . . . . 2.36 110.343 176.235 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 14.1 t -67.85 -40.42 83.67 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.699 0.682 . . . . 2.06 110.729 177.988 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 51.5 m -55.64 -52.29 64.3 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-N 119.038 0.835 . . . . 1.77 108.891 174.076 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -48.41 -55.63 10.31 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.229 1.411 . . . . 5.79 111.318 171.887 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -56.33 -56.65 18.48 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.05 0.94 . . . . 4.36 109.554 -175.262 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 36.7 p -61.61 -44.79 96.35 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.256 0.622 . . . . 3.28 110.705 -177.576 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -57.64 -61.38 2.55 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.533 1.133 . . . . 6.98 111.008 177.376 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.8 -19.6 51.65 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.668 1.987 . . . . 2.06 111.678 176.656 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . 2.318 0.0 OUTLIER -46.68 -19.1 0.08 Allowed 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 127.956 2.502 . . . . 6.23 113.481 162.368 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -52.07 -64.06 0.94 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 114.101 1.149 . . . . 3.26 114.101 -175.838 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -73.68 -31.6 63.52 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 116.512 2.041 . . . . 5.35 116.512 -154.63 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.22 -111.35 0.43 Allowed Glycine 0 CA--C 1.53 1.013 1 C-N-CA 132.384 4.802 . . . . 5.53 116.075 9.579 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 49.5 ttt85 53.75 98.49 0.01 OUTLIER 'General case' 0 C--O 1.237 0.4 0 C-N-CA 126.512 1.925 . . . . 5.1 112.25 -175.9 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.32 -39.24 93.51 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 121.061 0.458 . . . . 5.97 111.109 177.329 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -75.06 2.33 10.9 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 113.109 0.781 . . . . 3.93 113.109 -171.02 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 1.6 m -154.93 144.21 21.15 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 118.956 0.798 . . . . 3.53 110.657 -177.309 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.8 mp -131.64 141.31 49.59 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.164 0.985 . . . . 3.86 108.932 178.645 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 8.2 t -108.67 177.24 4.84 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.662 0.744 . . . . 3.27 109.773 168.628 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 10.3 p -84.44 53.77 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.118 0 CA-C-O 122.283 1.039 . . . . 3.6 109.878 177.044 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -155.99 54.33 0.58 Allowed 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 104.825 -2.287 . . . . 3.15 104.825 149.387 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -163.56 -60.42 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 102.403 -3.184 . . . . 2.33 102.403 175.882 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -41.26 -58.08 1.93 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.53 1.132 . . . . 4.35 113.602 -179.129 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 11.9 ttmm -54.78 -30.55 57.1 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.456 0.702 . . . . 3.39 112.42 -179.277 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -65.0 -25.5 67.89 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 121.083 -1.011 . . . . 3.04 110.898 -173.707 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.69 -49.54 62.23 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.27 0.941 . . . . 3.76 108.92 179.272 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 15.3 m -66.67 -38.16 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 115.337 -0.847 . . . . 1.72 109.142 -175.704 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 72.5 m -63.53 -54.37 37.31 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.767 0.827 . . . . 2.03 111.323 175.503 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -80.79 -62.33 1.7 Allowed 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 112.199 0.444 . . . . 3.32 112.199 -164.424 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -80.94 -43.72 19.32 Favored 'General case' 0 C--O 1.226 -0.148 0 O-C-N 122.144 -0.348 . . . . 3.03 110.687 -170.677 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 6.6 mp -81.71 -18.89 0.27 Allowed Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 119.171 3.026 . . . . 3.23 119.171 -161.523 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -52.05 89.56 0.03 OUTLIER 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.396 2.731 . . . . 3.12 114.104 -145.787 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 154.36 -65.06 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 129.656 3.182 . . . . 5.23 106.579 -175.098 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 52.7 tp -49.13 -73.37 0.04 OUTLIER 'General case' 0 C--O 1.235 0.304 0 C-N-CA 123.649 0.78 . . . . 2.06 109.445 -164.801 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.3 mt -74.01 131.85 41.78 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.002 -1.851 . . . . 2.21 106.002 147.029 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.49 168.46 12.55 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 104.333 -2.469 . . . . 7.71 104.333 167.864 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . 0.408 ' OD2' ' NZ ' ' B' ' 59' ' ' LYS . 8.8 t0 61.3 84.21 0.14 Allowed 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 124.493 1.12 . . . . 3.56 108.349 -152.599 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 27.3 m -89.13 4.15 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 CA-C-N 114.061 -1.427 . . . . 2.43 109.712 165.649 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.79 -71.48 1.27 Allowed Glycine 0 C--N 1.341 0.854 0 N-CA-C 108.215 -1.954 . . . . 2.73 108.215 -173.55 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 1.5 t -77.01 64.17 2.44 Favored 'General case' 0 CA--C 1.528 0.096 0 C-N-CA 125.518 1.527 . . . . 3.14 107.671 177.583 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -75.25 -27.74 59.59 Favored 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 126.35 1.86 . . . . 1.88 108.845 178.235 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -42.24 -48.84 4.98 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.256 1.822 . . . . 4.33 112.143 170.336 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -45.87 -54.4 8.2 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.369 1.468 . . . . 3.26 110.723 174.872 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . 0.408 ' NZ ' ' OD2' ' B' ' 52' ' ' ASP . 1.6 mppt? -67.93 -55.51 12.48 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 107.363 -1.347 . . . . 4.93 107.363 -177.912 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -40.87 -56.17 2.29 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 125.207 1.403 . . . . 2.56 110.966 -179.973 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -61.27 -42.04 97.96 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 117.8 0.273 . . . . 3.53 111.404 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 21.4 m -59.44 -32.1 69.9 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.065 0.394 . . . . 2.32 112.065 176.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 mp -76.65 -57.2 3.99 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.463 0.574 . . . . 3.31 111.076 172.134 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -59.63 -16.19 24.32 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.348 1.859 . . . . 1.74 113.557 -162.397 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.7 m -32.01 -26.33 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 129.848 3.259 . . . . 2.51 119.007 -132.885 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -54.3 -31.32 53.77 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 120.497 1.499 . . . . 3.03 111.314 159.025 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 70.57 68.89 0.2 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.814 1.246 . . . . 3.49 111.077 166.44 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 41.5 p30 -121.14 -7.23 9.4 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.845 1.258 . . . . 1.93 112.497 -177.816 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 18.8 m 72.13 15.48 5.46 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.239 1.415 . . . . 2.69 112.789 -176.567 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -115.76 106.19 13.57 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 127.152 2.181 . . . . 3.94 107.386 164.778 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -83.49 90.12 7.17 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 106.505 -1.665 . . . . 2.09 106.505 167.004 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 31.3 pttt -84.75 174.2 10.08 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.049 0.94 . . . . 5.01 111.37 179.078 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 23.3 p90 -84.67 49.35 1.69 Allowed 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.75 1.019 . . . . 6.88 113.75 -168.424 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -172.03 58.36 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.529 1.531 . . . . 2.95 108.866 116.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -87.11 -59.13 2.34 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 106.758 -1.571 . . . . 2.05 106.758 124.182 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -42.27 -50.94 4.92 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 125.51 1.524 . . . . 4.26 115.044 -168.333 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.444 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 0.0 OUTLIER -45.88 -35.39 4.5 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-O 117.918 -1.039 . . . . 5.67 109.621 -177.835 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 8.0 mmt180 -35.77 -55.26 0.72 Allowed 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 117.66 -1.162 . . . . 4.62 111.087 -178.159 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.4 tp -48.31 -46.98 36.94 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 120.276 1.398 . . . . 1.74 112.203 -177.369 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 64.3 mt -72.87 -39.75 59.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 C-N-CA 125.154 1.382 . . . . 3.01 107.965 -176.965 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -45.93 -53.19 9.08 Favored Glycine 0 N--CA 1.446 -0.638 0 CA-C-O 122.908 1.282 . . . . 2.59 110.864 170.254 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . 0.428 ' OE1' ' NZ ' ' B' ' 85' ' ' LYS . 9.5 mm-40 -75.3 -47.77 26.28 Favored 'General case' 0 N--CA 1.438 -1.029 0 C-N-CA 126.734 2.014 . . . . 3.47 107.199 -166.847 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mp -38.85 -47.15 1.38 Allowed 'General case' 0 C--N 1.34 0.171 0 C-N-CA 125.305 1.442 . . . . 3.29 111.138 172.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -45.61 -46.16 14.22 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.448 -0.787 . . . . 2.42 111.379 178.548 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . 0.428 ' NZ ' ' OE1' ' B' ' 82' ' ' GLU 0.453 0.0 OUTLIER -83.74 -34.72 24.8 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 116.285 1.957 . . . . 3.34 116.285 166.033 . . . . . . . . 4 4 . 1 . 023 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -59.45 -18.92 43.59 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 121.215 1.825 . . . . 3.85 113.052 -176.593 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 6.9 tp -41.51 -51.54 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 O-C-N 121.894 -0.504 . . . . 2.58 110.732 163.468 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -86.22 -48.69 8.33 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.681 1.593 . . . . 5.46 113.441 171.137 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 46.2 tttp . . . . . 0 CA--C 1.537 0.475 0 C-N-CA 124.476 1.11 . . . . 5.03 111.991 -163.853 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 . . . . . 0 CA--C 1.539 0.547 0 N-CA-C 108.116 -1.068 . . . . 5.73 108.116 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -72.71 88.34 0.91 Allowed 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 122.814 2.343 . . . . 4.16 110.066 -175.908 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 87.6 mt -64.3 137.02 57.7 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 107.36 -1.348 . . . . 2.6 107.36 170.912 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.9 t -65.47 169.07 6.42 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.403 -0.591 . . . . 2.26 109.403 176.72 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.1 tt0 -59.23 -48.28 82.22 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 121.586 0.708 . . . . 3.7 109.561 -175.896 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.4 mp -57.98 -45.7 86.32 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 118.245 -0.883 . . . . 2.8 110.267 -179.307 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -57.81 -53.33 59.48 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.09 0.956 . . . . 2.12 111.34 174.824 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.84 -49.35 75.69 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 108.827 -0.805 . . . . 5.19 108.827 -176.1 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 70.7 p -68.81 -44.42 73.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.097 -0.501 . . . . 1.88 110.994 -175.141 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.257 2.5 pp -63.59 -36.94 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 C-N-CA 118.441 -1.304 . . . . 2.06 109.809 176.797 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -59.04 -50.37 74.35 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.462 1.028 . . . . 3.22 110.187 173.031 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.73 -38.34 78.16 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.366 0.603 . . . . 1.97 111.921 -175.143 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 10.8 m -78.27 -36.98 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 O-C-N 120.54 -1.35 . . . . 1.59 111.012 174.302 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 t -59.01 -41.89 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-N 119.427 1.012 . . . . 2.07 110.481 177.359 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.6 t -65.22 -41.88 93.97 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.015 0.825 . . . . 2.01 110.466 176.604 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 22.4 m -61.98 -47.83 83.05 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.659 0.663 . . . . 1.89 109.907 177.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -48.45 -56.77 7.36 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 124.449 1.1 . . . . 4.47 109.883 169.075 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -62.72 -45.44 92.75 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.338 0.655 . . . . 5.32 111.737 -171.467 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.24 -25.88 68.06 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 122.269 -0.269 . . . . 3.31 110.775 179.823 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -80.2 -39.64 28.79 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 118.354 0.524 . . . . 3.84 112.262 164.798 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.94 -37.67 64.1 Favored 'General case' 0 C--O 1.24 0.553 0 O-C-N 120.122 -1.611 . . . . 1.93 110.497 -174.747 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -21.07 66.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.25 1.42 . . . . 5.56 113.302 -179.841 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.0 -66.07 0.45 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 119.849 1.204 . . . . 3.88 111.561 -168.713 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -123.39 151.82 42.19 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 127.148 2.179 . . . . 3.25 109.858 -168.333 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 41.63 62.54 1.89 Allowed Glycine 0 CA--C 1.523 0.589 0 C-N-CA 124.207 0.908 . . . . 2.36 112.941 153.772 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . 0.457 10.7 mpt_? 85.54 112.1 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.558 1.318 . . . . 7.06 114.558 175.757 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -67.14 49.87 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 128.605 2.762 . . . . 4.62 114.522 -177.796 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.86 -54.46 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 108.626 -0.879 . . . . 4.36 108.626 -165.294 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -82.71 131.19 35.21 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 127.403 2.281 . . . . 2.88 107.72 175.907 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -97.97 129.64 44.86 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.297 0.639 . . . . 3.49 109.606 -175.807 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.9 t -82.58 161.86 22.13 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 125.663 1.585 . . . . 3.8 109.603 177.64 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.4 p -57.46 -39.71 70.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 116.212 -0.449 . . . . 3.62 109.927 167.919 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -69.91 -57.14 5.39 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-O 117.823 -1.084 . . . . 2.2 108.977 -178.186 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 63.9 mt-10 -39.0 -49.61 1.72 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 119.07 0.85 . . . . 1.77 112.12 169.91 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -57.71 -52.15 66.63 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 122.011 -0.43 . . . . 4.04 110.723 175.006 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 48.1 tttt -57.23 -38.13 73.3 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.715 -0.616 . . . . 3.29 111.261 -179.959 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -55.43 -34.91 64.86 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.278 0.49 . . . . 2.96 111.376 177.193 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -65.07 -53.78 40.24 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.294 -1.002 . . . . 3.41 108.294 -178.096 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.2 m -66.86 -40.91 86.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-N 115.318 -0.856 . . . . 1.96 109.71 -173.458 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.3 m -60.9 -53.74 53.59 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.288 1.035 . . . . 2.43 110.533 176.001 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -71.11 -48.0 54.79 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 119.188 -0.434 . . . . 3.36 111.282 -170.128 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -154.21 85.85 1.15 Allowed 'General case' 0 C--N 1.34 0.166 0 CA-C-N 118.644 0.656 . . . . 4.97 111.492 177.776 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 tp -157.62 59.02 1.59 Allowed Pre-proline 0 CA--C 1.543 0.696 0 CA-C-N 117.988 0.358 . . . . 2.84 111.602 161.454 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -65.85 -54.61 0.52 Allowed 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 124.103 3.202 . . . . 2.33 113.865 -166.394 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -107.66 41.31 1.54 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 119.295 0.952 . . . . 4.97 110.066 -169.671 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 mp -126.31 -98.78 0.4 Allowed 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 106.727 -1.583 . . . . 2.05 106.727 -178.416 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 87.6 mt -90.06 55.99 3.29 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.119 -0.988 . . . . 2.6 109.365 -168.183 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 157.57 14.49 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.658 -0.701 . . . . 5.45 110.925 -179.528 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 84.25 41.57 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 128.045 2.538 . . . . 4.56 110.193 -170.01 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.3 m -72.4 26.29 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 124.389 1.076 . . . . 3.37 113.556 -177.425 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -74.02 -76.85 0.67 Allowed Glycine 0 CA--C 1.522 0.478 0 N-CA-C 105.86 -2.896 . . . . 1.7 105.86 166.475 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 10.7 m -71.19 54.57 0.19 Allowed 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 127.276 2.23 . . . . 3.7 112.114 176.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -57.04 -28.54 62.63 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 125.302 1.441 . . . . 2.27 109.866 175.554 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -46.6 -33.43 4.16 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 125.121 1.368 . . . . 4.21 112.565 170.032 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -50.19 -60.88 2.53 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.035 -1.098 . . . . 4.04 108.035 172.884 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.7 -38.81 73.69 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.059 -0.973 . . . . 4.82 109.47 -172.969 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -49.64 -56.79 8.77 Favored 'General case' 0 CA--C 1.528 0.126 0 N-CA-C 109.389 -0.597 . . . . 2.54 109.389 175.04 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -63.42 -36.53 84.05 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 111.549 0.203 . . . . 4.26 111.549 178.945 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.1 m -59.36 -32.53 70.2 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.821 -0.549 . . . . 2.58 112.45 174.063 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 17.7 mt -87.47 -51.67 5.79 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 125.307 1.443 . . . . 2.68 111.679 -175.709 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -75.22 69.42 2.07 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.616 1.167 . . . . 1.52 109.83 -173.695 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 16.4 m -51.36 -42.71 28.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 124.47 1.108 . . . . 2.73 113.711 -168.992 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -84.22 -6.62 59.42 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.273 0.488 . . . . 2.61 112.245 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . 0.306 0.0 OUTLIER 51.25 59.95 4.23 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.646 1.979 . . . . 5.69 113.448 179.365 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.0 p30 -101.6 -9.39 21.0 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.259 1.423 . . . . 1.83 111.44 175.91 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . 0.295 15.7 p 80.9 -0.54 1.8 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 127.751 2.42 . . . . 3.16 114.234 -174.831 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -110.33 124.68 52.11 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.204 1.002 . . . . 3.05 108.345 173.064 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -84.7 97.77 9.84 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 106.071 -1.825 . . . . 1.98 106.071 168.084 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.3 pttt -69.65 162.8 26.95 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.542 1.065 . . . . 7.35 109.32 173.095 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -38.46 -52.61 1.57 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.695 1.198 . . . . 6.6 113.429 -173.051 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.08 -45.49 85.04 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.858 0.463 . . . . 2.09 111.174 -179.212 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -60.0 -45.43 92.77 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.673 -0.492 . . . . 1.89 109.673 178.915 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -66.01 -45.15 82.57 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 118.558 -0.734 . . . . 4.12 110.458 177.581 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.53 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -42.8 -47.13 5.44 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-O 117.133 -1.413 . . . . 6.46 107.239 173.499 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . 0.406 ' C ' ' O ' ' A' ' 77' ' ' TRP . 13.4 mtp-105 -39.16 -45.76 1.36 Allowed 'General case' 0 C--O 1.213 -0.829 0 CA-C-O 117.368 -1.301 . . . . 4.48 111.364 -177.422 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.5 tp -45.12 -56.94 4.25 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 120.226 1.375 . . . . 2.0 112.319 174.526 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.7 mp -61.81 -40.69 87.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 C-N-CA 126.949 2.1 . . . . 2.62 107.761 179.636 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -44.98 -54.89 6.66 Favored Glycine 0 CA--C 1.528 0.858 0 N-CA-C 109.761 -1.336 . . . . 2.28 109.761 170.707 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -74.27 -38.9 63.3 Favored 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 127.266 2.226 . . . . 2.7 107.727 -169.193 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 11.3 mt -52.85 -43.17 65.86 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 119.365 0.984 . . . . 3.39 110.912 178.869 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.49 -25.0 59.09 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.833 0.679 . . . . 2.39 112.833 176.829 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -83.78 -57.15 3.33 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.908 1.683 . . . . 2.57 111.498 168.716 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -57.33 -26.34 60.79 Favored 'General case' 0 N--CA 1.465 0.306 0 O-C-N 120.826 -1.171 . . . . 3.86 112.841 -175.604 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.0 tp -42.5 -33.24 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 C-N-CA 124.626 1.17 . . . . 2.96 112.284 168.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.1 -5.7 5.53 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.122 0.969 . . . . 7.27 112.785 174.39 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 26.8 tttp . . . . . 0 CA--C 1.542 0.644 0 CA-C-N 119.666 1.121 . . . . 4.43 113.424 176.233 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.546 0.806 0 CA-C-O 118.886 -0.578 . . . . 3.87 110.338 . . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 3.2 t -86.77 -171.88 3.73 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.334 1.054 . . . . 2.0 113.149 -170.397 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -55.16 -67.04 0.31 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.786 1.634 . . . . 2.33 112.837 -170.97 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 20.5 mt -53.13 -42.21 65.82 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.265 -0.897 . . . . 2.27 111.32 176.234 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -57.45 -42.4 82.42 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 119.454 -0.308 . . . . 3.17 110.443 177.415 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.7 -49.58 75.9 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 124.536 1.134 . . . . 4.03 110.148 175.066 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 76.0 p -67.33 -25.88 66.22 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 118.895 -0.574 . . . . 2.45 112.151 -174.58 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.287 2.7 pp -80.32 -32.56 13.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 119.219 0.918 . . . . 2.31 111.268 165.844 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -58.46 -53.42 58.47 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 119.553 1.069 . . . . 2.97 110.808 175.406 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 8.2 t -48.47 -45.13 36.31 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 119.59 1.086 . . . . 1.87 111.557 -174.013 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 33.3 m -69.96 -34.25 59.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 O-C-N 121.113 -0.992 . . . . 2.06 111.577 177.917 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 59.1 t -63.14 -52.32 60.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 118.883 0.765 . . . . 2.05 110.224 173.353 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 8.9 t -60.72 -43.01 98.37 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.547 1.067 . . . . 1.84 110.557 179.009 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 54.9 m -57.72 -49.23 77.22 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.388 -0.82 . . . . 1.85 110.768 174.251 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -48.68 -53.51 18.47 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 121.512 -0.742 . . . . 5.15 110.191 170.209 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -59.32 -47.83 83.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.442 1.097 . . . . 3.7 110.969 -173.331 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -61.55 -47.43 85.58 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 119.876 -0.73 . . . . 3.64 109.909 178.38 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -59.2 -35.16 73.12 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 120.849 -1.157 . . . . 4.1 111.828 173.584 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.11 -34.77 79.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 120.926 -1.109 . . . . 1.9 109.601 -179.875 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -18.53 64.79 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 117.566 -1.207 . . . . 4.8 113.159 -177.86 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -49.17 -66.73 0.35 Allowed 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 114.113 1.153 . . . . 2.56 114.113 -155.921 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -92.54 -79.69 0.39 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.361 0.875 . . . . 3.3 113.361 -172.762 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.79 170.61 30.89 Favored Glycine 0 C--N 1.34 0.764 0 C-N-CA 128.792 3.091 . . . . 2.41 111.611 160.527 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.9 mmt85 46.69 96.85 0.01 OUTLIER 'General case' 0 C--O 1.241 0.621 0 C-N-CA 124.843 1.257 . . . . 4.32 113.724 146.781 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -76.69 52.88 0.85 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.937 0.895 . . . . 4.19 111.198 173.239 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -147.59 -64.78 0.27 Allowed 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 105.256 -2.128 . . . . 4.09 105.256 179.182 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 26.0 p -78.34 139.38 38.82 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.942 -1.026 . . . . 2.15 109.855 -178.533 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.82 128.42 36.16 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 106.883 -1.525 . . . . 3.69 106.883 159.156 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 6.5 t -82.46 -170.13 2.79 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.37 1.468 . . . . 2.92 108.496 163.707 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 85.1 t -67.03 -98.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 130.183 3.393 . . . . 3.41 101.969 -174.113 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -71.7 77.92 0.84 Allowed 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 121.364 1.893 . . . . 2.68 108.313 178.546 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -163.3 -56.84 0.04 OUTLIER 'General case' 0 N--CA 1.444 -0.755 1 C-N-CA 132.155 4.182 . . . . 1.96 102.752 177.849 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -63.36 -52.78 60.29 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.061 -0.972 . . . . 3.29 109.01 170.359 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 9.8 ttmm -55.95 -37.1 68.56 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 119.677 -0.809 . . . . 3.63 110.333 -176.217 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -56.2 -38.03 70.44 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.839 0.681 . . . . 2.76 112.839 175.528 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -62.97 -51.66 65.99 Favored 'General case' 0 C--O 1.231 0.106 0 N-CA-C 108.083 -1.08 . . . . 3.6 108.083 -178.784 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 12.6 m -68.85 -48.66 69.52 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-N 115.861 -0.608 . . . . 1.93 109.726 -172.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 47.1 m -53.64 -54.95 30.48 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.991 0.916 . . . . 1.8 110.931 175.662 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -77.18 -56.4 4.6 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 122.362 -0.211 . . . . 1.9 110.745 -168.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -80.91 -50.75 9.37 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.552 0.945 . . . . 3.05 113.552 -164.97 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.23 -21.28 0.74 Allowed Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 115.022 1.49 . . . . 3.49 115.022 -157.014 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -62.98 -11.56 25.27 Favored 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 121.59 -2.254 . . . . 2.55 111.467 -74.407 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -107.39 -37.01 6.34 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 125.512 1.525 . . . . 3.6 110.993 -174.884 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 28.5 tp -47.39 -46.3 25.96 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 124.313 1.045 . . . . 1.9 111.765 -172.432 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.2 mt -108.27 131.05 55.1 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 105.696 -1.965 . . . . 2.12 105.696 153.641 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -105.37 -175.09 2.69 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 125.609 1.564 . . . . 6.85 109.15 -178.403 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.25 3.7 p30 44.5 47.25 8.32 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 125.227 1.411 . . . . 4.63 110.917 178.731 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -52.85 -14.84 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 C-N-CA 128.082 2.553 . . . . 4.02 113.589 -178.587 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -48.61 -59.58 6.51 Favored Glycine 0 CA--C 1.531 1.063 0 N-CA-C 110.197 -1.161 . . . . 2.77 110.197 162.835 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 23.2 t -73.97 39.49 0.11 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 128.212 2.605 . . . . 3.01 113.15 -169.244 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -67.77 -31.66 71.7 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 125.786 1.634 . . . . 1.89 110.131 -178.393 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -43.75 -52.64 6.45 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.604 1.562 . . . . 4.33 112.602 177.795 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -40.43 87.3 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.625 1.102 . . . . 4.11 111.17 -176.308 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -62.05 -58.99 5.75 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.866 -0.791 . . . . 5.65 108.866 172.12 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -44.48 -50.74 9.29 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 119.112 0.869 . . . . 2.37 111.4 -179.118 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 10.9 tptp -55.3 -46.03 76.24 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.284 1.033 . . . . 4.89 111.333 177.052 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 20.0 m -71.79 -29.06 64.05 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.54 0.736 . . . . 2.14 112.356 179.783 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 65.6 mt -81.3 -57.91 3.28 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.857 1.263 . . . . 2.34 111.212 -175.935 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -57.68 -10.96 1.8 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.797 2.039 . . . . 1.84 115.773 -166.047 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 30.2 m -35.9 -25.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 130.618 3.567 . . . . 2.91 119.173 -130.92 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 21.6 p-10 -61.71 -24.62 66.91 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 120.846 1.657 . . . . 3.97 110.645 169.051 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 65.7 65.07 0.55 Allowed 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.711 2.005 . . . . 5.7 112.047 176.067 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 35.7 p30 -109.48 -8.57 15.0 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.664 1.986 . . . . 2.4 110.542 176.798 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.5 m 63.66 16.24 9.55 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.304 1.041 . . . . 2.15 113.402 -170.384 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -108.62 101.08 10.26 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 105.861 -1.903 . . . . 3.15 105.861 158.377 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.82 94.97 0.34 Allowed 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 105.026 -2.213 . . . . 2.55 105.026 166.482 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 46.5 tptt -83.14 162.42 21.3 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.999 0.519 . . . . 6.33 111.007 -155.009 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -83.11 64.4 7.65 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 109.044 -0.725 . . . . 5.44 109.044 162.413 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -163.97 51.67 0.14 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 115.66 -2.416 . . . . 5.21 113.303 82.397 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 -85.85 -53.06 5.34 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 126.855 2.062 . . . . 2.24 108.213 153.035 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -40.9 -43.2 2.02 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 127.571 2.348 . . . . 4.58 113.077 -169.523 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.512 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 0.0 OUTLIER -39.09 -48.51 1.69 Allowed 'General case' 0 C--N 1.343 0.29 0 O-C-N 124.124 0.89 . . . . 5.6 109.078 178.031 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -38.8 -46.39 1.26 Allowed 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 124.127 0.971 . . . . 5.67 112.948 -168.477 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 5.4 tp -57.59 -46.24 84.27 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.943 1.247 . . . . 1.91 112.966 178.534 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 15.7 mt -66.04 -41.42 89.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 106.95 -1.5 . . . . 3.21 106.95 177.596 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -43.64 -56.6 4.89 Favored Glycine 0 N--CA 1.44 -1.064 0 N-CA-C 108.739 -1.744 . . . . 2.16 108.739 171.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -69.32 -61.66 1.7 Allowed 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 125.567 1.547 . . . . 2.2 108.803 -171.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 4.5 pp -53.18 -29.92 34.54 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 111.802 0.297 . . . . 3.08 111.802 -171.79 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -51.12 -48.22 61.8 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.988 1.107 . . . . 2.28 113.988 169.148 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.27 0.0 OUTLIER -77.18 -39.8 47.59 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 119.781 1.173 . . . . 3.26 111.743 172.286 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -55.84 -34.01 65.02 Favored 'General case' 0 C--N 1.339 0.117 0 CA-C-O 118.36 -0.829 . . . . 2.94 112.715 -166.37 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 10.0 tt -42.65 -45.75 1.16 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 118.749 0.704 . . . . 1.89 111.363 173.381 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 63.8 ttt-85 -83.67 -43.78 15.21 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.097 0.959 . . . . 4.73 111.684 172.464 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 45.2 tttt . . . . . 0 CA--C 1.536 0.44 0 N-CA-C 114.682 1.364 . . . . 7.2 114.682 -144.032 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 . . . . . 0 CA--C 1.541 0.618 0 N-CA-C 109.719 -0.474 . . . . 5.47 109.719 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.87 142.33 62.37 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.392 1.395 . . . . 2.7 108.662 171.335 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.7 mt -111.6 -173.86 2.34 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.562 0.745 . . . . 2.75 110.086 -169.158 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.2 t -91.09 151.34 21.04 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.331 0.652 . . . . 2.33 110.202 -178.542 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -37.2 -54.52 1.02 Allowed 'General case' 0 C--N 1.339 0.134 0 C-N-CA 125.998 1.719 . . . . 2.31 113.456 -177.353 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.1 mt -63.7 -47.32 81.65 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 117.739 -1.125 . . . . 3.0 110.392 -175.857 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.21 -61.15 2.14 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.713 1.205 . . . . 4.97 110.392 170.044 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -48.7 -51.23 29.7 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.195 0.998 . . . . 3.77 109.318 -178.359 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 81.3 p -62.5 -48.42 79.63 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.626 0.602 . . . . 2.27 112.626 179.783 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.309 2.7 pp -60.42 -41.66 88.27 Favored 'Isoleucine or valine' 0 C--N 1.344 0.362 0 CA-C-N 119.459 1.027 . . . . 2.13 110.537 179.685 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -60.41 -53.05 62.24 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 119.261 -0.976 . . . . 2.87 109.234 173.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -53.62 -36.78 62.38 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.81 0.67 . . . . 1.89 112.81 -174.849 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.3 m -78.52 -45.2 26.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-N 119.311 0.96 . . . . 1.95 111.156 172.8 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 45.5 t -57.47 -40.75 76.39 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.333 0 CA-C-O 118.553 -0.737 . . . . 2.07 110.834 -176.891 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.0 t -59.61 -48.05 83.2 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 119.729 1.15 . . . . 2.02 110.335 176.027 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.7 m -53.19 -59.23 4.81 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 109.005 -0.739 . . . . 1.96 109.005 175.147 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -59.11 -43.52 91.91 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 112.052 0.39 . . . . 9.71 112.052 -176.127 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -61.18 -53.97 50.25 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 125.515 1.526 . . . . 5.1 110.409 -178.605 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 40.0 p -57.3 -50.51 72.69 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.074 -0.713 . . . . 3.53 109.074 177.07 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.89 -47.04 64.75 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-O 121.637 0.732 . . . . 4.54 111.63 176.806 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.65 -17.16 45.71 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 126.55 1.94 . . . . 1.64 111.973 -178.041 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -24.12 67.59 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 117.657 -1.163 . . . . 6.12 111.351 171.598 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -42.61 -62.45 0.98 Allowed 'General case' 0 C--N 1.346 0.431 0 C-N-CA 124.378 1.071 . . . . 3.21 112.082 -174.056 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -122.44 173.17 7.83 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 127.816 2.446 . . . . 2.59 107.606 -177.271 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -22.36 133.33 0.01 OUTLIER Glycine 0 CA--C 1.533 1.201 0 C-N-CA 127.458 2.456 . . . . 1.74 115.348 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.1 mtt85 64.47 103.49 0.03 OUTLIER 'General case' 0 C--O 1.239 0.503 0 C-N-CA 125.319 1.448 . . . . 6.36 111.907 179.509 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.38 58.25 0.39 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.194 1.398 . . . . 5.89 112.015 173.424 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 57.4 p-10 -170.94 -45.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 126.109 1.764 . . . . 4.24 108.61 170.391 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.5 m -84.16 139.87 32.13 Favored 'General case' 0 N--CA 1.444 -0.741 0 C-N-CA 125.152 1.381 . . . . 4.26 109.639 -179.379 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -89.8 175.11 7.36 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.44 1.096 . . . . 3.05 108.563 -178.447 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 35.2 m -153.56 170.13 21.55 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 105.845 -1.909 . . . . 3.66 105.845 179.365 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.3 p -51.63 -57.75 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 119.873 1.215 . . . . 3.39 113.443 -167.001 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -67.03 -47.26 71.97 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.907 -0.405 . . . . 2.28 109.907 -176.419 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -38.62 -51.54 1.64 Allowed 'General case' 0 C--O 1.231 0.12 0 C-N-CA 125.83 1.652 . . . . 1.83 110.863 167.839 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.56 -58.05 10.27 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.431 -0.804 . . . . 4.68 109.665 176.916 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.9 tttm -53.13 -47.45 68.67 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 118.849 -0.596 . . . . 3.82 111.555 -175.106 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -51.36 -41.58 60.72 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.378 0.535 . . . . 2.28 110.986 175.795 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 14.9 tp -64.96 -49.92 68.42 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 119.204 0.911 . . . . 3.79 109.028 -174.876 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 2.3 m -70.31 -46.52 71.09 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 CA-C-O 121.519 0.676 . . . . 2.0 109.215 -173.696 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.4 m -59.6 -49.29 78.33 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.79 0.836 . . . . 2.62 109.941 179.877 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -81.11 -56.13 4.29 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 118.914 -0.565 . . . . 4.16 112.13 -171.527 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.01 39.43 2.55 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.223 0.92 . . . . 5.43 113.44 -173.753 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 tp -150.19 70.83 9.26 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-N 119.273 0.942 . . . . 2.86 110.231 173.062 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.08 -49.38 1.39 Allowed 'Trans proline' 0 N--CA 1.451 -1.017 0 C-N-CA 123.221 2.614 . . . . 1.85 113.084 -165.067 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -120.24 -29.41 4.85 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 118.373 0.533 . . . . 3.84 112.082 -167.27 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 13.6 tp -45.43 -62.98 1.05 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.241 1.017 . . . . 1.85 113.242 -170.065 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.3 mt -84.87 -64.13 1.21 Allowed 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 108.186 -1.042 . . . . 3.48 108.186 174.132 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.5 tptm 68.59 157.65 0.14 Allowed 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 124.656 1.182 . . . . 7.46 111.665 -170.284 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 59.6 t0 50.13 68.69 0.71 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 123.626 1.679 . . . . 4.56 109.145 -147.739 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.7 m -82.64 29.91 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 112.999 -1.91 . . . . 3.13 109.893 160.484 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -101.85 -58.43 0.8 Allowed Glycine 0 C--N 1.341 0.823 0 N-CA-C 108.278 -1.929 . . . . 1.74 108.278 172.834 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.1 t -74.1 57.14 0.63 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.386 1.474 . . . . 2.45 110.682 179.851 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -69.33 -42.53 75.19 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 124.035 0.934 . . . . 2.29 109.528 -175.889 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -39.46 -50.31 2.12 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 126.065 1.746 . . . . 4.25 112.961 -179.096 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -52.88 -52.47 57.36 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.596 0.712 . . . . 3.07 110.291 176.618 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.59 -38.01 83.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.213 0.605 . . . . 4.44 109.549 -177.346 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -55.34 -49.84 71.2 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.506 -0.553 . . . . 2.48 109.506 174.095 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -64.52 -39.01 92.98 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 117.933 0.333 . . . . 3.85 111.353 177.04 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.8 m -58.06 -41.82 84.16 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.768 -0.583 . . . . 3.16 111.072 174.978 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 36.7 mt -70.0 -68.44 0.42 Allowed 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.881 0.872 . . . . 2.77 109.067 178.363 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -77.46 75.83 4.0 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.801 1.24 . . . . 1.79 110.069 -171.775 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.7 m -46.24 -35.96 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 124.718 1.207 . . . . 2.72 113.625 -177.824 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -84.95 -14.62 47.02 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.707 1.203 . . . . 2.46 112.879 -178.214 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 51.89 46.64 26.25 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.028 1.331 . . . . 5.04 110.805 -176.535 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 35.1 p30 -86.38 -18.5 31.68 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.666 0.787 . . . . 1.93 109.909 168.168 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.0 t 71.45 16.06 6.05 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.872 1.669 . . . . 3.97 112.743 -178.886 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -120.84 104.92 10.23 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 105.76 -1.941 . . . . 3.83 105.76 172.397 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -88.07 92.91 9.32 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.221 -1.399 . . . . 2.33 107.221 -174.012 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 33.5 tttt -55.13 160.03 2.27 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 108.878 -0.786 . . . . 7.05 108.878 172.385 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -39.77 -57.62 1.51 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.422 1.089 . . . . 6.63 112.777 -178.75 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -60.46 -38.25 83.58 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.087 0.555 . . . . 2.52 112.01 179.08 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -66.77 -50.55 62.34 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.822 -0.436 . . . . 2.14 109.822 -178.024 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -58.88 -43.98 91.03 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 119.818 -0.753 . . . . 8.03 109.628 175.778 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' TRP . . . . . 0.611 ' CZ2' ' CE2' ' B' ' 77' ' ' TRP . 3.8 t-105 -48.5 -34.04 10.53 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 117.714 -1.136 . . . . 4.82 112.019 -177.142 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.7 mtp85 -39.25 -47.49 1.68 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.726 1.148 . . . . 4.79 111.549 174.072 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.1 tp -45.66 -47.45 15.0 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.408 0.683 . . . . 1.88 111.164 179.208 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.8 mp -64.08 -21.37 28.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-O 120.874 0.368 . . . . 3.05 110.265 -169.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' GLY . . . . . 0.541 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -76.67 -44.69 14.88 Favored Glycine 0 CA--C 1.496 -1.106 0 N-CA-C 109.012 -1.635 . . . . 1.62 109.012 179.452 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -63.98 -43.23 96.36 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 105.802 -1.925 . . . . 2.64 105.802 -179.53 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.5 mt -54.62 -60.28 3.56 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 121.447 -0.783 . . . . 3.86 111.71 171.094 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.7 -27.74 63.2 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.281 1.032 . . . . 2.37 112.46 -176.908 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -80.53 -48.77 12.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.5 1.52 . . . . 3.03 110.054 177.202 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -55.46 -45.67 76.88 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 126.038 1.735 . . . . 2.37 110.694 -179.967 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.0 tt -63.69 0.3 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 N-CA-C 113.271 0.841 . . . . 2.24 113.271 175.661 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.71 -59.54 1.82 Allowed 'General case' 0 C--O 1.236 0.367 0 O-C-N 120.552 -1.343 . . . . 8.71 109.821 162.975 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.342 0.261 0 N-CA-C 114.339 1.237 . . . . 4.23 114.339 -168.812 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.541 0.599 0 N-CA-C 109.088 -0.708 . . . . 3.21 109.088 . . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 13.7 t -79.57 -176.62 5.4 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.875 0.87 . . . . 2.37 111.828 -166.706 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -62.98 -67.58 0.41 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.491 0.716 . . . . 3.27 112.26 -165.278 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 18.6 mt -50.07 -45.46 52.49 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.03 -1.044 . . . . 2.32 111.244 176.139 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -56.93 -37.46 71.52 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.252 1.021 . . . . 3.69 111.686 177.123 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.72 -44.21 51.09 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.195 0.998 . . . . 4.19 109.241 179.521 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 25.7 t -57.39 -46.95 82.89 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.272 0.629 . . . . 2.29 110.07 -179.031 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.275 2.7 pp -65.98 -18.93 24.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 O-C-N 121.172 -0.955 . . . . 2.34 112.282 174.505 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.38 -56.17 5.16 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.751 1.16 . . . . 3.17 110.639 167.496 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.1 t -47.48 -43.91 24.83 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.051 1.296 . . . . 2.19 111.422 -169.836 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 15.4 m -69.36 -37.93 76.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 O-C-N 121.562 -0.711 . . . . 2.09 112.128 178.032 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.65 -42.36 95.76 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.133 0.973 . . . . 2.26 109.585 175.011 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 18' ' ' THR . . . . . . . . . . . . 0.269 9.8 t -68.26 -36.9 80.14 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 120.774 -1.204 . . . . 2.32 111.358 174.69 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.0 m -53.59 -57.52 10.45 Favored 'General case' 0 C--N 1.345 0.382 0 CA-C-N 120.705 1.593 . . . . 1.88 109.248 169.632 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -41.59 -55.54 2.87 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.269 1.028 . . . . 5.45 110.539 172.503 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -58.28 -53.21 60.81 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.251 1.02 . . . . 3.51 111.1 -174.624 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 40.3 p -56.1 -52.9 62.63 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.729 0.411 . . . . 3.03 110.893 -178.955 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -61.47 -47.8 84.01 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 118.042 0.383 . . . . 4.17 110.632 177.699 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.19 -29.55 61.04 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 126.221 1.809 . . . . 2.08 111.271 -176.176 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.16 -15.67 47.7 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 117.951 -1.023 . . . . 3.95 113.038 176.524 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -58.13 -65.13 0.69 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 116.131 1.9 . . . . 2.06 116.131 -166.801 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -88.02 -77.88 0.34 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.371 0.532 . . . . 2.98 112.205 -163.199 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.39 164.9 25.94 Favored Glycine 0 C--N 1.339 0.728 0 C-N-CA 128.048 2.737 . . . . 2.48 110.609 150.805 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 17.9 mmt85 53.47 98.96 0.01 OUTLIER 'General case' 0 C--O 1.24 0.591 0 N-CA-C 115.326 1.602 . . . . 4.43 115.326 135.565 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -72.82 60.68 0.52 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.018 1.727 . . . . 3.95 112.261 178.615 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -164.25 -61.24 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 106.716 -1.587 . . . . 4.02 106.716 -171.406 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 87.6 p -58.88 138.94 57.09 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 118.008 -0.996 . . . . 2.65 109.938 168.774 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 6.5 mp -102.08 101.45 11.81 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.248 -1.019 . . . . 3.47 108.248 152.353 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 1.4 p -84.25 176.11 8.96 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.684 1.194 . . . . 3.48 108.521 168.841 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 7.8 p -91.6 50.94 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 O-C-N 120.516 -1.365 . . . . 3.5 111.492 -170.523 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -156.37 52.78 0.54 Allowed 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 106.376 -1.712 . . . . 3.66 106.376 149.254 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -158.68 -54.83 0.07 Allowed 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 130.915 3.686 . . . . 1.72 104.046 -178.099 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -62.63 -57.64 10.34 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.801 -1.09 . . . . 3.37 109.105 173.683 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -59.13 -41.52 88.42 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 110.061 -0.348 . . . . 3.5 110.061 -175.334 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -47.88 -41.94 25.55 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.621 0.6 . . . . 3.54 112.621 170.549 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 tp -63.24 -52.4 62.29 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 119.115 0.871 . . . . 2.79 108.807 -175.018 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -68.51 -48.52 71.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.436 -0.802 . . . . 1.7 109.242 -173.307 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 68.2 m -56.67 -54.87 41.09 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 123.909 0.884 . . . . 1.96 111.178 177.34 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -80.68 -59.38 2.7 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 117.792 0.269 . . . . 2.48 111.627 -170.375 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -81.3 -48.51 11.9 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 112.404 0.52 . . . . 3.12 112.404 -160.075 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mp -64.77 -24.43 1.21 Allowed Pre-proline 0 CA--C 1.534 0.361 0 N-CA-C 113.727 1.01 . . . . 3.57 113.727 -164.178 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.79 -10.72 18.0 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.027 -2.072 . . . . 2.08 112.365 -82.837 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 70.1 t60 -95.98 -34.95 11.59 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.02 1.328 . . . . 3.74 111.15 179.761 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 33.5 tp -55.08 -66.6 0.38 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-N 119.014 0.824 . . . . 1.79 110.313 -169.078 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 80.3 mt -92.14 156.33 17.42 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 105.984 -1.858 . . . . 2.08 105.984 152.186 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.45 -166.19 2.35 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 106.42 -1.696 . . . . 6.87 106.42 -170.945 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 57.53 33.38 23.19 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 122.651 1.215 . . . . 4.7 109.456 -177.356 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 21.1 m -56.71 -29.98 31.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 125.756 1.622 . . . . 3.15 111.328 -166.564 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -41.78 -46.38 4.87 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 123.688 0.661 . . . . 3.36 111.737 172.869 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 2.4 t -93.7 19.72 8.35 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.626 0.77 . . . . 2.81 112.48 -174.389 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -42.65 -41.65 3.18 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 124.313 1.045 . . . . 1.98 111.201 178.693 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -34.58 -44.54 0.21 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.05 2.14 . . . . 4.22 113.722 173.569 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -65.11 -43.16 92.91 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.001 -1.062 . . . . 3.67 110.844 178.074 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? -65.67 -44.94 84.75 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 118.539 -0.743 . . . . 5.37 109.283 177.431 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -47.15 -53.55 12.71 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 119.196 0.907 . . . . 2.77 109.651 170.628 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -61.38 -39.26 90.0 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 122.182 -0.324 . . . . 4.57 111.568 -178.531 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 32.4 t -61.52 -41.96 98.1 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.846 0.859 . . . . 2.3 111.754 173.852 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 33.9 mt -77.94 -53.52 7.36 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 124.305 1.042 . . . . 2.55 110.254 -171.606 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.256 17.9 t0 -59.41 -8.88 1.98 Allowed 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 127.011 2.124 . . . . 1.42 116.535 -164.09 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.0 m -33.76 -19.26 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 C-N-CA 131.111 3.764 . . . . 2.51 119.414 -131.66 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -58.39 -28.2 64.96 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 120.962 1.71 . . . . 3.69 111.321 158.083 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 59.42 62.34 1.8 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.427 1.491 . . . . 4.97 110.991 175.401 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -103.18 -15.34 16.05 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.202 1.801 . . . . 1.96 111.591 175.21 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 11.8 m 73.79 21.92 2.62 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.783 1.633 . . . . 2.38 113.464 -175.254 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -129.52 109.7 11.25 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 125.36 1.464 . . . . 3.5 107.592 162.135 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -77.77 106.38 9.56 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.847 -1.168 . . . . 2.16 107.847 176.931 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 12.0 ptmt -85.54 -178.46 6.68 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 126.551 1.94 . . . . 4.89 112.115 -174.803 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -75.65 82.55 2.65 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 124.591 1.156 . . . . 5.01 108.284 -172.539 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 96.53 47.79 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.314 1 C-N-CA 133.554 4.742 . . . . 2.51 108.295 178.088 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -89.63 -60.93 1.81 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 107.934 -1.136 . . . . 1.94 107.934 120.467 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -38.71 -53.67 1.63 Allowed 'General case' 0 C--N 1.344 0.358 0 C-N-CA 127.049 2.14 . . . . 4.18 111.529 -174.172 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 77' ' ' TRP . . . . . 0.611 ' CE2' ' CZ2' ' A' ' 77' ' ' TRP . 43.0 t90 -43.4 -38.42 2.75 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 125.989 1.716 . . . . 5.45 112.42 -171.292 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -38.85 -48.66 1.57 Allowed 'General case' 0 C--N 1.342 0.25 0 C-N-CA 123.866 0.866 . . . . 6.39 111.746 174.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 6.0 tp -52.12 -48.05 65.01 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.033 0.533 . . . . 1.85 111.504 -177.271 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 64.5 mt -62.16 -30.68 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 N-CA-C 107.529 -1.285 . . . . 2.45 107.529 -178.255 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 81' ' ' GLY . . . . . 0.577 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -69.33 -52.94 19.75 Favored Glycine 0 CA--C 1.496 -1.154 0 C-N-CA 124.894 1.235 . . . . 1.53 111.392 179.965 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -50.54 -63.22 1.19 Allowed 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 107.192 -1.41 . . . . 3.37 107.192 174.047 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . 0.289 4.5 pp -58.98 -34.05 71.38 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.941 0.719 . . . . 3.24 112.941 -173.645 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.91 -38.62 73.1 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 118.265 -0.874 . . . . 2.21 111.966 174.939 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.315 0.0 OUTLIER -80.39 -41.12 25.2 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-O 116.101 -1.904 . . . . 4.53 112.189 166.451 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -45.62 -36.05 4.5 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 121.331 1.878 . . . . 2.62 112.914 -169.862 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 10.5 tt -44.05 -50.85 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 CA-C-N 118.316 0.507 . . . . 2.02 111.969 171.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.44 -50.18 8.0 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.861 2.464 . . . . 5.47 112.613 175.133 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 10.5 tttm . . . . . 0 CA--C 1.531 0.241 0 C-N-CA 126.04 1.736 . . . . 6.76 112.313 -168.68 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.0 mtt . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 108.551 -0.907 . . . . 7.35 108.551 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -146.15 170.76 16.06 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 106.202 -1.777 . . . . 3.66 106.202 170.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.71 71.47 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 128.189 2.596 . . . . 4.57 108.792 -172.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -62.82 133.22 95.08 Favored Pre-proline 0 N--CA 1.444 -0.756 0 C-N-CA 126.053 1.741 . . . . 4.3 110.457 -168.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -71.62 106.99 2.08 Favored 'Trans proline' 0 N--CA 1.453 -0.902 0 C-N-CA 122.829 2.353 . . . . 2.64 110.757 -174.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.5 mt -66.27 162.75 19.43 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.584 1.154 . . . . 2.31 110.089 172.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 t -76.31 170.1 16.98 Favored 'General case' 0 C--O 1.226 -0.135 0 O-C-N 121.554 -0.717 . . . . 2.49 109.89 -178.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -59.56 -50.21 74.79 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.477 0.711 . . . . 2.0 109.635 -174.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.7 mt -62.09 -53.39 56.18 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.55 -1.214 . . . . 2.59 111.696 176.156 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -47.33 -55.66 8.34 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.163 1.385 . . . . 2.28 110.785 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -49.71 -60.16 3.15 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.435 1.494 . . . . 3.94 109.616 173.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.4 p -57.05 -40.5 76.91 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.403 -0.811 . . . . 2.33 112.239 -175.548 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.295 2.8 pp -69.59 -42.2 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 O-C-N 121.819 -0.55 . . . . 1.68 110.248 177.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -58.66 -47.65 83.73 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 118.997 0.817 . . . . 3.47 109.804 177.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.9 m -46.03 -45.77 16.18 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.582 1.553 . . . . 2.93 112.745 174.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 32.6 m -79.89 -35.78 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 O-C-N 120.376 -1.453 . . . . 2.17 110.993 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 49.2 t -58.47 -44.23 88.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 118.779 0.718 . . . . 1.73 110.415 176.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.8 t -63.05 -46.53 87.1 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.02 0.827 . . . . 1.69 110.058 177.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 16.2 m -59.33 -49.48 77.65 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.293 0.497 . . . . 1.91 109.774 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -46.73 -52.07 14.77 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 124.146 0.978 . . . . 4.8 110.043 168.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -57.75 -50.18 74.08 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 118.566 0.621 . . . . 4.72 110.21 -174.085 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -55.79 -58.53 7.46 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 122.14 -0.35 . . . . 3.4 110.798 174.562 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -62.98 -23.23 67.33 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 112.377 0.51 . . . . 3.94 112.377 -177.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.46 -26.58 38.23 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 120.996 -1.065 . . . . 1.71 110.338 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 71.4 ttp85 -80.43 -25.73 38.8 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.888 0.875 . . . . 5.1 112.317 -177.505 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -39.06 -60.59 0.85 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.12 1.368 . . . . 3.37 112.974 -178.633 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -118.84 167.5 11.64 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 127.447 2.299 . . . . 2.37 106.354 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 0.74 108.73 0.01 OUTLIER Glycine 0 CA--C 1.536 1.383 0 C-N-CA 127.021 2.248 . . . . 1.57 115.636 171.463 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 66.13 103.25 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.928 1.455 . . . . 5.33 114.928 165.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.5 pttt -62.92 64.71 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.816 2.047 . . . . 4.77 110.973 166.212 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -177.2 -30.08 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.066 2.146 . . . . 3.61 110.599 -158.655 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 34.1 t -134.83 148.69 50.23 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 121.307 -0.871 . . . . 4.15 111.964 166.792 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -83.99 120.04 25.64 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 125.501 1.521 . . . . 3.05 107.473 165.078 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.4 m -84.48 169.6 14.34 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.599 1.56 . . . . 3.31 108.176 166.396 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.21 -43.64 91.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 O-C-N 120.854 -1.154 . . . . 3.24 112.215 -170.788 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -64.63 -51.45 62.54 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 108.989 -0.745 . . . . 2.2 108.989 -178.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -37.97 -54.31 1.31 Allowed 'General case' 0 C--O 1.232 0.136 0 C-N-CA 124.965 1.306 . . . . 1.85 112.139 166.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.21 -51.96 67.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 122.009 -0.432 . . . . 4.52 109.849 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt -55.46 -39.55 70.49 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 122.069 -0.394 . . . . 4.76 110.927 -179.121 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -55.42 -40.14 71.1 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.609 0.64 . . . . 2.56 111.851 173.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -62.88 -51.17 68.03 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 119.52 1.055 . . . . 3.65 108.664 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -69.01 -38.75 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 CA-C-N 115.991 -0.55 . . . . 1.94 110.169 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 78.0 m -63.15 -42.76 99.51 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.666 0.786 . . . . 2.21 111.224 175.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -79.84 -53.81 6.42 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 119.283 -0.389 . . . . 2.42 110.308 -168.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -98.0 -127.64 0.16 Allowed 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 109.858 -0.423 . . . . 3.67 109.858 171.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.2 mm? 29.7 59.56 0.84 Allowed Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 127.268 2.227 . . . . 3.34 114.374 -173.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.31 -42.54 3.77 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 122.488 2.125 . . . . 1.74 111.864 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -122.96 -20.6 5.75 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 113.618 0.97 . . . . 4.11 113.618 -170.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 2.0 mp -64.84 -97.2 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 118.898 0.772 . . . . 2.45 111.212 172.7 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 75.5 mt -88.74 71.66 8.71 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 120.87 -1.144 . . . . 2.27 109.31 -163.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.5 ttmm -56.06 156.03 5.84 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.155 -0.93 . . . . 6.92 110.845 170.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.0 t0 57.0 66.06 1.25 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 123.496 1.617 . . . . 4.82 109.987 -157.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.4 m -68.19 -3.3 2.36 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 112.851 -1.977 . . . . 2.76 111.616 162.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -75.4 -55.93 4.89 Favored Glycine 0 C--N 1.343 0.948 0 N-CA-C 108.136 -1.986 . . . . 1.88 108.136 176.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.5 t -74.08 52.06 0.43 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.158 1.383 . . . . 2.39 110.61 173.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -72.09 -45.57 60.14 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 125.015 1.326 . . . . 2.22 108.339 170.08 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.79 -38.14 74.95 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.561 1.144 . . . . 4.72 110.248 -164.411 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -54.07 -55.06 31.06 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.415 1.086 . . . . 3.16 111.669 167.778 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -51.36 68.57 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 107.653 -1.24 . . . . 3.6 107.653 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -46.94 -53.74 11.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.441 0.696 . . . . 2.47 110.698 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -59.56 -26.26 65.23 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.91 0.707 . . . . 4.2 112.91 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.2 m -79.76 -48.59 13.35 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.951 0.9 . . . . 3.13 111.466 178.089 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.4 mp -62.19 -48.82 78.33 Favored 'General case' 0 C--N 1.341 0.209 0 N-CA-C 109.381 -0.6 . . . . 2.74 109.381 177.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -74.33 73.07 1.83 Allowed 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 107.84 -1.17 . . . . 1.9 107.84 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 20.9 m -49.47 -30.34 4.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.484 1.113 . . . . 2.35 113.09 -173.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -87.33 -21.21 25.85 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.837 1.655 . . . . 3.11 112.645 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 55.16 50.88 14.24 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.509 1.124 . . . . 4.7 109.338 -176.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 34.1 p30 -94.09 -18.05 22.2 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.953 1.701 . . . . 1.94 110.612 172.552 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.9 m 70.4 17.21 6.98 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.371 1.468 . . . . 1.9 113.453 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -107.21 107.75 18.85 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 104.094 -2.558 . . . . 3.79 104.094 155.441 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.57 96.74 8.17 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 103.455 -2.794 . . . . 2.4 103.455 171.202 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.59 162.18 16.07 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.909 -1.145 . . . . 6.02 107.909 176.224 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -39.58 -52.49 2.19 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 123.578 0.751 . . . . 8.12 111.628 176.129 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -66.81 -27.58 67.67 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 113.496 0.924 . . . . 3.87 113.496 -176.132 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -79.73 -56.44 4.28 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.628 -1.249 . . . . 2.02 107.628 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -45.5 -50.48 12.74 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.42 1.088 . . . . 4.68 111.209 173.003 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.595 ' CH2' ' CH2' ' B' ' 77' ' ' TRP . 2.5 t-105 -39.78 -41.1 1.06 Allowed 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.426 1.89 . . . . 5.06 111.77 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 21.7 mmt180 -39.86 -48.12 2.25 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 123.651 0.781 . . . . 5.11 111.599 176.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.2 tp -48.64 -46.18 39.61 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.681 0.793 . . . . 2.04 110.405 -178.13 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 66.8 mt -63.46 -29.36 47.05 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 107.913 -1.143 . . . . 2.61 107.913 -172.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.488 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -69.98 -45.37 57.34 Favored Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 109.743 -1.343 . . . . 1.57 109.743 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -68.42 -48.19 65.27 Favored 'General case' 0 N--CA 1.437 -1.096 0 N-CA-C 106.667 -1.605 . . . . 2.5 106.667 -175.896 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 4.3 mp -42.04 -58.92 1.92 Allowed 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 118.613 0.642 . . . . 3.49 110.945 166.564 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.99 -19.73 53.96 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 113.133 0.79 . . . . 2.08 113.133 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -80.45 -52.74 7.29 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.757 1.623 . . . . 2.5 109.761 174.695 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -58.43 -29.15 65.9 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 127.305 2.242 . . . . 2.63 110.962 -171.317 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.0 tp -40.59 -38.2 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 124.534 1.134 . . . . 2.66 111.766 168.491 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.23 -43.73 3.05 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.462 1.105 . . . . 6.33 111.371 177.304 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 49.0 tttp -75.44 65.66 1.74 Allowed 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 123.765 0.826 . . . . 4.4 110.414 177.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 11.8 tttp -69.04 -18.34 64.01 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.585 -0.697 . . . . 8.74 110.486 165.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -158.53 -81.87 0.05 Allowed 'General case' 0 C--O 1.236 0.39 0 C-N-CA 125.276 1.43 . . . . 8.94 108.721 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . 2.475 39.9 m-20 137.21 -35.81 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 123.78 0.832 . . . . 5.36 109.814 176.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . 2.531 10.4 tt 161.51 -153.13 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.047 1 C-N-CA 139.749 7.219 . . . . 8.77 101.532 -15.794 . . . . . . . . 3 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.66 144.29 32.7 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 121.151 1.796 . . . . 11.14 110.007 174.23 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 19.0 mt 48.43 57.13 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 107.363 -1.347 . . . . 11.64 107.363 -156.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 7.2 ptp85 -79.0 -113.49 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.535 1.134 . . . . 14.73 110.588 -171.241 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.446 ' NZ ' ' OE2' ' B' ' 4' ' ' GLU . 1.6 tmtm? -176.78 132.64 0.2 Allowed 'General case' 0 C--O 1.237 0.415 0 N-CA-C 104.971 -2.233 . . . . 10.72 104.971 -179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . 2.208 31.9 mttm . . . . . 0 C--O 1.251 1.155 0 C-N-CA 129.529 3.132 . . . . 13.66 113.782 171.27 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 59.0 mmm . . . . . 0 CA--C 1.534 0.355 0 N-CA-C 106.736 -1.579 . . . . 7.1 106.736 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.346 . . 61.05 134.74 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 119.0 2.963 . . . . 5.43 119.0 156.869 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 79.27 92.48 0.06 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 116.772 2.138 . . . . 5.17 116.772 112.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.446 ' OE2' ' NZ ' ' A' ' 97' ' ' LYS . 3.0 mt-10 -164.37 145.7 6.78 Favored Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 125.167 1.387 . . . . 6.35 108.783 161.756 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -81.83 159.31 18.69 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 124.56 3.506 . . . . 2.78 110.234 173.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 1.7 mt -150.88 -175.47 5.14 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 113.884 1.068 . . . . 2.88 113.884 -153.93 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 4.2 t -89.05 -163.72 1.03 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.316 1.446 . . . . 2.19 113.464 173.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -65.14 -67.29 0.45 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.98 2.112 . . . . 2.1 113.057 -172.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 16.3 mt -57.16 -41.46 79.25 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 120.622 -1.299 . . . . 2.06 109.976 178.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 99.2 mt-10 -49.77 -42.97 47.8 Favored 'General case' 0 CA--C 1.563 1.473 0 C-N-CA 123.794 0.838 . . . . 3.15 112.512 167.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -61.05 -46.98 88.5 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 119.677 -1.889 . . . . 3.88 110.124 172.061 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 54.1 p -61.23 -36.96 81.36 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.613 -0.68 . . . . 2.57 111.121 -175.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.283 2.9 pp -68.63 -43.05 83.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 O-C-N 121.587 -0.696 . . . . 2.04 110.476 171.588 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.07 -43.55 82.23 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.263 0.938 . . . . 4.3 110.845 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.38 -28.77 68.89 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.1 0.56 . . . . 2.4 111.735 -174.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 34.3 m -81.35 -36.84 15.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 O-C-N 120.888 -1.132 . . . . 2.03 111.276 168.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 39.5 t -56.89 -43.92 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 118.731 0.696 . . . . 2.37 110.688 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.6 t -59.49 -50.53 73.58 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.59 0.632 . . . . 2.59 110.268 176.672 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.9 m -53.83 -55.03 30.31 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.395 -0.816 . . . . 2.11 110.351 177.056 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -42.84 -56.7 3.12 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 123.929 0.891 . . . . 5.76 110.3 171.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -57.01 -52.15 66.42 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.791 0.436 . . . . 4.92 110.996 -177.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 75.7 p -56.64 -32.9 65.79 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.334 0.494 . . . . 3.08 112.334 -177.341 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -81.1 -47.2 13.84 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 118.844 0.747 . . . . 3.92 111.534 171.827 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.32 -40.89 68.41 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 120.769 -1.207 . . . . 1.86 109.854 -175.352 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -17.19 64.57 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 117.234 -1.365 . . . . 5.68 113.097 -175.379 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -47.75 -60.87 2.26 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.987 1.267 . . . . 2.84 114.262 -168.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -79.54 -35.38 39.98 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 118.65 2.833 . . . . 3.28 118.65 -158.442 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -81.6 -92.94 0.52 Allowed Glycine 0 C--N 1.34 0.766 1 C-N-CA 131.448 4.356 . . . . 4.58 114.308 7.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.1 mmt-85 49.15 73.12 0.25 Allowed 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.876 -1.157 . . . . 6.47 107.876 -153.43 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -78.89 49.78 0.95 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.962 1.705 . . . . 4.53 110.949 -175.035 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -161.03 -48.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 126.73 2.012 . . . . 4.23 107.448 -168.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 29.8 m -116.35 140.21 49.58 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 124.676 1.19 . . . . 3.05 110.956 -174.853 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 6.3 mp -93.59 120.68 34.17 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.711 1.204 . . . . 3.45 109.249 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 7.1 m -83.38 171.55 13.38 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.399 -0.963 . . . . 3.41 108.399 173.475 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 7.1 p -85.37 51.5 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 120.098 -1.626 . . . . 3.73 110.507 177.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -158.53 57.25 0.45 Allowed 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 106.124 -1.806 . . . . 2.16 106.124 157.584 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -176.29 -57.6 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 102.024 -3.324 . . . . 1.58 102.024 -167.451 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -62.91 -60.73 3.07 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.914 -1.039 . . . . 3.53 110.479 171.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -58.78 -39.17 80.28 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.984 -0.376 . . . . 4.39 109.984 -176.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -54.39 -34.3 60.96 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.862 -0.59 . . . . 2.56 112.428 175.337 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 30.8 tp -67.44 -45.77 75.05 Favored 'General case' 0 C--N 1.338 0.092 0 CA-C-N 119.754 1.161 . . . . 3.29 109.045 -177.419 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 5.6 m -68.67 -45.49 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 N-CA-C 110.009 -0.367 . . . . 2.19 110.009 -177.391 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 97.7 m -55.56 -51.15 68.03 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.431 0.692 . . . . 1.75 111.111 174.682 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -80.04 -57.49 3.61 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.094 0.558 . . . . 2.13 111.641 -168.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 34.9 tp60 -80.23 -54.21 5.95 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 112.817 0.673 . . . . 4.82 112.817 -158.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . 0.269 1.0 OUTLIER -39.37 -49.57 4.81 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 116.053 1.872 . . . . 3.72 116.053 -136.425 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -84.34 -28.17 1.21 Allowed 'Trans proline' 0 N--CA 1.448 -1.19 0 CA-C-N 120.672 1.276 . . . . 3.23 108.871 -36.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -100.82 -37.4 8.71 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 125.291 1.437 . . . . 3.53 110.047 -171.335 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 43.9 tp -35.31 -58.95 0.55 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.99 1.716 . . . . 2.19 115.235 -171.762 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.89 -175.24 3.12 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.408 -0.96 . . . . 3.92 108.408 168.396 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.42 ' NZ ' ' OE1' ' B' ' 86' ' ' GLU . 0.0 OUTLIER -150.57 169.88 20.47 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 124.97 1.308 . . . . 6.38 108.04 -163.39 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 11.7 t0 58.9 67.1 0.96 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 123.443 1.592 . . . . 4.24 109.11 -171.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 16.1 m -83.54 -12.1 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 112.213 -2.267 . . . . 2.67 109.897 164.681 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -64.96 -61.86 5.46 Favored Glycine 0 C--N 1.34 0.803 0 N-CA-C 108.884 -1.686 . . . . 2.76 108.884 176.083 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 35.5 t -78.3 57.28 1.86 Allowed 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.943 -1.132 . . . . 3.29 107.943 173.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.8 tm? -60.93 -44.29 97.43 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 119.67 -1.894 . . . . 2.16 108.116 173.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -65.03 -24.02 67.37 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.256 1.022 . . . . 4.32 112.25 -166.637 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -50.95 -60.12 3.42 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.647 1.179 . . . . 2.35 109.585 161.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.47 -51.59 68.82 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.106 -1.072 . . . . 4.88 108.106 177.631 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.42 -60.47 1.93 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.303 0.956 . . . . 2.38 110.618 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -61.66 -36.38 80.65 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 122.377 -0.202 . . . . 4.06 110.935 -175.328 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 18.5 m -66.24 -32.48 73.92 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.4 0.518 . . . . 2.87 112.4 175.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 22.0 mt -80.65 -43.8 19.86 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.789 1.236 . . . . 2.67 111.158 -177.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -66.45 -7.15 17.63 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 129.905 3.282 . . . . 1.59 116.787 -166.52 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 17.1 m -36.95 -19.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 128.629 2.771 . . . . 2.49 117.844 -160.459 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -69.12 -1.3 7.4 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 120.689 1.586 . . . . 5.04 112.043 170.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 82.43 -29.56 0.1 Allowed 'General case' 0 C--N 1.342 0.241 0 C-N-CA 127.613 2.365 . . . . 5.51 113.284 161.385 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -50.8 109.16 0.29 Allowed 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.421 -0.955 . . . . 3.31 108.421 160.489 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 41.0 p -66.85 66.93 0.06 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.31 1.844 . . . . 3.13 111.469 -179.386 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -167.03 120.28 0.98 Allowed 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 128.472 2.709 . . . . 3.0 104.828 -167.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -87.55 97.9 11.1 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 107.514 -1.291 . . . . 2.02 107.514 -175.381 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 4.0 tttt -80.25 167.74 19.92 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 122.949 0.5 . . . . 4.89 109.691 -165.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -83.15 54.6 2.83 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.536 -0.727 . . . . 6.03 110.065 175.535 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -167.37 50.73 0.06 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.879 1.271 . . . . 2.23 107.713 111.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -93.21 -60.69 1.73 Allowed 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.286 -2.133 . . . . 1.85 108.34 140.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 1.3 t80 -41.37 -50.45 3.79 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 126.135 1.774 . . . . 4.09 111.53 -173.621 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.595 ' CH2' ' CH2' ' A' ' 77' ' ' TRP . 25.8 t-105 -39.02 -45.99 1.3 Allowed 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 125.787 1.635 . . . . 5.95 111.78 178.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 40.9 mtt-85 -39.42 -52.4 2.08 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.374 1.07 . . . . 6.39 111.681 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 11.9 tp -52.17 -42.29 63.3 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.399 0.679 . . . . 2.17 111.384 -177.476 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 4.1 mp -62.82 -33.47 60.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 N-CA-C 107.063 -1.458 . . . . 4.16 107.063 -175.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.485 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -67.41 -44.03 85.6 Favored Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 110.151 -1.18 . . . . 1.59 110.151 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -68.38 -54.75 15.12 Favored 'General case' 0 N--CA 1.437 -1.077 0 N-CA-C 108.185 -1.043 . . . . 2.34 108.185 -176.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 4.6 pp -57.52 -38.1 74.11 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.608 1.095 . . . . 3.18 111.924 177.094 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.28 -58.57 7.39 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 118.859 0.754 . . . . 2.31 109.912 173.071 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -51.79 -39.33 58.46 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.66 1.584 . . . . 2.55 111.802 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . 0.42 ' OE1' ' NZ ' ' B' ' 51' ' ' LYS . 8.6 mm-40 -60.22 -24.15 64.62 Favored 'General case' 0 C--N 1.338 0.072 0 C-N-CA 125.063 1.345 . . . . 3.09 111.431 -176.788 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 5.0 tt -52.05 -39.45 26.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 118.897 0.771 . . . . 1.99 109.865 171.14 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 18.4 tpt180 -84.94 -54.46 4.64 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.747 1.219 . . . . 5.83 112.916 169.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -91.71 141.75 28.34 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.938 0.895 . . . . 5.71 112.397 -159.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . 0.282 16.6 pttp -80.75 -14.29 58.22 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 115.472 1.656 . . . . 7.26 115.472 -178.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 49.4 mtpt 73.93 49.77 0.12 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 127.128 2.171 . . . . 9.3 106.873 -143.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -56.2 -65.91 0.52 Allowed 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.153 1.781 . . . . 6.02 110.978 179.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 24.0 tp -126.63 137.71 53.34 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 105.649 -1.982 . . . . 8.88 105.649 168.712 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.22 140.45 58.87 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.268 1.027 . . . . 7.66 112.128 177.892 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 2.3 pt -79.0 105.3 8.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 123.074 0.55 . . . . 10.02 110.37 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.58 148.1 26.13 Favored 'General case' 0 N--CA 1.457 -0.086 0 O-C-N 121.355 -0.841 . . . . 8.11 109.494 165.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -178.16 136.14 0.17 Allowed 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 105.059 -2.2 . . . . 8.08 105.059 -177.414 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.253 1.265 0 N-CA-C 100.825 -3.768 . . . . 7.32 100.825 148.054 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.9 mtt . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 106.135 -1.802 . . . . 8.27 106.135 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.61 174.28 5.95 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 124.47 1.108 . . . . 5.45 110.091 177.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.09 99.11 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 128.957 2.903 . . . . 4.3 110.092 -178.612 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -110.1 100.36 43.41 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 125.661 1.584 . . . . 5.99 108.357 -176.142 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -71.96 154.98 58.04 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.306 2.004 . . . . 3.06 109.718 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.7 mt -118.06 176.83 5.03 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.856 1.262 . . . . 2.67 109.414 -169.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -74.09 159.03 33.19 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.107 -0.996 . . . . 2.65 110.077 178.835 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -43.4 -56.52 3.53 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.237 1.015 . . . . 3.05 112.188 -178.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.8 mt -59.16 -47.38 85.53 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.178 -0.915 . . . . 2.41 110.818 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.9 mt-10 -53.08 -50.92 63.42 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.354 1.061 . . . . 2.19 111.569 176.071 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -54.85 -53.06 60.23 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.488 0.661 . . . . 4.23 110.011 175.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 84.8 p -62.07 -44.03 97.56 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.867 -0.521 . . . . 2.29 111.69 -174.943 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 1.8 pp -65.38 -40.6 88.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 117.695 -1.145 . . . . 1.75 110.023 175.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -51.52 -55.84 16.77 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 119.779 1.172 . . . . 2.91 110.033 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.7 t -58.42 -36.82 74.19 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.469 0.544 . . . . 2.06 112.469 -171.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.3 m -77.67 -37.2 23.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 O-C-N 120.629 -1.294 . . . . 1.88 111.148 175.055 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.5 t -61.09 -43.55 96.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 124.394 1.078 . . . . 1.92 110.18 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -64.87 -49.35 70.86 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.576 0.625 . . . . 1.68 110.339 176.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 39.7 m -53.3 -44.62 68.49 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.307 0.643 . . . . 1.86 110.055 176.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -59.89 -61.97 2.22 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.037 0.935 . . . . 4.6 110.512 175.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -62.52 -41.28 98.75 Favored 'General case' 0 C--O 1.233 0.204 0 O-C-N 121.163 -0.96 . . . . 6.61 111.89 -171.053 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.1 t -65.6 -22.13 66.65 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 119.365 -0.35 . . . . 2.79 111.247 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -81.35 -43.09 19.55 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 118.415 0.552 . . . . 4.28 111.059 166.154 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.08 -28.78 62.92 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 126.304 1.842 . . . . 1.71 111.929 -166.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 33.6 ptt85 -66.38 -34.21 77.45 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.365 1.066 . . . . 4.26 112.383 177.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -41.18 -60.09 1.33 Allowed 'General case' 0 C--N 1.345 0.401 0 C-N-CA 124.604 1.162 . . . . 2.12 112.962 -163.586 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -106.05 75.75 1.12 Allowed 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 104.931 -2.248 . . . . 2.95 104.931 -178.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 60.21 164.16 0.16 Allowed Glycine 0 CA--C 1.533 1.204 0 C-N-CA 125.449 1.499 . . . . 1.87 114.478 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 28.72 100.38 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 128.104 2.562 . . . . 5.47 114.839 165.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.9 pttt -69.38 65.06 0.17 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.317 1.847 . . . . 4.05 112.741 -177.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -169.31 -45.08 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 127.571 2.348 . . . . 3.82 108.066 -175.166 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.96 110.92 19.24 Favored 'General case' 0 C--O 1.242 0.659 0 C-N-CA 127.548 2.339 . . . . 2.49 110.193 171.66 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.9 mp -91.3 124.52 35.56 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 118.776 -0.631 . . . . 3.69 109.549 172.03 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.9 t -100.05 -179.88 4.28 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 122.007 0.908 . . . . 3.11 111.109 172.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.6 m -57.59 -35.97 52.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 CA-C-N 114.958 -1.019 . . . . 4.24 112.923 -167.123 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -73.18 -50.72 21.0 Favored 'General case' 0 C--O 1.223 -0.316 0 N-CA-C 108.373 -0.973 . . . . 2.91 108.373 -177.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 62.3 mt-10 -46.09 -48.17 17.11 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.138 0.975 . . . . 1.94 110.901 172.327 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.17 -58.77 7.08 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.897 -0.592 . . . . 4.16 110.138 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 11.0 ttmm -58.0 -37.05 73.55 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 118.243 0.474 . . . . 3.24 111.577 -175.526 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -53.33 -44.98 68.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.735 0.814 . . . . 3.23 110.547 173.721 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -65.57 -50.28 65.71 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 119.441 1.019 . . . . 3.23 108.699 -172.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 31.0 m -62.66 -41.31 91.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 114.767 -1.106 . . . . 2.48 108.782 -173.478 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 96.6 m -62.19 -50.13 73.02 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.102 0.961 . . . . 3.52 111.235 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -62.77 -54.29 41.39 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.219 1.408 . . . . 4.41 111.818 -168.454 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -149.36 66.86 1.01 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 118.185 0.448 . . . . 4.74 110.336 -177.483 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.427 ' N ' ' CD ' ' A' ' 47' ' ' PRO . 2.5 tp -155.04 29.13 0.04 OUTLIER Pre-proline 0 CA--C 1.544 0.74 0 N-CA-C 114.049 1.129 . . . . 2.5 114.049 173.323 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 46' ' ' LEU . 58.8 Cg_endo -64.12 -46.14 8.69 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.943 2.429 . . . . 1.76 112.932 -166.082 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 -79.6 -45.53 18.98 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.47 -0.937 . . . . 6.53 108.47 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.49 ' CD2' ' HB2' ' A' ' 83' ' ' LEU . 3.4 tp -66.36 -44.24 83.74 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.455 -0.793 . . . . 2.08 111.996 -168.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.7 mt -129.16 75.02 1.62 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 119.191 0.905 . . . . 2.59 109.628 165.243 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.96 157.51 5.67 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.164 -0.926 . . . . 5.95 109.64 165.595 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 42.9 t0 61.21 74.05 0.46 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 123.378 1.561 . . . . 4.77 108.838 -164.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.2 m -76.97 4.38 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 CA-C-N 113.079 -1.873 . . . . 3.41 110.582 163.65 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.19 -66.89 1.69 Allowed Glycine 0 C--N 1.341 0.83 0 N-CA-C 107.924 -2.07 . . . . 2.08 107.924 179.475 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 29.2 t -76.28 63.36 1.9 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-O 123.227 1.489 . . . . 2.5 110.23 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -77.83 -31.42 51.59 Favored 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 127.978 2.511 . . . . 2.34 108.323 174.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -46.41 -51.16 15.57 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 127.102 2.161 . . . . 4.12 112.206 172.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -55.78 -53.97 50.16 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.436 -0.579 . . . . 2.92 109.436 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.4 -48.75 78.26 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 109.119 -0.697 . . . . 4.05 109.119 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 8.2 ttt -48.89 -53.73 18.33 Favored 'General case' 0 C--O 1.227 -0.099 0 C-N-CA 123.861 0.864 . . . . 2.51 109.976 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -60.19 -45.78 91.97 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 119.798 -0.144 . . . . 4.28 111.003 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 26.6 m -60.67 -41.45 95.1 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.291 0.478 . . . . 2.94 112.291 177.398 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.8 mt -71.39 -56.17 6.51 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.178 0.991 . . . . 2.9 110.77 -176.139 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -75.09 82.41 2.28 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.356 0.663 . . . . 2.42 109.83 -170.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.9 m -45.04 -39.92 2.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 124.492 1.117 . . . . 2.36 113.548 -173.862 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 23.9 p-10 -97.46 -4.32 38.34 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.93 0.715 . . . . 3.14 112.93 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 51.03 50.1 19.81 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.325 1.85 . . . . 3.87 111.243 177.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.9 p30 -82.2 -42.32 19.14 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.468 0.707 . . . . 2.28 110.291 176.901 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.4 m 99.92 16.56 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 129.652 3.181 . . . . 2.06 112.112 -170.436 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 70.8 mt-10 -116.23 108.62 16.35 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 105.145 -2.168 . . . . 2.89 105.145 161.268 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -79.04 87.42 4.83 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 102.312 -3.218 . . . . 2.13 102.312 168.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.36 145.9 50.0 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.841 -1.541 . . . . 4.14 106.841 177.511 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -37.61 -51.78 1.2 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.775 1.398 . . . . 6.82 114.775 -169.385 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -73.3 -26.5 61.09 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.519 1.054 . . . . 2.13 112.167 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -63.79 -60.36 3.39 Favored 'General case' 0 C--N 1.341 0.238 0 N-CA-C 108.338 -0.986 . . . . 2.34 108.338 164.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -50.59 -44.41 56.88 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.253 0.621 . . . . 4.46 110.604 -175.239 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.671 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 41.7 t90 -44.32 -38.22 3.78 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 125.498 1.519 . . . . 5.58 111.887 -178.375 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 13.2 mmt85 -39.72 -46.6 1.9 Allowed 'General case' 0 C--N 1.341 0.238 0 C-N-CA 124.06 0.944 . . . . 4.9 111.619 173.075 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 12.7 tp -49.58 -50.59 41.85 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.974 0.909 . . . . 1.65 111.492 178.813 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.6 mp -64.7 -24.21 35.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 107.616 -1.253 . . . . 2.9 107.616 -176.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.59 ' CA ' ' CZ2' ' B' ' 77' ' ' TRP . . . -69.79 -55.21 9.94 Favored Glycine 0 CA--C 1.49 -1.525 0 C-N-CA 125.334 1.445 . . . . 1.42 111.822 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.69 -47.19 77.21 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 107.389 -1.337 . . . . 2.39 107.389 -177.476 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.49 ' HB2' ' CD2' ' A' ' 49' ' ' LEU . 4.0 pp -74.09 -39.97 63.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 115.098 1.518 . . . . 3.24 115.098 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.99 -31.95 63.51 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 121.236 -0.915 . . . . 2.15 110.228 170.935 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -79.7 -42.41 24.74 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 124.809 1.244 . . . . 3.13 111.461 175.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -45.36 -42.15 9.71 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 126.123 1.769 . . . . 2.93 110.626 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.8 tt -46.46 -32.25 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 123.697 0.799 . . . . 2.56 112.638 178.555 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -121.93 -18.83 6.88 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.925 1.083 . . . . 5.9 113.925 177.431 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.4 tttp -77.91 69.17 4.09 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 123.177 1.465 . . . . 4.29 109.139 175.835 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.73 -34.51 0.11 Allowed 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 130.16 3.384 . . . . 12.27 117.258 -167.488 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -158.44 61.53 0.44 Allowed 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 107.234 -1.395 . . . . 9.08 107.234 175.809 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.407 ' CG ' ' H ' ' A' ' 93' ' ' LEU 0.261 7.5 p-10 7.57 -111.12 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 128.772 2.829 . . . . 9.88 116.616 172.121 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . 0.407 ' H ' ' CG ' ' A' ' 92' ' ' ASP . 9.0 tp -97.86 -45.25 6.38 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.144 2.578 . . . . 13.01 108.065 155.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 16.6 mmtt -74.34 -173.56 1.74 Allowed 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 126.159 1.783 . . . . 16.85 110.027 -171.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -120.32 160.82 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 C-N-CA 124.473 1.109 . . . . 12.69 108.11 171.219 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 9.8 ttt85 -149.46 -68.27 0.21 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 122.919 0.488 . . . . 16.65 109.86 -166.094 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.9 tttp 177.01 138.24 0.07 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 105.573 -2.01 . . . . 11.28 105.573 -168.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 63.5 pttt . . . . . 0 C--O 1.252 1.194 0 N-CA-C 105.048 -2.204 . . . . 15.29 105.048 150.584 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 117.273 -1.346 . . . . 6.54 108.449 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 86.94 167.42 0.07 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 127.32 2.248 . . . . 7.16 113.02 178.218 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.66 100.24 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 130.252 3.421 . . . . 7.32 109.431 -166.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -132.43 -78.15 0.01 OUTLIER Pre-proline 0 CA--C 1.555 1.154 0 CA-C-O 117.22 -1.372 . . . . 5.79 114.337 -159.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -74.85 156.84 43.67 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 122.869 2.379 . . . . 4.81 112.779 -171.203 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.3 mt -141.68 134.41 28.58 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.22 0.608 . . . . 3.69 110.364 -165.767 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 15.3 t -73.98 -154.35 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.543 0.737 . . . . 2.96 109.924 156.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -84.13 -62.02 1.67 Allowed 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 121.073 -1.017 . . . . 3.1 111.866 -164.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 mt -47.08 -43.8 20.58 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 120.611 1.55 . . . . 2.2 111.715 168.283 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 90.6 mt-10 -53.83 -44.58 70.36 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.541 1.136 . . . . 3.07 111.676 173.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -35.07 63.58 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.026 -1.671 . . . . 3.86 111.705 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 22.9 t -59.14 -47.19 86.19 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.717 0.807 . . . . 2.41 110.551 177.438 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.263 2.2 pp -58.05 -37.2 60.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 O-C-N 121.124 -0.985 . . . . 2.3 111.522 172.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -58.4 -55.17 38.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.663 0.665 . . . . 2.98 110.137 174.952 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . 0.251 4.0 t -54.2 -33.27 57.83 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.247 0.931 . . . . 2.12 112.617 -172.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 33.9 m -78.43 -44.35 26.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 119.008 0.822 . . . . 1.88 111.522 173.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 38.2 t -53.23 -46.74 56.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-O 119.025 -0.512 . . . . 2.18 110.491 177.423 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 15.3 t -62.38 -45.89 91.08 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.15 0.886 . . . . 2.42 111.43 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 20.4 m -54.82 -50.65 68.06 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 120.621 1.555 . . . . 2.19 109.788 174.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -55.21 -51.46 66.5 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.207 0.603 . . . . 8.67 110.513 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -64.06 -48.26 76.93 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 126.505 1.922 . . . . 4.07 111.285 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 30.4 p -57.36 -53.29 59.82 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.412 -0.588 . . . . 2.52 109.412 176.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -56.1 -39.57 72.36 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.782 0.719 . . . . 4.24 111.258 175.286 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.32 -29.23 63.77 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.266 1.026 . . . . 1.79 110.851 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -53.74 -32.0 50.51 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 118.105 -0.95 . . . . 5.69 111.494 176.696 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.16 -65.99 0.47 Allowed 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 116.033 1.864 . . . . 2.65 116.033 -143.142 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 71.7 mt-10 -91.72 -74.87 0.49 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.846 0.831 . . . . 3.7 112.319 -175.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.46 163.73 28.9 Favored Glycine 0 C--N 1.336 0.563 0 C-N-CA 126.898 2.19 . . . . 2.53 111.361 167.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 38.1 ttm180 36.25 102.93 0.0 OUTLIER 'General case' 0 C--O 1.242 0.709 0 C-N-CA 125.675 1.59 . . . . 5.05 115.155 142.386 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -72.11 34.82 0.06 Allowed 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 115.213 1.56 . . . . 4.09 115.213 -173.254 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -147.8 -50.82 0.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.458 -0.942 . . . . 4.05 108.458 -167.799 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 20.2 m -87.43 130.68 34.58 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-N 115.851 -0.613 . . . . 2.43 109.837 173.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -87.11 160.19 18.64 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.488 1.515 . . . . 3.63 109.186 172.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 7.0 m -154.71 169.51 23.75 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.787 0.835 . . . . 2.42 109.699 -167.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.55 120.36 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 101.503 -3.517 . . . . 3.71 101.503 152.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -118.1 98.45 6.32 Favored 'General case' 0 C--N 1.331 -0.198 1 C-N-CA 131.944 4.098 . . . . 2.65 107.309 9.889 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -155.03 -52.49 0.09 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 113.592 -1.64 . . . . 2.43 106.852 -175.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -59.3 -49.35 78.18 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 114.132 -1.394 . . . . 3.22 108.314 176.148 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -58.38 -36.83 74.11 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 120.259 -0.576 . . . . 3.72 110.631 -175.569 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -58.0 -38.83 76.89 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 112.512 0.56 . . . . 2.7 112.512 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 7.7 tp -66.75 -47.79 71.15 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 119.207 0.912 . . . . 3.24 108.849 -178.288 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 16.2 m -69.59 -39.01 77.82 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.814 -0.63 . . . . 1.81 109.536 -172.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 97.8 m -64.21 -60.1 3.61 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.446 0.698 . . . . 1.9 110.604 174.9 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -81.83 -57.39 3.45 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.701 0.8 . . . . 2.63 111.939 -166.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -82.47 -40.61 20.89 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.709 1.204 . . . . 3.11 112.74 -167.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 18.4 tp -81.0 -19.16 0.27 Allowed Pre-proline 0 CA--C 1.538 0.499 0 N-CA-C 116.095 1.887 . . . . 2.98 116.095 -167.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -30.67 -63.26 0.1 Allowed 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 124.82 3.68 . . . . 2.28 116.938 -126.355 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -80.7 -51.26 8.89 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.87 0.759 . . . . 3.11 112.799 -162.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 17.5 tp -18.84 -62.82 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 127.296 2.238 . . . . 1.93 116.329 -175.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 pp -117.71 145.22 44.58 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-O 121.354 0.597 . . . . 3.91 109.438 168.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.22 163.2 18.82 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.558 -0.746 . . . . 6.63 111.054 -173.637 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 61.1 t0 57.35 66.73 1.09 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 124.606 2.146 . . . . 3.73 110.236 172.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 18.3 m -71.82 8.59 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.892 0 CA-C-N 110.486 -3.052 . . . . 2.84 111.171 157.26 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -83.59 -55.37 2.87 Favored Glycine 0 C--N 1.343 0.933 0 N-CA-C 108.467 -1.853 . . . . 2.63 108.467 179.138 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 17.2 t -69.05 59.16 0.1 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.811 2.445 . . . . 3.11 109.83 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -86.16 -29.5 23.2 Favored 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 124.257 1.023 . . . . 2.05 110.348 -172.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -57.75 -46.45 84.47 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.845 0.858 . . . . 3.71 110.281 173.59 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -51.51 -60.27 3.33 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.174 0.99 . . . . 2.48 109.832 171.863 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.07 -49.05 74.87 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.846 0.458 . . . . 3.95 109.957 -176.734 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tpt -49.05 -56.84 7.77 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 126.464 1.906 . . . . 3.96 108.614 178.346 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -60.83 -39.73 90.12 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 111.624 0.231 . . . . 4.31 111.624 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.6 t -58.35 -39.05 78.49 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.83 0.452 . . . . 2.22 111.322 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 3.5 mp -74.61 -52.89 10.48 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.549 -0.719 . . . . 2.52 111.956 174.153 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -54.39 -10.9 0.44 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 116.939 2.2 . . . . 1.46 116.939 -163.962 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 28.1 m -34.27 -22.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 130.591 3.557 . . . . 2.47 118.906 -137.855 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -57.26 -24.48 55.1 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.669 1.577 . . . . 3.47 111.608 163.625 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 69.73 56.62 0.33 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.119 1.367 . . . . 4.31 110.871 168.358 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 47.2 p30 -110.6 -12.29 14.36 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.578 1.551 . . . . 1.79 111.898 177.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 14.2 m 72.96 1.08 3.9 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.41 1.884 . . . . 2.57 114.154 -174.915 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -105.14 107.15 17.98 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.351 1.46 . . . . 2.98 107.594 169.299 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -80.86 94.86 6.54 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 107.354 -1.35 . . . . 1.88 107.354 -179.364 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 7.6 ptmt -83.38 175.11 10.09 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.03 0.532 . . . . 4.08 110.248 -173.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 40.7 p90 -93.76 52.87 1.74 Allowed 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.616 -0.677 . . . . 6.02 111.996 -175.27 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -155.62 49.54 0.54 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.377 -0.971 . . . . 2.47 108.377 112.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -93.32 -62.09 1.44 Allowed 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 107.475 -1.306 . . . . 2.13 107.475 142.23 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -46.85 -48.28 21.02 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 126.431 1.893 . . . . 4.67 112.156 -172.505 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.671 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 7.5 t-105 -40.34 -40.68 1.22 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.754 1.222 . . . . 5.94 111.916 175.662 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 8.3 mtp-105 -39.54 -46.31 1.72 Allowed 'General case' 0 C--N 1.347 0.462 0 C-N-CA 124.11 0.964 . . . . 6.13 112.681 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.0 tp -54.68 -38.73 67.33 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 118.861 -0.59 . . . . 1.83 110.922 -176.47 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 68.3 mt -58.66 -38.09 69.45 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 N-CA-C 109.17 -0.678 . . . . 2.46 109.17 -177.379 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.575 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -74.2 -42.83 34.41 Favored Glycine 0 CA--C 1.488 -1.655 0 N-CA-C 110.715 -0.954 . . . . 1.65 110.715 -174.264 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -64.38 -63.27 1.18 Allowed 'General case' 0 N--CA 1.427 -1.616 0 N-CA-C 104.722 -2.325 . . . . 2.18 104.722 179.392 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 3.4 pp -52.12 -38.97 59.16 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.069 0.849 . . . . 2.87 111.948 -176.068 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.2 -60.04 3.86 Favored 'General case' 0 C--N 1.341 0.212 0 N-CA-C 112.237 0.458 . . . . 2.13 112.237 171.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.18 -35.15 66.35 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.001 0.819 . . . . 2.65 111.71 -174.112 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -48.62 -34.21 11.24 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 125.719 1.607 . . . . 2.93 110.524 -178.509 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 11.8 tt -39.94 -48.29 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 123.972 0.909 . . . . 2.14 110.839 174.077 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 49.3 ttt180 -85.72 -56.76 3.34 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.339 1.455 . . . . 5.4 111.692 168.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 18.2 mttt -86.13 58.31 4.98 Favored 'General case' 0 N--CA 1.461 0.11 0 C-N-CA 124.957 1.303 . . . . 8.21 112.859 -157.592 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -38.57 -42.69 0.79 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 127.401 2.281 . . . . 6.21 114.244 -171.766 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.67 44.66 0.85 Allowed 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.491 -0.929 . . . . 7.94 108.491 174.932 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -140.0 70.07 1.36 Allowed 'General case' 0 C--O 1.231 0.1 0 N-CA-C 109.119 -0.697 . . . . 4.34 109.119 -159.524 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -142.41 -66.3 0.39 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.929 1.085 . . . . 6.4 113.929 -167.888 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.97 170.79 0.88 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.209 1.404 . . . . 10.16 108.686 -171.945 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 20.7 tt -145.92 155.14 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 125.85 1.66 . . . . 8.0 106.621 176.093 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 5.0 tmm_? -61.93 131.98 51.49 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 109.872 -0.418 . . . . 8.92 109.872 -176.747 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 30.0 mttp -174.66 135.4 0.4 Allowed 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 128.18 2.592 . . . . 10.69 104.488 -176.946 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 9.7 tptp . . . . . 0 C--O 1.253 1.258 0 N-CA-C 103.586 -2.746 . . . . 8.1 103.586 -176.077 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.6 ptt? . . . . . 0 N--CA 1.469 0.511 0 CA-C-O 118.753 -0.641 . . . . 12.28 112.011 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -136.6 43.12 2.46 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.782 0.719 . . . . 4.43 111.808 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 75.05 78.15 0.11 Allowed 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 125.501 1.52 . . . . 5.76 109.492 168.409 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -121.74 63.92 16.03 Favored Pre-proline 0 N--CA 1.442 -0.865 0 C-N-CA 124.891 1.276 . . . . 6.03 107.625 -173.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -64.02 149.22 90.95 Favored 'Trans proline' 0 N--CA 1.451 -1.002 0 N-CA-C 107.65 -1.711 . . . . 2.71 107.65 172.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.53 -164.19 0.92 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.729 -0.841 . . . . 2.88 108.729 -172.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.3 m -64.93 140.92 58.92 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 120.914 -1.116 . . . . 4.72 109.615 177.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -39.51 -56.52 1.62 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.159 0.984 . . . . 2.86 112.322 173.748 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.1 mt -69.62 -38.75 77.36 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.257 -0.902 . . . . 2.87 112.153 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 80.6 tt0 -50.04 -49.45 51.02 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.802 1.241 . . . . 3.17 111.16 170.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -52.25 -52.11 54.48 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.583 0.753 . . . . 4.25 109.077 173.161 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.9 p -63.19 -42.37 99.33 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.241 -0.436 . . . . 2.47 111.765 -173.622 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.28 2.6 pp -71.1 -36.15 61.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 O-C-N 121.742 -0.599 . . . . 1.78 110.405 179.079 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -55.46 -56.03 24.9 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.122 0.874 . . . . 2.66 109.678 172.647 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.2 t -58.57 -28.63 65.71 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 119.712 -0.795 . . . . 2.48 112.75 -170.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.7 m -80.72 -39.56 18.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 O-C-N 121.361 -0.837 . . . . 1.79 111.556 170.976 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.8 t -54.57 -46.89 72.35 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 119.267 0.939 . . . . 1.69 110.743 175.42 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.5 t -59.25 -46.88 87.31 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.715 1.143 . . . . 1.91 111.055 176.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.6 m -59.63 -39.3 83.83 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.848 0.859 . . . . 1.87 110.839 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -56.63 -61.13 2.64 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.474 0.71 . . . . 4.93 109.635 168.608 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -62.09 -45.97 91.16 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.81 0.844 . . . . 4.05 110.801 -164.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -59.79 -33.57 71.89 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.526 -0.306 . . . . 2.98 110.935 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -76.98 -41.57 42.42 Favored 'General case' 0 C--O 1.22 -0.472 0 O-C-N 121.921 -0.487 . . . . 4.02 111.338 173.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.38 -25.76 66.13 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 125.442 1.497 . . . . 1.62 111.604 -169.351 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -71.21 -25.18 62.39 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 117.079 -1.439 . . . . 4.45 113.329 175.871 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -44.11 -53.82 6.08 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-N 119.742 1.156 . . . . 2.32 112.355 -167.367 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -124.26 170.71 10.5 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 106.422 -1.695 . . . . 2.7 106.422 176.042 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -7.87 119.15 0.01 OUTLIER Glycine 0 CA--C 1.537 1.409 0 C-N-CA 127.47 2.462 . . . . 2.15 115.972 177.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 60.4 105.33 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.397 1.479 . . . . 7.2 114.885 159.257 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -72.56 60.87 0.49 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.467 1.107 . . . . 4.73 113.471 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -147.65 -48.1 0.17 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 129.02 2.928 . . . . 4.88 105.419 167.712 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -81.77 117.15 21.84 Favored 'General case' 0 C--O 1.242 0.669 0 C-N-CA 128.141 2.576 . . . . 2.29 111.116 174.949 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.7 mp -89.27 132.48 34.88 Favored 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 122.661 0.384 . . . . 3.27 110.068 164.434 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 29.1 t -82.23 174.67 10.95 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.473 1.509 . . . . 3.22 109.313 175.644 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.6 t -55.07 -46.34 77.33 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 108.893 -0.78 . . . . 3.13 108.893 172.412 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -54.8 -62.3 1.75 Allowed 'General case' 0 C--N 1.34 0.179 0 C-N-CA 123.056 0.543 . . . . 4.05 109.897 176.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -49.78 -48.4 50.5 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 124.435 1.094 . . . . 1.96 110.857 -177.365 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -61.59 -55.89 25.87 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 116.197 -0.456 . . . . 3.91 110.567 178.421 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 40.3 tttt -60.14 -38.18 82.3 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.549 -0.72 . . . . 3.67 111.174 -174.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -54.74 -34.23 62.22 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.813 -0.613 . . . . 2.55 112.087 174.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.81 -55.64 21.51 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 119.751 1.16 . . . . 3.69 108.407 -177.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.9 m -65.94 -38.56 82.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 CA-C-N 115.042 -0.981 . . . . 2.06 109.464 -172.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.8 m -60.84 -52.49 64.84 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 123.627 0.771 . . . . 2.11 110.865 174.156 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -76.25 -51.2 12.52 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.039 0.536 . . . . 2.8 111.709 -167.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -146.02 78.25 1.52 Allowed 'General case' 0 CA--C 1.523 -0.086 0 C-N-CA 123.006 0.522 . . . . 4.2 110.1 -175.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.4 tp -153.78 48.99 0.45 Allowed Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 113.313 0.857 . . . . 2.65 113.313 159.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -68.02 139.81 48.04 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.793 2.329 . . . . 4.05 111.984 -177.696 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 76.48 -1.74 2.84 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.241 1.417 . . . . 5.08 113.681 165.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 11.1 tp -100.47 -92.25 0.29 Allowed 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 124.313 1.045 . . . . 1.8 110.565 -175.688 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 28.6 mt -65.74 -42.06 91.43 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 118.283 0.492 . . . . 3.15 110.864 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt 57.1 -168.59 0.11 Allowed 'General case' 0 C--N 1.344 0.367 0 C-N-CA 123.185 0.594 . . . . 8.0 110.869 -160.818 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.6 t0 60.39 44.11 12.56 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 124.028 1.871 . . . . 3.94 110.447 175.114 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.4 m -53.48 -24.32 8.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 112.76 -2.018 . . . . 3.27 110.796 159.031 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -62.99 -78.31 0.18 Allowed Glycine 0 CA--C 1.528 0.88 0 N-CA-C 110.64 -0.984 . . . . 1.55 110.64 171.276 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.25 32.34 0.5 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.229 1.012 . . . . 3.78 111.528 -167.208 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -50.31 -37.55 37.13 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 124.761 1.225 . . . . 2.44 110.022 -179.625 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.91 -19.74 45.23 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.25 1.82 . . . . 4.33 113.682 -177.317 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -80.18 -41.23 25.68 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 120.62 1.554 . . . . 3.8 110.351 166.234 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.66 -47.19 70.6 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 108.515 -0.92 . . . . 3.5 108.515 174.749 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -43.96 -51.83 7.4 Favored 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 124.688 1.195 . . . . 2.23 110.153 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.5 mttp -69.39 -47.47 64.11 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 110.333 -0.247 . . . . 4.66 110.333 -177.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.5 m -57.29 -31.49 65.68 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.31 0.644 . . . . 3.2 112.476 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.1 mt -75.69 -60.17 2.43 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.155 1.382 . . . . 3.08 109.409 174.939 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -76.43 75.37 3.18 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 123.685 0.794 . . . . 1.84 110.717 -174.429 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.2 m -49.55 -34.49 8.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.203 1.001 . . . . 3.35 113.059 -179.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -89.86 -32.28 16.96 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.19 0.596 . . . . 3.88 112.127 -178.454 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 56.85 44.1 23.84 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.296 1.038 . . . . 3.69 111.466 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 23.8 p30 -50.95 -42.1 59.61 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.14 0.976 . . . . 2.13 110.02 155.658 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.6 t 113.25 18.37 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.635 1 C-N-CA 131.706 4.002 . . . . 2.79 112.277 -174.325 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -134.24 126.98 30.96 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.802 1.241 . . . . 4.65 109.211 178.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -80.43 77.58 7.2 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 104.218 -2.512 . . . . 2.09 104.218 168.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.1 tppt? -49.93 153.76 1.25 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 128.124 2.569 . . . . 4.75 108.885 173.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -38.95 -59.95 0.91 Allowed 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.352 1.433 . . . . 6.86 112.836 -166.165 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.08 -40.03 96.45 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.096 0.558 . . . . 2.34 110.853 -177.022 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -64.06 -41.72 97.26 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.176 0.591 . . . . 2.38 111.278 177.467 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 31.5 t80 -68.64 -53.86 19.92 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 118.937 0.79 . . . . 3.99 109.31 176.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.508 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.7 OUTLIER -40.5 -42.19 1.59 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.317 1.047 . . . . 5.62 108.918 176.216 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 11.3 ttt180 -38.69 -52.39 1.67 Allowed 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 117.868 -1.063 . . . . 5.98 111.266 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.4 tp -43.77 -42.47 5.55 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 123.929 0.892 . . . . 1.92 111.085 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 29.5 mt -68.66 -43.61 83.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 C-N-CA 125.81 1.644 . . . . 2.32 108.066 -174.238 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -59.46 -47.76 89.32 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 110.591 -1.004 . . . . 1.43 110.591 172.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -58.42 -39.94 81.14 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 124.156 0.982 . . . . 2.52 109.898 178.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 13.7 mt -56.76 -48.62 77.44 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 120.069 1.304 . . . . 3.37 110.984 174.611 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.36 -27.71 64.45 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.222 0.609 . . . . 2.26 111.86 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.2 ttmt -75.58 -60.64 2.22 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.333 0.653 . . . . 2.97 109.744 168.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -48.67 -49.3 38.15 Favored 'General case' 0 C--N 1.334 -0.068 0 C-N-CA 125.861 1.664 . . . . 2.34 111.223 -172.791 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.9 tt -51.2 -39.78 21.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 C-N-CA 122.577 0.351 . . . . 1.92 111.625 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.43 -31.02 26.83 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.015 1.326 . . . . 5.29 109.965 -177.025 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.4 ' NZ ' ' OD1' ' A' ' 92' ' ' ASP . 43.4 tttm -107.16 32.49 4.58 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.561 1.544 . . . . 5.19 112.138 -168.714 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 58.4 mttt -67.18 -65.15 0.72 Allowed 'General case' 0 CA--C 1.533 0.323 0 O-C-N 120.888 -1.133 . . . . 8.63 112.684 -173.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -62.27 -24.82 67.49 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 118.941 0.791 . . . . 12.98 112.312 -169.406 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.4 ' OD1' ' NZ ' ' A' ' 89' ' ' LYS . 0.1 OUTLIER -56.49 -39.69 73.69 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.217 1.807 . . . . 6.45 111.671 173.802 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 21.1 tp -125.94 -55.72 1.48 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.902 0.881 . . . . 10.64 110.72 -168.798 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -69.04 162.83 26.05 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 109.192 -0.67 . . . . 15.27 109.192 175.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 19.5 tt -49.71 144.16 1.7 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.809 -0.632 . . . . 11.45 109.804 170.176 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -62.18 100.58 0.17 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.541 0.737 . . . . 14.02 109.863 -175.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -174.24 140.63 0.68 Allowed 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 126.233 1.813 . . . . 13.64 107.495 -161.917 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 3.7 ptmt . . . . . 0 C--O 1.253 1.266 0 C-N-CA 126.093 1.757 . . . . 12.49 112.517 166.767 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.338 1.5 ppp? . . . . . 0 N--CA 1.47 0.546 0 CA-C-O 116.853 -1.546 . . . . 6.85 107.044 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.42 . . 79.05 -171.25 0.05 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.429 1.013 . . . . 5.2 113.363 166.197 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 83.3 79.37 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 127.9 2.48 . . . . 6.02 114.456 171.527 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 6.2 mt-10 -150.12 158.73 36.39 Favored Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 125.641 1.576 . . . . 5.55 107.427 159.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.09 159.31 53.62 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 123.883 3.056 . . . . 3.72 111.609 -177.554 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.7 mt -132.98 -127.49 0.18 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.139 0.575 . . . . 3.15 110.762 -158.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 1.7 t -129.43 -79.9 0.56 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.857 1.263 . . . . 2.82 112.381 -174.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -159.5 -71.32 0.08 Allowed 'General case' 0 C--N 1.342 0.263 0 CA-C-N 119.38 0.991 . . . . 2.32 109.256 -176.021 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.2 mt -50.98 -49.67 59.77 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.522 -0.736 . . . . 2.24 110.106 169.026 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 22.8 mp0 -50.68 -46.17 58.57 Favored 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 124.636 1.175 . . . . 3.91 111.788 173.16 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -60.34 -41.18 93.04 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.519 -0.738 . . . . 4.44 110.398 176.485 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 31.6 p -64.96 -39.3 93.28 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.595 -0.691 . . . . 2.4 111.51 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.322 2.8 pp -69.57 -32.44 52.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 O-C-N 121.524 -0.735 . . . . 1.84 111.41 172.006 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -58.76 -57.27 13.78 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.466 -0.771 . . . . 2.79 110.339 173.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.4 t -51.52 -39.46 57.71 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.762 0.71 . . . . 1.89 111.731 -171.879 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 23.2 m -72.68 -37.02 54.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 120.995 -1.066 . . . . 1.92 111.896 176.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 42.1 t -60.57 -45.27 97.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 119.43 1.014 . . . . 1.85 110.786 173.436 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -66.22 -41.4 90.15 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.98 -1.075 . . . . 1.94 110.783 176.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 61.6 m -59.23 -46.7 87.78 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.151 0.887 . . . . 1.87 110.826 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -48.25 -61.86 1.78 Allowed 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 108.073 -1.084 . . . . 5.05 108.073 169.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -52.95 -52.81 56.71 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.203 1.001 . . . . 4.55 112.238 -172.498 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 7.1 t -61.55 -29.97 70.35 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 119.075 -0.488 . . . . 3.84 111.826 -174.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -81.69 -40.25 23.09 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 119.358 0.981 . . . . 4.2 111.538 170.381 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.16 -25.26 65.4 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 126.913 2.085 . . . . 1.91 112.653 -168.391 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 20.3 ptt180 -58.62 -28.86 66.04 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 117.675 -1.155 . . . . 5.88 112.9 172.23 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -52.01 -63.83 1.01 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 115.448 1.647 . . . . 2.58 115.448 -155.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -88.93 -76.74 0.4 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.361 0.6 . . . . 3.33 112.384 -166.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.75 165.38 27.03 Favored Glycine 0 C--N 1.337 0.635 0 C-N-CA 127.791 2.615 . . . . 2.79 110.885 158.634 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 38.94 103.07 0.0 OUTLIER 'General case' 0 C--O 1.238 0.487 0 N-CA-C 115.973 1.842 . . . . 4.57 115.973 139.121 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 18.3 pttm -54.58 -32.08 57.96 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.948 1.299 . . . . 4.85 114.033 174.642 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -79.37 -33.43 42.88 Favored 'General case' 0 CA--C 1.531 0.226 0 O-C-N 121.591 -0.693 . . . . 4.05 111.626 -173.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.0 p -100.73 130.23 46.74 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.953 -0.758 . . . . 2.01 108.953 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.26 170.72 4.39 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 122.486 1.136 . . . . 3.09 108.995 161.894 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 4.7 m -157.24 -173.5 4.46 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 106.259 -1.756 . . . . 3.77 106.259 -154.37 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.449 ' C ' ' H ' ' B' ' 37' ' ' GLU . 93.3 t -71.77 -111.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 101.397 -3.557 . . . . 4.17 101.397 -175.926 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -75.07 59.68 0.97 Allowed 'General case' 0 CA--C 1.551 0.998 0 O-C-N 119.597 -1.94 . . . . 2.39 110.074 -176.856 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . 0.449 ' H ' ' C ' ' B' ' 35' ' ' VAL . 67.4 mt-10 -115.37 -52.05 2.67 Favored 'General case' 0 N--CA 1.452 -0.347 1 C-N-CA 132.574 4.35 . . . . 2.45 107.621 144.505 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -56.31 -50.33 71.76 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.677 -1.231 . . . . 4.1 107.677 173.347 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 7.8 tttp -56.0 -39.5 71.97 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 121.02 -0.272 . . . . 3.89 110.723 178.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -56.36 -45.06 80.64 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 122.642 0.377 . . . . 2.55 110.745 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 7.2 tt -64.23 -48.83 74.31 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.381 -0.97 . . . . 3.46 108.381 -174.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 6.8 m -67.05 -42.69 88.78 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-N 115.773 -0.649 . . . . 1.73 109.899 -173.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 88.1 m -61.22 -53.33 58.28 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.929 0.892 . . . . 1.76 110.843 175.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -76.76 -61.16 2.06 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 124.036 0.935 . . . . 1.93 110.617 -167.167 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -82.64 -53.13 6.18 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.72 0.408 . . . . 2.92 110.575 -173.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 5.8 tp -83.47 -18.77 0.26 Allowed Pre-proline 0 CA--C 1.542 0.653 0 N-CA-C 121.281 3.808 . . . . 2.83 121.281 -143.163 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -46.17 -54.81 4.26 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 CA-C-N 123.108 2.146 . . . . 4.0 116.154 -145.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -79.69 55.85 2.12 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 118.971 0.805 . . . . 3.23 112.055 -175.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 33.2 tp -147.39 -87.1 0.09 Allowed 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 125.898 1.679 . . . . 2.55 107.117 170.624 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 53.1 mt -73.99 77.46 1.69 Allowed 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 107.29 -1.374 . . . . 2.75 107.29 165.17 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.455 ' HZ3' ' CB ' ' B' ' 52' ' ' ASP . 0.4 OUTLIER -50.5 151.76 2.15 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.247 -0.888 . . . . 6.37 109.583 174.77 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.455 ' CB ' ' HZ3' ' B' ' 51' ' ' LYS . 61.3 t0 66.7 73.47 0.35 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 123.665 1.697 . . . . 3.59 108.893 -179.713 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 14.3 m -78.42 6.68 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 CA-C-N 112.172 -2.285 . . . . 2.34 110.284 163.803 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -74.11 -58.9 4.15 Favored Glycine 0 C--N 1.342 0.904 0 N-CA-C 106.681 -2.568 . . . . 2.72 106.681 172.907 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 1.7 t -77.34 49.07 0.68 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.706 0.765 . . . . 3.16 110.46 172.48 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -62.32 -47.47 84.12 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 107.634 -1.247 . . . . 1.68 107.634 167.745 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -63.25 -30.72 71.81 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.844 0.857 . . . . 4.59 111.221 -165.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -52.98 -59.94 3.91 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.132 0.973 . . . . 2.41 110.113 163.82 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -58.51 -39.42 80.04 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.436 -0.792 . . . . 5.56 109.982 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -52.49 -55.77 19.74 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 119.066 0.848 . . . . 2.62 109.232 174.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 35.1 mtmt -58.1 -40.9 82.35 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.226 0.921 . . . . 4.16 111.954 176.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 18.0 t -61.35 -25.27 67.04 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.734 -0.604 . . . . 2.96 112.475 173.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 1.2 tp -81.95 -52.07 7.43 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.035 1.734 . . . . 3.71 110.625 176.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -62.16 -13.73 30.17 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 128.662 2.785 . . . . 1.67 115.211 -164.187 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 30.1 m -35.98 -27.12 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 C-N-CA 130.931 3.693 . . . . 2.46 118.456 -130.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -65.25 -11.52 42.05 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.603 1.092 . . . . 2.88 111.643 166.957 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 70.15 28.67 3.94 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.712 1.205 . . . . 5.34 112.297 165.099 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 55.4 p30 -91.54 -1.21 57.59 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.783 1.233 . . . . 2.13 112.73 177.664 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 8.1 t 69.39 1.56 3.35 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 114.524 1.305 . . . . 3.86 114.524 -176.394 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -103.64 126.77 50.99 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 119.855 1.207 . . . . 3.7 108.412 171.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -98.76 80.85 2.58 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.802 -1.184 . . . . 2.92 107.802 175.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 11.0 ptpp? -83.42 177.75 8.34 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.513 1.125 . . . . 4.7 111.772 -174.207 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -83.08 56.65 3.57 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.373 -0.829 . . . . 5.27 112.898 -173.144 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -163.19 49.07 0.15 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.375 -0.972 . . . . 2.51 108.375 109.689 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -93.78 -62.47 1.35 Allowed 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 124.885 1.274 . . . . 1.76 108.428 150.376 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -61.1 -32.32 71.99 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.174 -0.921 . . . . 5.8 112.012 -164.073 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.425 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 5.8 t90 -41.11 -44.64 2.55 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 124.49 1.119 . . . . 5.52 109.541 175.916 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 60.1 mtp85 -38.92 -41.19 0.73 Allowed 'General case' 0 C--N 1.344 0.36 0 C-N-CA 123.833 0.853 . . . . 4.82 111.509 -178.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 16.7 tp -51.53 -54.5 26.7 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.934 0.788 . . . . 2.17 112.822 176.329 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.6 mt -70.23 -30.94 45.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 120.144 1.338 . . . . 2.29 108.529 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -41.92 -51.98 4.9 Favored Glycine 0 C--N 1.344 0.999 0 C-N-CA 125.437 1.494 . . . . 1.83 110.184 165.867 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -75.58 -57.9 3.61 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 112.89 -1.655 . . . . 2.23 109.862 -176.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 10.5 mp -41.69 -59.33 1.68 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 120.62 1.555 . . . . 3.25 112.212 -176.95 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.71 -28.84 70.16 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-N 115.436 -0.802 . . . . 1.95 111.739 -174.662 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -71.24 -62.09 1.53 Allowed 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 108.12 -1.067 . . . . 2.69 108.12 172.877 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -58.27 -39.11 78.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.047 0.939 . . . . 2.73 111.87 -166.462 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 11.4 tt -47.51 -47.37 10.64 Favored 'Isoleucine or valine' 0 C--N 1.347 0.492 0 CA-C-N 119.603 1.092 . . . . 2.26 112.104 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 5.9 ttp85 -82.27 -48.4 11.26 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 122.313 1.054 . . . . 5.05 110.14 173.511 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -83.43 61.01 5.95 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.846 2.058 . . . . 7.19 109.022 -169.685 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -41.16 -41.5 1.81 Allowed 'General case' 0 C--O 1.24 0.578 0 C-N-CA 126.125 1.77 . . . . 5.97 113.275 -167.212 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 3.5 tpmp? -142.16 -47.87 0.35 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 118.148 -0.929 . . . . 7.73 111.441 162.386 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -2.34 74.87 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 130.725 3.61 . . . . 5.22 114.753 164.667 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 50.7 tp -151.79 -74.53 0.14 Allowed 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 121.069 -1.02 . . . . 6.03 108.499 -177.982 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -168.92 167.74 10.68 Favored 'General case' 0 C--N 1.339 0.145 0 C-N-CA 124.088 0.955 . . . . 7.95 108.613 177.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 44.1 pt -134.54 19.23 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 C-N-CA 123.988 0.915 . . . . 10.84 110.561 160.956 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.22 113.76 1.63 Allowed 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.494 -0.753 . . . . 9.1 110.681 -174.377 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 27.1 tptp 152.09 120.05 0.0 OUTLIER 'General case' 0 C--O 1.234 0.266 0 C-N-CA 129.02 2.928 . . . . 6.39 107.544 158.154 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt . . . . . 0 C--O 1.249 1.068 0 N-CA-C 103.045 -2.946 . . . . 10.72 103.045 151.81 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptt? . . . . . 0 N--CA 1.476 0.858 0 N-CA-C 111.913 0.338 . . . . 11.38 111.913 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -160.93 176.99 10.81 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 106.637 -1.616 . . . . 4.78 106.637 -177.274 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.03 96.65 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 128.914 2.885 . . . . 4.57 109.726 -173.087 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -75.74 128.86 82.79 Favored Pre-proline 0 CA--C 1.537 0.462 0 C-N-CA 123.844 0.858 . . . . 5.51 110.199 -173.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.69 103.4 1.7 Allowed 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.912 2.408 . . . . 3.18 110.467 -177.238 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 88.5 mt -67.65 164.82 18.4 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.228 0.537 . . . . 2.39 110.833 173.575 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.8 t -83.18 175.68 9.77 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.658 -0.867 . . . . 2.28 108.658 171.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -69.37 -48.52 60.99 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.567 0.747 . . . . 2.58 109.175 -167.562 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.5 mp -62.33 -52.46 63.56 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 119.361 -0.352 . . . . 3.56 111.226 178.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -54.42 -50.55 67.34 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.226 1.01 . . . . 2.89 110.248 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -50.99 -55.2 18.52 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.3 1.04 . . . . 3.58 110.606 172.451 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.9 m -55.24 -49.77 71.17 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.878 -0.514 . . . . 2.66 111.654 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.293 2.9 pp -62.49 -37.12 78.02 Favored 'Isoleucine or valine' 0 C--N 1.339 0.13 0 C-N-CA 119.763 -0.775 . . . . 1.8 110.332 178.074 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -60.65 -58.08 9.98 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.093 0.86 . . . . 2.63 110.431 175.499 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.9 t -52.33 -39.86 61.18 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.392 0.996 . . . . 1.99 111.583 -172.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.0 m -73.36 -42.09 57.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 O-C-N 121.107 -0.996 . . . . 2.09 111.271 175.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 28.2 t -55.39 -51.29 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 119.376 0.989 . . . . 1.65 110.853 175.312 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.6 t -60.27 -48.34 82.15 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.163 0.892 . . . . 1.93 110.448 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 90.6 m -55.29 -51.38 66.85 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-N 118.691 0.678 . . . . 1.96 110.251 178.252 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -46.88 -58.9 3.47 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 123.658 0.783 . . . . 4.15 109.447 171.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -57.09 -47.07 81.95 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.617 1.167 . . . . 3.85 111.452 -169.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.05 -41.85 65.19 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 119.101 -0.476 . . . . 3.29 111.945 178.203 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -81.41 -31.18 33.31 Favored 'General case' 0 C--O 1.221 -0.427 0 C-N-CA 123.668 0.787 . . . . 4.74 111.71 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.01 -34.91 72.42 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 120.432 -1.417 . . . . 1.83 109.762 178.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 33.7 ttp180 -69.27 -26.24 64.66 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.12 1.768 . . . . 5.51 113.589 178.214 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -41.05 -60.82 1.11 Allowed 'General case' 0 C--N 1.344 0.345 0 CA-C-N 120.49 1.495 . . . . 2.19 113.514 -168.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -110.54 169.27 8.86 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 127.009 2.124 . . . . 2.63 106.346 175.972 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -11.91 121.09 0.01 OUTLIER Glycine 0 CA--C 1.533 1.2 0 C-N-CA 127.264 2.364 . . . . 1.66 115.19 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.27 106.3 0.06 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.932 0.893 . . . . 6.59 113.072 170.118 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -68.08 55.22 0.07 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.163 1.385 . . . . 4.51 111.769 168.062 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -158.83 -61.8 0.08 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 126.572 1.949 . . . . 4.14 105.771 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.7 m -82.53 127.24 33.14 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.003 -0.999 . . . . 2.83 109.365 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 5.8 mp -93.29 132.41 37.51 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.694 0.283 . . . . 3.67 110.537 170.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.5 t -81.5 175.78 10.23 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.276 1.43 . . . . 3.58 108.429 172.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.1 t -64.73 -48.58 84.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 C-N-CA 123.1 0.56 . . . . 2.98 109.642 -175.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -59.5 -56.8 17.45 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 118.932 -0.556 . . . . 2.64 109.537 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -39.23 -52.14 1.96 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 125.098 1.359 . . . . 1.72 112.479 172.765 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -58.58 -58.2 9.59 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.476 -0.564 . . . . 4.42 109.476 175.778 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 33.9 tttm -52.98 -39.59 63.14 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 119.216 -0.421 . . . . 4.52 111.823 -175.124 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 67.9 mt-10 -47.78 -47.56 30.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 118.972 -0.537 . . . . 2.89 111.224 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.3 tp -65.95 -46.76 77.0 Favored 'General case' 0 C--N 1.337 0.063 0 CA-C-N 119.816 1.189 . . . . 3.65 109.266 -171.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.8 m -69.04 -36.29 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-O 121.494 0.664 . . . . 1.91 109.471 -173.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 57.9 m -75.35 -30.34 60.2 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.393 0.677 . . . . 2.06 110.795 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -80.53 -57.42 3.59 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.754 1.222 . . . . 2.36 110.655 -176.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.4 mp0 -97.95 -125.95 0.15 Allowed 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 109.109 -0.701 . . . . 4.11 109.109 177.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.4 mm? 28.96 64.61 0.73 Allowed Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 127.973 2.509 . . . . 3.42 115.62 175.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -75.54 -50.12 0.13 Allowed 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 121.918 1.745 . . . . 1.72 111.062 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 19.6 t-160 -107.47 -22.77 12.43 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.13 0.972 . . . . 5.22 112.181 -166.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.411 ' CD2' ' HB2' ' A' ' 83' ' ' LEU . 18.1 tp -74.73 -91.08 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.475 1.11 . . . . 2.31 109.733 -167.285 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.6 mt -82.65 68.08 8.97 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.117 -1.068 . . . . 2.23 108.117 172.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -59.74 156.1 14.62 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.155 -0.475 . . . . 6.36 110.054 170.927 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 60.1 t0 67.69 84.58 0.15 Allowed 'General case' 0 C--O 1.231 0.089 0 C-N-CA 125.879 1.672 . . . . 4.44 109.055 -155.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 25.2 m -100.09 28.72 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 114.224 -1.353 . . . . 2.97 109.244 166.819 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -104.57 -59.0 0.68 Allowed Glycine 0 C--N 1.34 0.778 0 C-N-CA 126.419 1.961 . . . . 1.6 108.74 177.221 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 t -77.28 60.81 2.04 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 123.242 1.496 . . . . 2.71 109.571 175.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -73.88 -25.01 59.81 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 124.782 1.233 . . . . 2.16 109.078 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -52.83 -53.07 53.86 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.953 1.701 . . . . 4.02 111.613 171.641 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . 0.402 ' OE1' ' NZ ' ' A' ' 59' ' ' LYS . 2.1 tt0 -54.26 -56.74 15.41 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.132 0.973 . . . . 3.39 108.903 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.402 ' NZ ' ' OE1' ' A' ' 58' ' ' GLU . 0.0 OUTLIER -53.43 -45.52 69.48 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.969 -0.56 . . . . 3.53 110.034 179.502 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -57.35 -56.06 26.68 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 123.514 0.725 . . . . 2.26 109.693 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 60.1 mttt -63.05 -33.08 74.67 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 111.665 0.246 . . . . 4.54 111.665 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -62.09 -41.96 98.73 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.132 -0.355 . . . . 2.76 110.781 173.396 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 21.5 mt -76.54 -56.4 4.65 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.214 1.406 . . . . 2.6 112.773 -174.948 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -59.34 114.42 2.65 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.04 0.936 . . . . 1.85 108.834 -175.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.2 t -73.76 -30.66 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 N-CA-C 109.169 -0.678 . . . . 4.76 109.169 -173.403 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -84.19 -40.5 18.06 Favored 'General case' 0 C--O 1.227 -0.109 0 N-CA-C 109.197 -0.668 . . . . 2.75 109.197 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 65.36 64.56 0.6 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.014 1.326 . . . . 4.04 108.032 -158.569 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -104.11 -125.11 0.21 Allowed 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 105.467 -2.049 . . . . 3.64 105.467 172.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.3 t -137.28 18.22 2.96 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.365 1.066 . . . . 3.42 110.117 170.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 40.0 mp0 -133.12 113.38 12.66 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 125.282 1.433 . . . . 5.02 107.399 -165.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -84.27 87.85 7.21 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 105.461 -2.052 . . . . 2.18 105.461 167.241 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -54.64 158.96 2.34 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 118.222 -0.894 . . . . 5.58 109.485 176.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -37.25 -53.03 1.07 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.44 1.096 . . . . 6.19 112.011 -176.707 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -70.23 -40.31 74.56 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.565 0.58 . . . . 3.75 112.565 -178.08 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -63.07 -34.76 78.28 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.873 0.469 . . . . 2.12 110.576 176.358 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 28.3 t80 -75.63 -47.04 28.18 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 119.008 -0.52 . . . . 4.79 109.832 175.999 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.526 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 2.3 t-105 -43.74 -43.94 6.31 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 108.73 -0.841 . . . . 5.59 108.73 173.515 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.0 mtp180 -39.71 -51.48 2.33 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-O 117.087 -1.435 . . . . 5.09 109.44 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.7 tp -43.6 -47.64 7.52 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 120.44 1.473 . . . . 1.82 112.198 177.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.5 mp -68.19 -44.11 84.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 125.689 1.595 . . . . 2.77 108.707 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -60.49 -36.97 92.53 Favored Glycine 0 C--N 1.332 0.314 0 CA-C-O 122.121 0.845 . . . . 1.56 113.48 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -75.99 -56.04 5.03 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 104.979 -2.23 . . . . 3.12 104.979 -175.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.411 ' HB2' ' CD2' ' A' ' 49' ' ' LEU 0.282 4.6 pp -57.14 -32.18 66.11 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 121.207 -0.933 . . . . 3.62 113.38 177.027 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.12 -25.09 68.2 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 118.065 -0.969 . . . . 2.21 112.876 175.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . 0.308 0.0 OUTLIER -84.74 -41.4 16.24 Favored 'General case' 0 C--N 1.344 0.346 0 CA-C-N 120.201 1.364 . . . . 3.56 112.507 158.968 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 16.8 mm-40 -52.94 -39.39 62.84 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 119.211 0.914 . . . . 2.54 111.336 -171.474 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.3 tp -26.87 -50.47 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.449 1.1 . . . . 2.81 111.963 166.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -115.24 -42.68 3.15 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.007 0.923 . . . . 5.51 112.981 -176.445 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 44.6 tttm -53.67 -54.38 38.68 Favored 'General case' 0 C--O 1.232 0.166 0 O-C-N 119.92 -1.737 . . . . 3.94 109.298 171.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . 0.469 ' C ' ' H3 ' ' B' ' 1' ' ' MET . 0.2 OUTLIER -75.78 -41.67 52.33 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 107.976 -1.12 . . . . 9.33 107.976 178.982 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . 0.613 0.1 OUTLIER -138.32 57.07 1.71 Allowed 'General case' 0 CA--C 1.565 1.533 1 N-CA-C 121.803 4.001 . . . . 11.29 121.803 -177.569 . . . . . . . . 4 3 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . 0.449 ' N ' ' H ' ' B' ' 2' ' ' ALA . 0.0 OUTLIER -130.03 129.24 43.43 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 129.915 3.286 . . . . 8.41 109.199 147.529 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . 0.577 0.1 OUTLIER 91.91 24.01 0.02 OUTLIER 'General case' 0 CA--C 1.573 1.829 2 C-N-CA 136.37 5.868 . . . . 11.86 126.554 169.273 . . . . . . . . 4 3 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 4.1 tttp -158.26 -71.27 0.09 Allowed 'General case' 0 N--CA 1.486 1.365 1 CA-C-N 126.385 4.175 . . . . 11.35 120.302 -178.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.3 mm -61.4 86.54 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 125.168 1.387 . . . . 9.1 111.275 -154.592 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.4 mtp85 64.68 -65.23 0.14 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.208 1.803 . . . . 14.27 108.017 -165.715 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt 152.91 62.58 0.0 OUTLIER 'General case' 0 C--O 1.233 0.221 0 C-N-CA 131.285 3.834 . . . . 11.75 105.407 151.374 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 37.8 mmtm . . . . . 0 C--O 1.251 1.144 0 C-N-CA 125.89 1.676 . . . . 12.34 107.237 -173.364 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.469 ' H3 ' ' C ' ' A' ' 90' ' ' LYS 2.36 0.0 OUTLIER . . . . . 0 CA--C 1.579 2.084 0 CA-C-O 116.725 -1.607 . . . . 9.56 113.078 . . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . 0.449 ' H ' ' N ' ' A' ' 92' ' ' ASP 2.333 . . 120.03 90.53 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.159 0 CA-C-N 124.927 3.512 . . . . 6.56 119.631 177.869 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 104.03 70.26 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.166 0 N-CA-C 120.48 3.511 . . . . 7.1 120.48 124.1 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . 0.452 21.2 tt0 91.02 -117.22 0.0 OUTLIER Pre-proline 0 CA--C 1.559 1.311 0 N-CA-C 118.915 2.932 . . . . 6.39 118.915 131.307 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -66.08 152.17 81.95 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 123.805 3.003 . . . . 4.03 114.563 -147.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -160.02 158.41 30.49 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 120.011 -0.676 . . . . 4.37 112.188 -149.42 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 5.1 t -79.85 -159.9 0.24 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.403 1.881 . . . . 2.14 113.068 -173.13 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -75.28 -66.83 0.72 Allowed 'General case' 0 C--O 1.223 -0.29 0 O-C-N 121.957 -0.465 . . . . 2.68 111.786 -172.745 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.0 mt -48.81 -41.67 33.54 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 120.852 -1.155 . . . . 1.94 110.353 175.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -44.69 -61.51 1.55 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.323 1.849 . . . . 3.52 113.71 164.676 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.66 -34.94 78.12 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 120.464 -1.397 . . . . 4.29 110.234 -177.963 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.8 m -64.16 -38.06 89.71 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.204 0.602 . . . . 3.09 111.238 178.591 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.263 2.9 pp -71.47 -36.51 60.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 O-C-N 121.477 -0.765 . . . . 2.29 111.209 167.562 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -53.11 -57.3 10.9 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 118.857 0.753 . . . . 2.65 110.043 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.1 t -47.24 -44.51 22.77 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.284 0.947 . . . . 1.91 112.699 -176.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.0 m -74.36 -36.22 41.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 O-C-N 120.832 -1.168 . . . . 2.45 110.967 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 56.3 t -61.53 -48.18 89.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 118.828 0.74 . . . . 2.12 110.739 175.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 10.1 t -59.89 -44.91 93.97 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 120.197 1.362 . . . . 2.21 110.532 176.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 56.5 m -55.7 -49.81 72.0 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.422 0.63 . . . . 2.23 110.483 175.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -49.75 -55.64 13.24 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 118.155 -0.926 . . . . 4.94 110.751 170.77 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -49.61 -57.74 6.58 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 120.125 1.329 . . . . 5.72 111.161 178.408 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 30.5 p -60.05 -45.75 91.82 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 122.311 -0.243 . . . . 3.01 110.398 -172.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -66.21 -49.38 67.47 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 121.506 0.67 . . . . 4.83 110.488 177.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.02 -30.24 64.03 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 126.011 1.724 . . . . 1.74 110.384 -177.805 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -58.5 -26.11 63.1 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 117.541 -1.218 . . . . 8.02 111.453 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -45.05 -66.19 0.43 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.87 1.804 . . . . 2.12 115.87 -156.949 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -90.21 -75.41 0.46 Allowed 'General case' 0 C--N 1.341 0.219 0 C-N-CA 119.604 -0.838 . . . . 3.48 111.694 -168.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.85 165.18 29.28 Favored Glycine 0 C--N 1.337 0.628 0 C-N-CA 126.891 2.186 . . . . 2.5 110.741 156.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 18.4 mmt85 36.33 105.5 0.0 OUTLIER 'General case' 0 C--O 1.242 0.67 0 N-CA-C 116.819 2.155 . . . . 6.38 116.819 136.773 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -66.09 46.76 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.833 2.053 . . . . 5.08 114.448 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -148.07 -55.98 0.22 Allowed 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 124.872 1.269 . . . . 4.43 108.161 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 2.6 p -81.89 117.55 22.23 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.791 1.636 . . . . 2.38 109.952 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 7.7 mp -96.22 137.59 35.07 Favored 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 108.382 -0.97 . . . . 3.31 108.382 169.382 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 34' ' ' SER . . . . . 0.444 ' C ' ' H ' ' B' ' 36' ' ' ASN . 0.8 OUTLIER -81.77 -171.5 3.38 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 128.547 2.739 . . . . 3.79 108.055 179.464 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 13.2 p -96.52 42.99 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 CA-C-O 123.454 1.597 . . . . 3.39 108.569 164.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . 0.444 ' H ' ' C ' ' B' ' 34' ' ' SER . 0.6 OUTLIER -161.09 170.55 20.22 Favored 'General case' 0 CA--C 1.544 0.747 1 C-N-CA 141.317 7.847 . . . . 3.68 101.403 169.592 . . . . . . . . 4 4 . 1 . 004 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 63.8 mt-10 58.0 -65.36 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 121.918 2.145 . . . . 2.46 110.156 -153.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -57.62 -50.59 72.64 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.709 -0.849 . . . . 3.44 108.709 177.289 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -57.32 -48.58 78.6 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.741 -0.208 . . . . 5.44 110.885 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -53.86 -38.48 64.74 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 121.917 -0.49 . . . . 3.61 111.137 174.145 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 8.8 tt -68.56 -47.04 67.85 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.955 -0.758 . . . . 3.49 108.955 -177.183 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 0.2 OUTLIER -65.24 -51.79 60.67 Favored 'Isoleucine or valine' 0 C--N 1.34 0.155 0 CA-C-N 118.379 0.536 . . . . 2.0 110.187 -179.535 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 63.3 m -53.39 -53.58 49.17 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.878 0.871 . . . . 2.18 111.252 177.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -81.64 -60.44 2.25 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.93 0.492 . . . . 2.31 112.139 -171.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -80.92 -44.19 18.64 Favored 'General case' 0 C--N 1.337 0.039 0 N-CA-C 113.808 1.04 . . . . 3.34 113.808 -159.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -39.89 -57.08 2.83 Favored Pre-proline 0 N--CA 1.467 0.418 0 CA-C-O 117.333 -1.317 . . . . 2.98 112.823 -164.196 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -87.22 -27.57 5.2 Favored 'Cis proline' 0 N--CA 1.45 -1.04 0 CA-C-N 120.48 1.207 . . . . 2.77 109.506 -25.07 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 22.2 t-160 -98.72 -44.36 6.44 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.467 1.107 . . . . 3.66 110.327 -166.824 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 13.0 tp -29.34 -57.8 0.15 Allowed 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.555 1.942 . . . . 1.94 114.652 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 72.0 mt -97.56 116.19 29.29 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 109.398 -0.593 . . . . 2.1 109.398 175.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.21 178.23 8.19 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.108 0.563 . . . . 6.09 109.617 164.414 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.326 1.0 OUTLIER 62.6 16.26 8.67 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.761 2.025 . . . . 4.31 114.075 176.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 19.3 m -54.76 -20.17 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 C-N-CA 125.812 1.645 . . . . 3.52 113.101 171.005 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.3 -44.95 21.42 Favored Glycine 0 CA--C 1.532 1.095 0 N-CA-C 110.456 -1.058 . . . . 2.77 110.456 166.04 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 18.4 m -92.17 40.34 1.04 Allowed 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.821 1.248 . . . . 3.05 110.872 174.832 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -48.36 -48.67 36.39 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 119.541 1.064 . . . . 2.19 109.809 176.391 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -45.41 -36.73 4.5 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.188 1.795 . . . . 4.83 112.819 177.663 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -64.69 -51.39 62.73 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.139 -0.976 . . . . 2.88 110.111 172.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 4.4 mmpt? -54.16 -53.61 51.04 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 107.997 -1.112 . . . . 4.1 107.997 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.03 -42.08 98.78 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.876 -0.583 . . . . 3.03 110.464 -174.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -53.84 -37.17 63.34 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.178 0.899 . . . . 4.28 112.051 171.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 9.2 m -68.86 -44.81 72.6 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 122.708 0.403 . . . . 2.77 111.703 176.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 6.5 mp -69.5 -43.61 72.77 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.23 -0.919 . . . . 2.89 111.816 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.268 16.9 t0 -62.88 -9.0 8.12 Favored 'General case' 0 C--O 1.221 -0.395 0 C-N-CA 127.874 2.469 . . . . 1.46 115.99 -166.103 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.3 m -32.26 -21.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 130.57 3.548 . . . . 2.42 120.139 -131.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -53.94 -33.82 57.89 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 121.191 1.814 . . . . 2.95 110.723 155.672 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 58.92 55.33 4.59 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.638 0.775 . . . . 5.21 109.658 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 34.2 p30 -81.66 -34.24 30.88 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.331 -0.849 . . . . 2.13 109.056 172.791 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 24.8 m 109.07 -6.23 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 129.531 3.132 . . . . 2.37 111.879 -175.413 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -111.85 98.22 7.23 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.852 1.661 . . . . 5.39 106.568 -177.193 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -76.02 91.19 3.06 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 126.674 1.99 . . . . 1.84 106.843 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 12.3 ptmt -84.25 176.37 8.79 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.873 1.269 . . . . 3.91 110.25 -177.307 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -83.73 50.24 1.76 Allowed 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.42 1.267 . . . . 5.75 114.42 -176.687 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -162.13 49.46 0.19 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.206 1.402 . . . . 2.47 107.882 125.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -95.54 -58.85 2.01 Favored 'General case' 0 N--CA 1.44 -0.963 0 O-C-N 119.498 -2.001 . . . . 1.85 108.475 131.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -46.27 -44.53 16.56 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 124.15 0.98 . . . . 4.27 112.967 -173.106 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.417 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 7.7 t90 -43.2 -46.65 6.13 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 123.636 0.585 . . . . 5.25 110.207 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -41.57 -37.7 1.18 Allowed 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.749 -0.643 . . . . 6.89 111.802 -177.776 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 11.1 tp -50.34 -55.51 15.26 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 119.186 0.903 . . . . 2.03 111.935 175.735 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.2 mt -71.29 -30.51 40.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 120.183 1.356 . . . . 2.45 108.353 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -41.77 -49.57 5.05 Favored Glycine 0 C--N 1.344 1.001 0 C-N-CA 125.687 1.613 . . . . 1.91 111.298 166.03 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -80.51 -59.54 2.65 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 112.538 -1.831 . . . . 2.42 108.676 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 8.4 mp -39.01 -56.48 1.41 Allowed 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 121.374 1.897 . . . . 3.46 113.893 -174.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.35 -30.34 69.48 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 123.146 0.578 . . . . 2.05 111.953 -177.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt -75.84 -46.58 29.66 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 123.971 0.908 . . . . 2.74 109.896 169.629 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -56.77 -40.86 76.59 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-N 120.372 1.442 . . . . 2.66 111.931 -175.577 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 5.7 tt -55.52 -32.36 30.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 CA-C-N 118.776 0.717 . . . . 1.99 111.657 174.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 50.2 tpt85 -81.86 -40.53 22.29 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.449 1.1 . . . . 4.59 112.79 175.482 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 43.4 tttp -85.31 142.57 29.25 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.182 1.393 . . . . 4.96 112.866 -157.52 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 5.6 tmtp? -84.53 -61.0 1.9 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 122.921 0.488 . . . . 5.53 110.374 170.6 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -172.68 20.38 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 126.086 1.754 . . . . 6.78 110.335 -173.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -89.11 55.31 3.27 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 121.165 -0.959 . . . . 4.37 109.509 -150.545 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 54.4 tp -111.18 -77.43 0.59 Allowed 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 124.707 1.203 . . . . 5.77 108.04 -172.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -171.82 179.46 2.75 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.985 1.314 . . . . 8.5 108.176 175.837 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 65.5 mt -92.55 -78.0 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 N-CA-C 106.843 -1.54 . . . . 11.63 106.843 168.351 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -160.07 135.34 8.09 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 107.186 -1.413 . . . . 11.84 107.186 175.878 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 18.9 tttp -179.74 136.34 0.12 Allowed 'General case' 0 C--O 1.236 0.378 0 C-N-CA 125.323 1.449 . . . . 10.06 108.207 -178.385 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 86.1 tttt . . . . . 0 C--O 1.253 1.241 0 N-CA-C 104.005 -2.591 . . . . 6.82 104.005 148.821 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.4 mtt . . . . . 0 N--CA 1.471 0.592 0 N-CA-C 104.325 -2.472 . . . . 8.22 104.325 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.16 173.78 0.78 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.223 0.919 . . . . 3.97 109.179 149.447 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 80.68 80.29 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 126.481 1.912 . . . . 4.17 110.096 -175.512 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -59.17 123.39 69.45 Favored Pre-proline 0 N--CA 1.448 -0.548 0 C-N-CA 126.152 1.781 . . . . 4.2 110.064 -179.475 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.41 101.46 1.36 Allowed 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 122.583 2.189 . . . . 3.1 109.688 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 91.4 mt -60.08 152.17 24.85 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.473 0.654 . . . . 2.51 110.82 175.744 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.4 t -69.07 151.06 46.91 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.823 0.849 . . . . 2.36 109.249 178.855 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -39.09 -59.12 1.04 Allowed 'General case' 0 CA--C 1.527 0.084 0 C-N-CA 126.291 1.836 . . . . 3.2 112.147 -172.688 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 10.3 mt -69.07 -46.05 68.79 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.435 -0.793 . . . . 2.6 111.16 -172.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -54.61 -48.55 72.06 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.996 0.919 . . . . 2.94 110.597 175.979 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -50.67 -60.8 2.66 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.984 1.314 . . . . 3.85 109.655 171.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 54.5 p -55.92 -42.95 76.86 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.606 0.362 . . . . 2.18 111.478 -173.625 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.306 2.6 pp -66.34 -41.03 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-O 117.671 -1.157 . . . . 1.83 111.346 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.72 -52.72 64.28 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 120.046 1.294 . . . . 2.52 108.818 172.591 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -43.23 -43.84 4.97 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.962 1.305 . . . . 3.08 113.72 177.839 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 35.1 m -81.43 -39.35 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.886 1.221 . . . . 1.83 112.619 173.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.3 t -57.47 -40.8 76.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 C-N-CA 123.816 0.847 . . . . 1.79 110.592 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.7 t -59.6 -50.78 72.55 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.544 0.611 . . . . 1.72 110.882 176.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.2 m -57.25 -50.89 71.45 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.376 -0.828 . . . . 2.18 110.12 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -49.1 -58.57 4.74 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.945 0.898 . . . . 4.24 109.951 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -63.15 -45.86 89.93 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 118.552 -0.737 . . . . 6.25 111.839 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.6 t -60.58 -44.7 95.92 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.506 1.048 . . . . 2.6 110.056 -176.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -61.17 -48.61 80.8 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 121.127 0.489 . . . . 3.91 111.02 172.037 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.2 -22.12 66.82 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 120.953 -1.092 . . . . 1.82 112.178 -175.67 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -79.04 -17.18 55.73 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.665 1.986 . . . . 7.46 112.378 174.239 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.4 tp60 -39.74 -55.28 1.96 Allowed 'General case' 0 C--N 1.344 0.335 0 CA-C-N 119.86 1.209 . . . . 3.46 111.255 179.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -145.64 -165.39 2.18 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 123.94 0.896 . . . . 5.34 109.471 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -18.28 113.58 0.01 OUTLIER Glycine 0 CA--C 1.527 0.806 0 C-N-CA 128.393 2.901 . . . . 2.21 114.37 -166.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? 66.05 106.9 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.48 1.112 . . . . 5.77 112.956 173.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.89 -26.11 65.63 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 113.32 0.859 . . . . 7.84 113.32 176.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -90.56 9.92 27.56 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.577 0.626 . . . . 4.64 111.99 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.6 p -151.35 160.5 43.74 Favored 'General case' 0 C--O 1.24 0.568 0 O-C-N 120.908 -1.12 . . . . 2.54 111.708 174.394 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mp -118.03 127.97 54.32 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 122.678 0.391 . . . . 4.18 110.918 -172.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.7 t -81.92 172.46 13.27 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.502 -0.925 . . . . 3.17 108.502 174.444 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 43.1 t -67.28 -48.75 77.1 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 O-C-N 121.492 -0.755 . . . . 4.02 110.36 -168.667 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -56.99 -52.03 66.87 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 109.473 -0.565 . . . . 3.13 109.473 172.252 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 7.2 tt0 -48.71 -49.58 37.3 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.349 1.46 . . . . 2.1 110.39 -176.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -59.47 -57.65 12.05 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 124.553 1.141 . . . . 4.18 109.932 172.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.434 ' HZ3' ' CG ' ' A' ' 57' ' ' ASP . 3.0 ttmp? -52.02 -44.72 64.29 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 117.948 0.34 . . . . 5.69 111.78 -174.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -48.58 -37.79 18.93 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.295 0.48 . . . . 2.74 112.295 177.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -64.65 -47.27 79.1 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 108.534 -0.913 . . . . 3.43 108.534 -176.028 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 28.7 m -71.01 -40.64 76.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 116.287 -0.415 . . . . 2.54 110.126 -175.827 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.8 m -61.5 -42.01 98.14 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.385 0.674 . . . . 2.82 110.88 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -80.63 -55.6 4.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.122 0.569 . . . . 2.79 111.478 -171.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -92.97 -122.34 0.09 Allowed 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.303 0.501 . . . . 4.54 110.421 177.461 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 6.9 mp 12.81 71.53 0.11 Allowed Pre-proline 0 CA--C 1.545 0.754 0 C-N-CA 129.927 3.291 . . . . 3.67 115.502 -174.018 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.59 -52.22 0.6 Allowed 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 123.055 2.504 . . . . 1.66 113.263 -177.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 -136.0 61.58 1.64 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.78 0.8 . . . . 3.96 110.081 -168.637 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.404 ' CD2' ' HB2' ' A' ' 83' ' ' LEU . 5.9 tp -143.94 -118.72 0.09 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.876 -1.056 . . . . 2.96 108.477 -164.459 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 68.2 mt -68.56 77.83 0.28 Allowed 'General case' 0 C--N 1.34 0.164 0 N-CA-C 108.524 -0.917 . . . . 2.9 108.524 163.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -66.65 -168.91 0.07 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.43 -0.805 . . . . 5.95 110.433 172.063 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 63.93 37.84 9.19 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 124.698 1.199 . . . . 3.55 109.46 178.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -63.02 -22.38 30.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 124.796 1.238 . . . . 3.18 111.742 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -49.82 -35.82 24.98 Favored Glycine 0 CA--C 1.532 1.117 0 N-CA-C 111.235 -0.746 . . . . 2.07 111.235 166.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.8 t -108.06 46.59 0.94 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.118 1.367 . . . . 3.09 109.55 173.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -55.39 -46.5 76.56 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.077 -1.015 . . . . 2.25 109.342 167.55 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.434 ' CG ' ' HZ3' ' A' ' 39' ' ' LYS . 2.0 m-20 -62.63 -22.82 66.71 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.355 1.062 . . . . 5.3 111.775 -169.397 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -62.34 -48.73 78.52 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 120.801 -1.187 . . . . 3.27 110.437 166.286 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.23 -37.78 81.37 Favored 'General case' 0 C--O 1.225 -0.232 0 O-C-N 121.441 -0.787 . . . . 4.08 109.406 174.266 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.0 ttp -53.33 -53.47 50.53 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 118.952 0.797 . . . . 2.91 109.876 173.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -57.21 -41.63 79.81 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 119.207 -0.425 . . . . 4.22 112.021 177.566 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.8 t -55.79 -57.47 11.89 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 118.908 0.776 . . . . 2.81 110.159 172.767 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 40.6 mt -58.97 -53.31 59.87 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.435 1.094 . . . . 2.78 110.971 -171.259 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -68.96 81.05 0.31 Allowed 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 123.66 0.6 . . . . 2.39 109.461 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.8 m -47.27 -33.34 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 C-N-CA 124.252 1.021 . . . . 2.72 111.722 172.468 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -92.83 -11.5 33.49 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.636 0.976 . . . . 2.9 113.636 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 45.41 59.02 3.79 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.587 1.555 . . . . 4.1 111.208 -176.389 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -77.73 -98.88 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 106.316 -1.735 . . . . 3.29 106.316 164.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.1 m 178.72 44.27 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 130.949 3.699 . . . . 2.41 106.003 162.091 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.66 109.34 3.45 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 105.792 -1.929 . . . . 4.01 105.792 -169.07 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -84.7 94.75 8.73 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 105.443 -2.058 . . . . 1.95 105.443 -176.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.54 151.67 45.87 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 107.858 -1.164 . . . . 3.98 107.858 175.35 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -39.13 -54.11 1.78 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.593 0.96 . . . . 7.3 113.593 -171.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -73.35 -26.95 61.24 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.553 0.575 . . . . 2.12 112.553 -176.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.32 -59.65 3.82 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 108.08 -1.082 . . . . 2.13 108.08 169.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 56.7 t80 -49.92 -49.53 49.49 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 124.044 0.937 . . . . 4.57 110.463 -177.189 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 1.3 t-105 -39.61 -42.41 1.18 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 125.266 1.426 . . . . 5.14 111.393 -178.844 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 -49.13 -38.98 26.87 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-O 117.994 -1.003 . . . . 4.55 112.102 -178.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 tp -46.43 -48.12 18.87 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 119.088 0.858 . . . . 2.19 110.763 178.485 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.6 mp -60.78 -34.44 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 108.0 -1.111 . . . . 2.88 108.0 -177.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.541 ' CA ' ' CZ2' ' B' ' 77' ' ' TRP . . . -70.4 -48.45 37.3 Favored Glycine 0 CA--C 1.491 -1.415 0 C-N-CA 124.217 0.913 . . . . 1.37 110.904 -178.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.18 -58.69 7.54 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 104.503 -2.406 . . . . 2.74 104.503 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.404 ' HB2' ' CD2' ' A' ' 49' ' ' LEU 0.26 3.8 pp -56.01 -40.95 74.15 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.703 1.372 . . . . 3.43 114.703 177.324 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.79 -23.87 66.49 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 118.793 0.724 . . . . 2.66 112.27 174.81 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -80.91 -44.69 17.9 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 125.415 1.486 . . . . 2.89 109.514 168.529 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.496 ' CD ' ' HZ2' ' A' ' 89' ' ' LYS . 36.7 mm-40 -61.84 -34.21 75.55 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 120.061 1.3 . . . . 2.24 111.419 -172.149 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.4 tt -49.04 -37.7 10.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-N 118.114 0.415 . . . . 2.51 111.955 171.849 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.66 -53.96 4.51 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.246 1.018 . . . . 6.21 109.056 176.631 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.496 ' HZ2' ' CD ' ' A' ' 86' ' ' GLU . 3.1 ttpm? -78.38 49.55 0.86 Allowed 'General case' 0 N--CA 1.437 -1.122 0 C-N-CA 125.601 1.56 . . . . 4.53 112.826 -170.002 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -81.95 -19.1 41.36 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.773 1.229 . . . . 9.36 113.876 -174.922 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.1 tptm -173.62 -41.88 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.584 1.084 . . . . 9.6 111.426 -177.589 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 67.25 8.69 6.41 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 114.103 1.149 . . . . 5.8 114.103 159.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 43.5 tp -110.12 -76.21 0.61 Allowed 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 107.173 -1.417 . . . . 10.33 107.173 -178.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -83.05 67.13 8.99 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.372 -0.83 . . . . 13.81 112.105 -172.782 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 2.239 1.2 pp 57.21 -97.08 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 N-CA-C 115.279 1.585 . . . . 14.24 115.279 147.489 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 94.3 mtt-85 57.52 -93.67 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 128.305 2.642 . . . . 12.36 111.244 -164.909 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -177.53 139.64 0.25 Allowed 'General case' 0 C--O 1.237 0.413 0 N-CA-C 106.184 -1.784 . . . . 14.97 106.184 -159.107 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.256 1.435 0 N-CA-C 101.288 -3.597 . . . . 14.58 101.288 128.509 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 109.989 -0.374 . . . . 7.19 109.989 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -176.67 -176.79 0.75 Allowed 'General case' 0 C--O 1.234 0.28 0 C-N-CA 126.235 1.814 . . . . 5.26 107.702 -175.677 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 76.9 104.91 0.07 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 115.659 1.726 . . . . 4.63 115.659 143.62 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -153.0 159.32 32.38 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.562 1.545 . . . . 7.91 107.618 161.794 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.85 153.02 22.44 Favored 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 124.397 3.398 . . . . 3.76 109.886 173.161 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 44.1 mt -139.37 172.2 13.17 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.772 0.656 . . . . 3.28 112.772 -153.457 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 10.2 t -89.36 -132.04 0.09 Allowed 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.04 1.336 . . . . 2.56 110.513 171.238 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -92.44 -59.06 2.17 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.111 1.365 . . . . 2.11 114.03 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.5 mt -62.93 -50.33 71.24 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 120.846 -1.159 . . . . 2.04 111.482 -173.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -88.02 115.22 25.34 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 100.433 -3.914 . . . . 4.82 100.433 138.399 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -54.67 -50.98 66.93 Favored 'General case' 0 C--N 1.342 0.271 1 C-N-CA 133.753 4.821 . . . . 3.68 118.752 19.719 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 52.7 p -51.74 -40.05 59.55 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.474 0.916 . . . . 2.27 113.474 -155.349 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 pp -57.34 -42.68 80.85 Favored 'Isoleucine or valine' 0 C--N 1.339 0.134 0 N-CA-C 112.837 0.68 . . . . 2.12 112.837 174.103 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -60.2 -50.04 75.22 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.867 -1.16 . . . . 2.42 107.867 173.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -50.05 -38.69 39.2 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.526 0.73 . . . . 3.53 112.882 -178.529 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 35.8 m -80.36 -40.54 19.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 O-C-N 121.124 -0.985 . . . . 2.04 111.924 171.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 18.0 t -55.22 -43.99 73.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 123.645 0.778 . . . . 2.18 111.308 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 10.2 t -57.26 -49.05 77.27 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.233 0.924 . . . . 2.14 110.428 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 34.6 m -57.61 -52.68 64.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.753 -0.462 . . . . 2.5 109.753 176.958 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -46.47 -51.82 14.44 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.407 1.083 . . . . 5.72 111.395 174.131 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -66.18 -53.87 32.11 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.088 0.47 . . . . 5.11 109.8 -173.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 1.3 t -64.55 -32.66 74.4 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 122.092 -0.38 . . . . 3.92 110.363 -176.159 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -61.35 -59.03 5.91 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.591 1.157 . . . . 7.02 110.238 170.33 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.48 -22.94 35.8 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 126.638 1.975 . . . . 1.78 112.033 -178.626 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -18.01 22.58 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 117.678 -1.153 . . . . 5.61 113.456 171.849 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -45.99 -62.37 1.35 Allowed 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.237 1.569 . . . . 3.66 115.237 -172.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -73.11 -42.5 62.89 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 116.174 1.916 . . . . 5.24 116.174 -152.425 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -80.35 -88.29 0.55 Allowed Glycine 0 CA--C 1.528 0.874 0 C-N-CA 130.015 3.674 . . . . 4.21 115.1 18.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 43.49 72.88 0.16 Allowed 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.864 -0.786 . . . . 5.7 109.092 -163.272 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 61.23 2.31 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.951 1.3 . . . . 6.03 111.064 -174.164 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -168.66 -59.7 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 127.286 2.234 . . . . 4.39 106.658 171.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 4.1 p -83.86 149.41 26.39 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.72 -0.673 . . . . 2.06 111.164 -174.05 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -107.12 128.64 54.57 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 107.951 -1.129 . . . . 3.31 107.951 174.573 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 52.8 m -114.11 174.65 5.84 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 119.335 0.97 . . . . 3.33 108.851 166.322 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 12.7 p -84.88 56.1 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.167 0 O-C-N 120.826 -1.171 . . . . 3.54 111.45 -174.977 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -152.9 55.89 0.78 Allowed 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 123.683 1.706 . . . . 2.17 108.24 130.515 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -141.49 -57.51 0.48 Allowed 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 130.408 3.483 . . . . 1.94 101.976 164.142 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -40.76 -52.82 2.93 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.206 1.003 . . . . 3.99 112.616 -177.232 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -68.19 -28.04 66.93 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.373 0.509 . . . . 3.71 112.373 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -66.91 -35.53 80.22 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 121.376 -0.827 . . . . 3.45 110.886 -178.242 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.52 -49.13 70.11 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.324 -0.86 . . . . 3.6 109.181 -176.338 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -62.56 -44.07 99.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 114.957 -1.019 . . . . 1.99 109.217 -176.218 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 99.4 m -57.31 -55.65 32.04 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.583 0.753 . . . . 1.9 111.257 172.555 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -80.9 -62.61 1.62 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.349 0.66 . . . . 2.75 112.443 -162.211 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 -82.41 -39.87 22.06 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 121.805 -0.559 . . . . 3.54 111.985 -173.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.62 -12.77 0.19 Allowed Pre-proline 0 CA--C 1.544 0.746 1 N-CA-C 121.954 4.057 . . . . 2.98 121.954 -153.919 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -49.89 -41.46 47.39 Favored 'Trans proline' 0 CA--C 1.535 0.569 0 C-N-CA 122.726 2.284 . . . . 2.62 116.676 -147.644 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 61.5 t-80 -86.77 50.03 1.93 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 120.795 1.634 . . . . 3.94 109.415 -174.654 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 10.3 tp -151.18 -82.52 0.1 Allowed 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.076 0.55 . . . . 1.97 110.444 -175.877 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 69.9 mt -80.64 70.95 7.48 Favored 'General case' 0 CA--C 1.522 -0.117 0 N-CA-C 108.501 -0.926 . . . . 2.15 108.501 171.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.05 137.53 10.27 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.513 -0.921 . . . . 6.96 108.513 155.27 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 16.2 t0 70.71 79.07 0.18 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 126.021 1.728 . . . . 3.35 109.869 -156.641 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 18.1 m -90.47 6.87 4.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 114.085 -1.416 . . . . 2.25 110.209 160.052 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -89.16 -65.13 1.27 Allowed Glycine 0 C--N 1.341 0.854 0 N-CA-C 108.123 -1.991 . . . . 2.63 108.123 -171.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 13.0 t -78.17 50.04 0.87 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.104 0.961 . . . . 3.13 108.493 172.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.68 -41.47 99.12 Favored 'General case' 0 N--CA 1.445 -0.681 0 O-C-N 120.469 -1.394 . . . . 2.28 108.214 171.323 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -32.33 71.39 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.689 1.596 . . . . 4.35 110.338 -170.734 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -56.8 -55.73 30.63 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.646 1.179 . . . . 2.43 110.615 167.21 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.17 -48.52 73.66 Favored 'General case' 0 C--N 1.343 0.295 0 N-CA-C 108.184 -1.043 . . . . 4.72 108.184 177.682 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -48.88 -51.01 32.17 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 123.576 0.75 . . . . 2.64 110.411 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -49.28 -46.76 46.8 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.379 0.671 . . . . 4.23 111.494 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 10.0 t -71.16 -39.22 72.03 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.95 0.5 . . . . 3.19 111.417 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 41.0 mt -68.63 -46.66 68.62 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.583 1.153 . . . . 2.63 110.826 -174.897 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -61.46 -10.31 7.39 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.694 2.398 . . . . 1.64 115.989 -173.985 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 1.1 p -33.49 -18.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.529 1 C-N-CA 132.607 4.363 . . . . 4.0 119.956 -141.095 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.33 -38.3 41.14 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 120.053 1.297 . . . . 4.09 109.476 156.377 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 70.94 67.68 0.17 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 126.626 1.97 . . . . 3.91 109.303 -177.888 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 16.5 p30 -126.97 -13.66 5.7 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.463 1.905 . . . . 1.97 113.525 -174.055 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 4.5 m 88.53 -10.0 0.48 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 127.203 2.201 . . . . 2.85 114.061 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -111.57 115.04 28.51 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 119.346 0.975 . . . . 3.32 108.922 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.73 97.53 9.18 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 106.016 -1.846 . . . . 2.37 106.016 173.241 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -82.95 178.28 8.23 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.71 0.686 . . . . 5.17 110.67 -178.184 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 42.3 p90 -82.8 52.56 2.16 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 114.066 1.136 . . . . 6.84 114.066 -166.9 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -162.69 47.35 0.15 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.465 -1.309 . . . . 2.78 107.465 126.578 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -96.18 -63.79 1.11 Allowed 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 120.046 -1.658 . . . . 2.07 109.057 153.681 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -50.12 -43.63 51.89 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 125.992 1.717 . . . . 4.25 110.543 -175.759 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 7.7 t-105 -41.78 -43.55 2.97 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.943 0.897 . . . . 5.7 111.637 176.24 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 21.6 mtt180 -45.53 -44.57 12.76 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.615 0.643 . . . . 5.15 111.382 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.0 tp -53.72 -39.47 65.27 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.337 0.655 . . . . 2.13 111.39 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 62.5 mt -65.28 -32.73 59.52 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 N-CA-C 106.688 -1.597 . . . . 2.41 106.688 -177.758 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.559 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -69.22 -44.95 63.47 Favored Glycine 0 CA--C 1.496 -1.152 0 N-CA-C 110.297 -1.121 . . . . 1.68 110.297 -178.747 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . 0.442 ' OE2' ' NZ ' ' B' ' 85' ' ' LYS . 3.2 mm-40 -66.17 -62.27 1.58 Allowed 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 106.867 -1.531 . . . . 2.18 106.867 -179.382 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 3.7 pp -54.42 -37.06 64.66 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.466 1.03 . . . . 2.96 112.452 -178.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.69 -61.44 2.62 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.549 0.613 . . . . 2.35 109.869 173.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . 0.442 ' NZ ' ' OE2' ' B' ' 82' ' ' GLU . 2.1 ptpp? -66.73 -23.76 66.14 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 118.037 -0.982 . . . . 2.54 111.789 -173.457 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -53.11 -25.67 13.88 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.993 1.717 . . . . 3.08 111.656 173.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 3.8 tt -59.57 -36.27 64.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 CA-C-N 118.709 0.686 . . . . 1.92 110.447 172.753 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 -82.91 -48.23 10.93 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.801 1.641 . . . . 5.0 112.011 169.527 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 43.5 tttm -86.09 126.45 34.2 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.934 1.694 . . . . 7.33 112.043 -159.341 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 40.8 pttt -82.85 -55.78 4.21 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.299 1.44 . . . . 7.31 110.26 169.033 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 6.1 mmtp -163.71 18.34 0.07 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.392 1.877 . . . . 6.86 110.529 -169.009 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.74 54.58 3.18 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 126.921 2.088 . . . . 4.42 108.468 -163.974 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . 0.409 ' CG ' ' H ' ' B' ' 94' ' ' LYS . 0.4 OUTLIER -99.86 -94.78 0.26 Allowed 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.613 1.165 . . . . 6.17 108.653 175.377 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . 0.409 ' H ' ' CG ' ' B' ' 93' ' ' LEU . 72.1 mmtt 41.78 61.42 1.89 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.62 1.568 . . . . 8.08 113.558 176.474 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 24.7 pt -132.0 155.56 41.69 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 124.306 1.043 . . . . 9.0 108.654 171.764 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -170.63 150.27 3.33 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 125.676 1.59 . . . . 9.09 107.676 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -176.86 137.57 0.25 Allowed 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 106.069 -1.826 . . . . 8.81 106.069 -172.895 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.251 1.142 0 N-CA-C 108.15 -1.056 . . . . 7.11 108.15 177.488 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.7 mtt . . . . . 0 N--CA 1.47 0.541 0 CA-C-O 119.464 -0.303 . . . . 10.11 111.301 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -178.69 158.62 1.03 Allowed 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 125.831 1.652 . . . . 4.79 107.581 -174.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 56.66 58.63 4.01 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.119 0.968 . . . . 5.62 110.752 -176.353 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -149.71 54.75 1.66 Allowed Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 125.615 1.566 . . . . 7.94 109.955 -172.872 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -82.5 -13.93 9.47 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.964 2.443 . . . . 9.37 113.291 -173.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 58.5 mt -72.23 134.8 45.82 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.38 0.672 . . . . 3.4 110.737 -162.255 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.6 t -63.52 -61.65 2.19 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.916 0.886 . . . . 3.62 112.062 -170.317 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -177.97 -75.32 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 126.253 1.821 . . . . 3.31 106.475 -175.438 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.06 -42.93 40.26 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.471 0.708 . . . . 2.21 111.154 171.88 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -49.64 -44.0 47.26 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.586 1.154 . . . . 2.24 112.497 174.018 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -54.59 -49.55 70.14 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.982 0.81 . . . . 3.81 109.229 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.3 t -63.78 -54.2 38.94 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.762 -0.654 . . . . 3.05 109.812 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.352 2.8 pp -62.81 -34.6 66.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 C-N-CA 118.503 -1.279 . . . . 2.0 112.562 -178.042 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -61.06 -56.64 18.66 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 119.352 0.978 . . . . 2.86 108.95 173.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.88 -39.31 65.6 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.878 0.847 . . . . 2.35 111.556 -171.798 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.8 m -75.23 -37.43 39.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 120.798 -1.189 . . . . 2.14 111.815 175.644 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 28.3 t -58.66 -48.68 85.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 119.808 1.186 . . . . 2.01 110.803 174.225 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -59.52 -38.32 80.67 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.853 -1.154 . . . . 2.06 110.347 175.351 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.0 m -56.14 -49.82 72.85 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 118.669 0.668 . . . . 2.0 110.115 171.482 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -50.99 -52.7 40.11 Favored 'General case' 0 C--N 1.342 0.276 0 CA-C-N 118.613 0.642 . . . . 6.64 109.805 176.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -55.94 -58.21 8.83 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.199 0.444 . . . . 4.96 112.199 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -65.07 -24.31 67.42 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 121.152 0.501 . . . . 3.07 111.397 -175.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.493 ' CZ ' ' HB2' ' A' ' 41' ' ' LEU . 8.1 t80 -80.55 -51.77 8.38 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 124.271 1.028 . . . . 6.12 112.711 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.7 -22.89 65.73 Favored 'General case' 0 C--O 1.24 0.59 0 C-N-CA 126.352 1.861 . . . . 2.18 113.065 -166.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -69.12 -19.8 64.04 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.215 1.406 . . . . 5.2 112.385 175.575 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -41.9 -62.19 0.96 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.396 0.998 . . . . 3.28 113.041 -172.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -127.37 106.8 9.45 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 126.495 1.918 . . . . 3.86 105.93 -175.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 62.56 118.11 0.01 OUTLIER Glycine 0 CA--C 1.534 1.269 0 CA-C-N 118.822 0.737 . . . . 2.64 113.763 169.654 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.0 ttm180 63.41 102.85 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 121.794 0.806 . . . . 5.71 113.006 162.63 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt -73.06 59.96 0.54 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.219 1.007 . . . . 6.89 112.845 -177.256 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -156.19 -62.76 0.11 Allowed 'General case' 0 C--O 1.231 0.091 0 C-N-CA 128.023 2.529 . . . . 3.69 106.404 177.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.0 p -84.13 135.55 34.34 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 123.666 0.786 . . . . 2.55 110.993 -174.071 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.429 HD13 ' CZ ' ' A' ' 23' ' ' PHE . 3.2 mm? -88.93 143.6 26.76 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.418 -0.956 . . . . 3.38 108.418 168.109 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.9 m -111.9 175.86 5.26 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.349 0.659 . . . . 2.67 109.952 168.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.9 p -57.05 -50.22 77.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 N-CA-C 114.008 1.114 . . . . 4.01 114.008 -164.327 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -64.94 -50.41 66.54 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 118.697 0.68 . . . . 3.19 109.184 -177.089 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -37.02 -57.85 0.81 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.149 1.38 . . . . 2.28 110.097 166.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.49 -55.6 23.99 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 121.917 -0.489 . . . . 4.56 110.75 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -55.84 -41.94 75.05 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 120.658 -0.417 . . . . 5.08 111.505 -177.414 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -49.94 -44.09 50.34 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 118.159 0.436 . . . . 2.9 111.022 177.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . 0.493 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 9.6 tp -66.47 -47.58 72.63 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.831 0.741 . . . . 3.75 109.323 -173.195 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 23.3 m -74.12 -29.13 24.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-N 115.041 -0.981 . . . . 2.25 109.951 -171.58 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 84.8 m -78.05 -47.04 19.27 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.712 0.805 . . . . 3.45 110.263 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -81.39 -59.95 2.44 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.373 1.069 . . . . 2.79 111.93 -171.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.3 mp0 -76.8 -51.8 10.69 Favored 'General case' 0 C--N 1.338 0.083 0 O-C-N 122.101 -0.375 . . . . 5.69 110.206 -169.985 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 mp -81.69 114.44 50.04 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 124.846 1.258 . . . . 2.81 110.033 -171.623 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -84.79 -58.96 0.02 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 122.965 2.444 . . . . 2.46 110.304 -174.34 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -141.26 9.03 2.06 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.068 0.947 . . . . 5.93 113.442 -168.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.4 tp -55.68 -78.88 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 122.073 0.939 . . . . 2.43 109.348 171.148 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.6 mt -79.4 -55.88 4.74 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.539 -0.912 . . . . 3.69 108.539 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 39.79 38.14 0.41 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.467 1.907 . . . . 6.45 112.331 -168.507 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.481 ' CG ' ' HZ1' ' A' ' 59' ' ' LYS . 62.2 t0 -108.37 12.51 26.28 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 130.137 3.375 . . . . 6.15 108.616 -175.769 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 18.8 m -66.25 -22.43 30.2 Favored 'Isoleucine or valine' 0 C--N 1.341 0.207 0 C-N-CA 124.738 1.215 . . . . 3.52 112.172 -171.781 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.6 -32.55 46.63 Favored Glycine 0 CA--C 1.529 0.967 0 N-CA-C 111.009 -0.836 . . . . 3.33 111.009 169.658 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 18.7 m -124.22 60.42 1.14 Allowed 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.186 0.994 . . . . 3.5 108.928 178.591 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -74.37 -38.65 63.12 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.792 1.237 . . . . 2.2 110.172 176.096 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -54.51 -50.84 66.88 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.406 0.682 . . . . 4.37 111.415 -173.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -57.21 -41.44 79.42 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 121.897 -0.502 . . . . 3.06 111.713 177.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.481 ' HZ1' ' CG ' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -58.04 -59.33 5.44 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.36 -0.978 . . . . 3.32 108.36 173.122 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -46.84 -51.48 16.5 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.202 0.601 . . . . 2.64 111.001 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -56.99 -47.6 80.42 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.665 0.786 . . . . 4.21 110.72 177.6 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 45.6 m -59.62 -39.67 85.06 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 122.195 -0.316 . . . . 2.53 111.419 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -69.81 -49.43 52.83 Favored 'General case' 0 CA--C 1.53 0.18 0 O-C-N 121.933 -0.479 . . . . 3.12 110.812 176.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -76.85 62.28 2.04 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.661 0.784 . . . . 1.82 110.043 -176.718 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.6 m -56.78 -31.32 35.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 124.698 1.199 . . . . 2.8 112.194 -176.101 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -88.8 -3.0 58.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.558 1.543 . . . . 3.17 112.057 178.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 54.87 63.35 2.16 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 125.6 1.56 . . . . 4.21 111.982 165.042 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.3 p30 -130.41 -1.77 4.42 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.784 1.234 . . . . 2.2 112.894 -173.979 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.2 p 64.3 12.67 7.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.231 1.812 . . . . 3.22 114.062 -175.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -113.37 106.47 14.63 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.614 1.565 . . . . 3.27 108.377 169.043 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.14 81.78 7.25 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 103.414 -2.81 . . . . 1.97 103.414 167.201 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.3 ttmt -67.37 161.15 25.81 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.638 0.775 . . . . 5.16 108.985 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -38.65 -53.57 1.61 Allowed 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.309 1.226 . . . . 7.1 114.309 -169.941 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -65.06 -40.22 94.4 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 121.53 -0.731 . . . . 2.89 112.637 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -63.8 -52.73 58.92 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.805 -1.183 . . . . 1.99 107.805 178.631 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -52.13 -45.59 65.03 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.55 0.74 . . . . 4.43 110.704 176.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.454 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.4 OUTLIER -40.29 -45.1 2.04 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-O 117.364 -1.303 . . . . 6.37 110.382 173.59 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -39.36 -46.34 1.59 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 120.753 1.615 . . . . 6.33 111.776 -178.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.2 tp -56.25 -45.14 80.17 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.016 0.826 . . . . 2.0 112.989 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.1 mt -69.44 -40.78 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 C-N-CA 125.155 1.382 . . . . 3.25 108.18 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -44.45 -57.99 4.82 Favored Glycine 0 N--CA 1.436 -1.337 0 N-CA-C 109.529 -1.428 . . . . 2.18 109.529 172.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -66.57 -50.97 61.37 Favored 'General case' 0 N--CA 1.435 -1.213 0 CA-C-N 112.134 -2.033 . . . . 2.8 107.751 -174.308 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.1 tp -37.26 -53.88 1.06 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.297 1.839 . . . . 4.38 111.747 -178.807 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.02 -34.02 65.46 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.976 0.911 . . . . 2.61 112.802 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -81.84 -48.18 11.9 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.119 0.968 . . . . 3.26 111.637 170.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.25 -26.52 66.5 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 123.743 0.817 . . . . 4.08 112.909 -170.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.6 tp -36.79 -47.27 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 123.5 0.72 . . . . 2.26 111.046 165.44 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.52 -51.54 6.81 Favored 'General case' 0 C--N 1.345 0.382 0 O-C-N 121.472 -0.767 . . . . 6.05 109.979 170.203 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -87.48 101.66 13.82 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.148 1.379 . . . . 4.32 112.177 -170.341 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.2 mptp? -80.38 -60.7 2.22 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 120.441 -1.412 . . . . 8.18 109.786 -176.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -176.19 90.6 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 103.679 -2.711 . . . . 11.05 103.679 169.363 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -66.74 80.03 0.11 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.024 0.93 . . . . 6.13 113.001 -147.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.3 tp 174.97 -54.44 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 128.466 2.706 . . . . 9.91 105.184 -170.044 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -68.62 142.53 55.09 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.275 -1.009 . . . . 12.89 108.275 170.001 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 2.28 1.3 mt 137.05 36.61 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 123.717 0.807 . . . . 11.12 111.968 175.613 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 70.8 mtp180 -115.56 -13.93 11.52 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 115.758 1.762 . . . . 15.18 115.758 -144.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -175.35 -42.31 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.456 1.102 . . . . 17.26 108.774 -171.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 87.8 tttt . . . . . 0 C--O 1.257 1.496 0 N-CA-C 102.551 -3.129 . . . . 17.94 102.551 127.862 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 81.4 mtp . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 119.693 -0.194 . . . . 8.66 111.365 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.337 . . -79.81 -136.11 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.21 1.804 . . . . 7.13 114.555 -171.246 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 86.04 100.94 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 127.927 2.491 . . . . 7.82 109.253 -171.306 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -130.54 -81.7 0.0 OUTLIER Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 125.684 1.594 . . . . 6.1 111.308 -163.805 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -72.09 147.36 48.47 Favored 'Trans proline' 0 C--N 1.352 0.757 0 CA-C-N 122.591 1.961 . . . . 3.74 108.92 176.003 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -148.89 149.99 32.21 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 118.695 0.68 . . . . 5.03 109.723 -158.071 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 10.7 t -75.33 -166.24 0.5 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.03 0.932 . . . . 2.5 111.907 -172.391 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -73.82 -60.17 2.38 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.049 -0.407 . . . . 2.82 111.091 -171.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mt -47.59 -45.75 27.59 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.169 -0.957 . . . . 2.14 110.363 172.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 2.0 tt0 -48.71 -58.78 4.23 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 126.043 1.737 . . . . 3.22 112.981 170.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.22 -36.9 83.38 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 120.863 -1.148 . . . . 5.11 109.204 -176.917 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 15.8 m -63.17 -37.07 85.77 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.925 0.49 . . . . 3.04 111.329 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.335 2.9 pp -70.51 -38.99 75.62 Favored 'Isoleucine or valine' 0 C--N 1.343 0.292 0 CA-C-N 118.691 0.678 . . . . 2.74 111.428 167.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -55.33 -52.18 64.34 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.421 1.01 . . . . 3.68 110.76 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 11.9 t -55.02 -39.63 69.33 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.42 0.629 . . . . 2.2 111.66 -176.532 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 25.6 m -77.61 -34.8 20.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 120.713 -1.242 . . . . 2.6 110.781 177.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 45.3 t -59.22 -45.54 92.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-N 119.167 0.894 . . . . 2.31 110.366 173.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.2 t -65.59 -42.41 91.73 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.711 0.687 . . . . 2.74 110.412 177.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 34.9 m -55.46 -47.34 76.23 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.089 0.859 . . . . 1.97 110.282 174.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -53.44 -56.43 16.93 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.157 -0.965 . . . . 4.99 110.173 172.346 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -49.52 -51.07 38.98 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.498 1.519 . . . . 4.9 111.585 -177.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 32.5 p -64.07 -28.59 69.89 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.184 -0.436 . . . . 2.9 111.736 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -82.17 -34.5 29.04 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-N 118.665 0.666 . . . . 4.21 111.791 170.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.54 -39.48 73.45 Favored 'General case' 0 C--O 1.239 0.531 0 O-C-N 120.949 -1.094 . . . . 2.03 110.475 -172.636 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 5.2 ptt180 -53.97 -44.09 70.5 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.626 -0.715 . . . . 4.71 111.755 174.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -41.62 -66.24 0.36 Allowed 'General case' 0 N--CA 1.443 -0.792 0 O-C-N 124.249 0.968 . . . . 2.39 113.012 -126.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -96.92 -72.84 0.62 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 124.13 1.919 . . . . 6.09 112.385 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.44 80.63 1.51 Allowed Glycine 0 N--CA 1.439 -1.109 0 CA-C-N 112.076 -2.329 . . . . 3.51 109.579 -171.525 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 15.2 ttt180 71.44 111.93 0.06 Allowed 'General case' 0 C--O 1.241 0.647 0 CA-C-N 120.725 2.262 . . . . 6.64 114.026 159.733 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -66.98 64.37 0.05 Allowed 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.886 -1.134 . . . . 5.08 111.727 172.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -132.48 -65.77 0.71 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 125.374 1.47 . . . . 4.96 107.261 172.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 50.0 m -113.93 159.83 19.46 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.18 -0.918 . . . . 2.52 110.812 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 10.5 mp -98.73 123.27 42.85 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.518 1.127 . . . . 3.41 109.036 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 1.1 t -94.87 176.77 6.13 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.509 1.123 . . . . 3.04 109.377 173.402 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 23.3 m -88.55 52.94 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 O-C-N 120.655 -1.278 . . . . 3.95 112.012 -178.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -157.54 58.11 0.5 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 106.103 -1.814 . . . . 2.61 106.103 143.912 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 50.4 mt-10 -163.34 -57.21 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 129.578 3.151 . . . . 2.21 103.167 -176.121 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 4.2 t80 -62.01 -59.94 4.34 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.377 -1.283 . . . . 3.6 109.456 171.426 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -56.82 -40.88 76.8 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 120.27 -0.572 . . . . 4.43 110.749 -174.863 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -50.7 -41.27 55.85 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.188 0.305 . . . . 2.64 111.437 175.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.18 -55.96 26.26 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.674 -1.232 . . . . 3.52 107.674 -175.818 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.2 m -67.94 -44.26 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.674 -0.693 . . . . 1.88 109.574 -170.602 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 87.5 m -62.86 -47.61 82.63 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 124.061 0.945 . . . . 2.92 110.243 -178.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -80.62 -55.79 4.61 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.085 0.402 . . . . 2.92 112.085 -173.428 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -81.19 -41.83 21.74 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 113.798 1.036 . . . . 3.19 113.798 -158.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -62.03 -28.76 4.16 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.186 0.81 . . . . 3.03 113.186 -156.509 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -57.27 -24.55 60.27 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.132 -2.445 . . . . 2.55 111.342 -78.21 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -91.52 -33.24 15.25 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.899 1.679 . . . . 4.12 110.653 -175.892 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 42.8 tp -58.61 -56.4 22.68 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.507 0.323 . . . . 1.93 111.449 -165.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 30.2 mt -87.24 162.69 17.3 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 108.404 -0.962 . . . . 2.26 108.404 161.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.29 170.92 14.75 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 107.557 -1.275 . . . . 5.84 107.557 165.373 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 18.7 t0 55.15 72.63 0.46 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 123.393 1.568 . . . . 4.2 109.25 -161.814 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 28.0 m -87.7 22.21 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 112.643 -2.071 . . . . 2.56 109.786 160.778 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -103.59 -70.74 0.84 Allowed Glycine 0 C--N 1.342 0.89 0 N-CA-C 108.81 -1.716 . . . . 2.81 108.81 -177.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 46.7 t -79.02 50.2 1.01 Allowed 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.619 1.167 . . . . 3.49 109.677 178.248 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -50.94 -41.65 59.16 Favored 'General case' 0 N--CA 1.444 -0.752 0 C-N-CA 125.679 1.592 . . . . 2.28 109.066 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -30.47 -48.18 0.1 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 127.743 2.417 . . . . 4.14 113.526 170.739 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -60.35 -54.55 44.33 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.309 0.576 . . . . 2.85 110.28 178.309 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.3 -54.29 48.68 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.115 -1.439 . . . . 5.17 107.115 -179.547 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -45.51 -55.05 6.64 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.863 1.265 . . . . 2.51 110.635 178.247 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -64.43 -39.82 94.56 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.268 0.485 . . . . 3.85 110.855 -177.586 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.4 t -63.89 -30.23 71.33 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 122.833 0.453 . . . . 2.43 111.791 175.549 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 36.6 mt -80.13 -53.91 6.25 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.595 1.158 . . . . 2.16 110.809 -178.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.261 16.8 t0 -54.63 -8.47 0.24 Allowed 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 128.531 2.732 . . . . 1.75 117.324 -168.869 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.8 m -34.17 -20.14 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 130.706 3.602 . . . . 2.93 119.762 -134.95 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -60.35 -25.16 65.64 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 121.281 1.855 . . . . 4.39 111.043 161.804 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 62.33 64.12 0.98 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.939 1.695 . . . . 4.06 109.908 176.147 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 39.4 p30 -104.33 -27.42 11.99 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.029 1.332 . . . . 2.56 111.546 176.363 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 35.0 m 111.35 -21.06 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.337 3.055 . . . . 2.63 111.926 -174.503 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -113.18 114.8 27.27 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 125.882 1.673 . . . . 6.14 108.566 -168.316 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -83.16 104.56 13.44 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.76 1.224 . . . . 2.12 108.336 -176.171 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -84.28 174.32 10.25 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 127.462 2.305 . . . . 6.2 112.339 -165.579 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -80.42 55.2 2.21 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.512 0.725 . . . . 6.64 109.782 167.137 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -167.53 46.68 0.05 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 120.316 -0.554 . . . . 5.81 111.067 102.121 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 69.2 mt-10 -91.33 -60.09 1.98 Allowed 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.473 1.509 . . . . 2.18 108.577 162.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -45.2 -41.48 8.31 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 125.011 1.324 . . . . 3.99 111.707 -175.688 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.461 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 1.4 t90 -39.5 -48.93 2.07 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 124.527 1.142 . . . . 5.3 109.312 178.632 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 48.6 mtp85 -42.58 -36.93 1.51 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.197 0.908 . . . . 5.02 113.15 -176.153 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.1 tp -63.69 -45.26 90.83 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.829 1.195 . . . . 2.07 111.177 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 8.2 pt -77.74 -31.52 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 C-N-CA 124.216 1.006 . . . . 4.87 108.664 -177.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -46.83 -59.27 5.62 Favored Glycine 0 N--CA 1.433 -1.563 0 N-CA-C 108.461 -1.856 . . . . 2.23 108.461 165.704 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -74.51 -53.97 8.43 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 113.531 -1.334 . . . . 2.87 110.916 -169.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . 0.292 4.5 pp -50.6 -29.28 10.5 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 121.116 1.78 . . . . 2.81 113.157 -175.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.63 -46.63 77.39 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.761 0.652 . . . . 1.94 112.761 168.263 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -77.45 -35.21 54.13 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 117.871 -1.062 . . . . 3.37 112.281 172.415 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -52.99 -31.92 43.47 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 120.753 1.615 . . . . 3.22 112.17 -172.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 9.2 tt -43.34 -46.44 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 123.16 0.584 . . . . 2.48 111.61 170.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 9.5 ptm85 -85.55 -49.51 7.98 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.326 1.45 . . . . 4.42 113.699 168.574 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 23.4 tttm -69.67 95.41 0.87 Allowed 'General case' 0 CA--C 1.531 0.247 0 O-C-N 121.128 -0.983 . . . . 7.61 111.659 -174.558 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 4.5 ttpm? -57.82 -60.24 4.01 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.718 -0.845 . . . . 6.38 108.718 157.941 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 20.4 tptp -153.89 -14.45 0.14 Allowed 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.666 0.617 . . . . 7.58 112.666 176.677 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -91.64 48.81 1.5 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.706 0.802 . . . . 4.93 111.22 -140.345 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 36.8 tp -97.9 -69.07 0.77 Allowed 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 108.563 -0.902 . . . . 7.28 108.563 -178.236 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -172.93 154.67 2.92 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 124.46 1.104 . . . . 11.14 108.495 175.888 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 17.1 mm -133.23 59.44 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 106.469 -1.678 . . . . 7.72 106.469 172.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -163.92 149.69 11.05 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.016 -0.735 . . . . 7.31 109.016 -178.252 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -177.56 116.89 0.09 Allowed 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 128.169 2.588 . . . . 7.65 104.596 178.358 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 6.0 tmtt? . . . . . 0 C--O 1.25 1.117 0 CA-C-O 117.36 -1.305 . . . . 8.2 108.672 -161.397 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.6 mtt . . . . . 0 N--CA 1.471 0.585 0 N-CA-C 105.188 -2.152 . . . . 7.35 105.188 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.77 174.3 0.84 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 119.292 0.951 . . . . 4.08 110.466 161.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.0 89.83 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 129.057 2.943 . . . . 4.0 109.735 -173.872 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -93.76 121.9 63.49 Favored Pre-proline 0 N--CA 1.451 -0.385 0 C-N-CA 125.019 1.327 . . . . 4.93 109.031 -178.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -72.06 154.46 57.56 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 122.174 1.916 . . . . 2.56 108.754 175.202 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 73.6 mt -109.33 169.68 8.54 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.187 0.995 . . . . 2.41 108.577 -174.459 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.5 t -75.18 159.97 30.97 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 120.885 -1.134 . . . . 2.17 110.504 -176.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -46.45 -56.85 5.32 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.193 -0.942 . . . . 2.79 113.164 -175.811 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 mt -61.08 -44.44 97.37 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.532 -0.747 . . . . 2.89 111.085 -178.307 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -54.36 -53.14 57.9 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.536 2.334 . . . . 2.71 112.208 173.65 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -53.26 -55.7 22.43 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.406 1.082 . . . . 3.58 109.274 172.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.0 t -53.08 -51.84 60.54 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.581 0.752 . . . . 2.75 112.076 -178.768 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.4 pp -65.56 -39.32 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-O 118.472 -0.775 . . . . 1.83 110.155 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -56.06 -58.08 9.42 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 119.138 0.881 . . . . 2.45 109.653 177.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.2 t -54.7 -40.86 69.59 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.351 0.596 . . . . 2.23 111.726 -172.219 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.4 m -74.28 -35.54 40.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 O-C-N 120.929 -1.107 . . . . 1.71 111.401 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 37.4 t -60.6 -48.4 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 119.285 0.948 . . . . 1.61 110.114 175.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.1 t -62.52 -42.08 99.27 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.077 0.853 . . . . 1.72 110.623 177.104 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 48.4 m -57.52 -53.45 57.98 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 118.736 0.698 . . . . 1.91 110.226 176.125 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -45.61 -54.1 8.18 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.109 0.964 . . . . 4.2 109.98 171.535 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -60.93 -50.19 74.39 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.578 0.751 . . . . 4.51 111.772 -173.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.0 t -63.94 -30.8 71.85 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.95 -0.469 . . . . 2.66 110.836 -178.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -69.71 -42.64 73.75 Favored 'General case' 0 C--O 1.221 -0.406 0 O-C-N 121.631 -0.668 . . . . 4.09 111.13 166.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.81 -22.48 66.93 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 125.259 1.423 . . . . 1.56 112.747 -170.283 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.253 0.0 OUTLIER -80.66 -15.73 55.82 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 117.112 -1.423 . . . . 4.59 113.543 175.046 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.69 -66.09 0.33 Allowed 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 120.071 1.305 . . . . 2.69 112.595 178.182 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -117.44 172.73 7.14 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 126.621 1.968 . . . . 2.47 107.219 -173.972 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -3.52 112.5 0.01 OUTLIER Glycine 0 CA--C 1.531 1.059 0 C-N-CA 127.906 2.67 . . . . 1.95 114.454 172.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.5 mtp180 62.99 106.54 0.03 OUTLIER 'General case' 0 C--O 1.236 0.387 0 N-CA-C 114.309 1.226 . . . . 7.11 114.309 175.618 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 51.56 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.835 1.654 . . . . 5.5 112.263 157.099 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -148.14 -53.13 0.19 Allowed 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 125.746 1.618 . . . . 3.99 107.505 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -118.96 162.71 18.07 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 124.533 1.133 . . . . 2.38 111.339 -175.727 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 mp -112.92 170.17 8.39 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 124.547 1.139 . . . . 3.74 110.461 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.6 t -153.77 179.48 8.82 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.991 1.716 . . . . 4.04 106.794 175.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.7 t -37.28 -62.85 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 125.768 1.627 . . . . 3.33 113.619 -166.349 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -66.2 -56.29 12.05 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.647 0.658 . . . . 2.3 109.951 -174.52 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -38.84 -45.89 1.22 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.238 1.415 . . . . 1.72 112.704 171.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -67.53 -58.02 5.45 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 122.996 0.519 . . . . 3.98 110.304 176.824 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -54.17 -39.98 67.1 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.071 0.396 . . . . 3.78 111.11 -174.215 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -47.76 -40.43 20.65 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 112.741 0.645 . . . . 3.03 112.741 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 tp -66.22 -45.92 79.01 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-N 119.404 1.002 . . . . 3.53 108.787 -175.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.8 m -68.15 -53.6 28.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 N-CA-C 108.66 -0.867 . . . . 2.45 108.66 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 93.9 m -53.08 -48.9 67.39 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.983 0.913 . . . . 2.33 111.983 179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -80.39 -52.88 7.16 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.751 0.42 . . . . 2.57 111.433 -174.663 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -106.0 6.55 31.36 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.523 1.129 . . . . 3.61 113.087 -162.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 tp -136.28 84.03 30.7 Favored Pre-proline 0 CA--C 1.537 0.457 0 O-C-N 121.079 -1.013 . . . . 2.97 108.36 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.07 -29.23 48.49 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.431 2.088 . . . . 2.35 111.696 -170.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -141.22 -99.52 0.14 Allowed 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 118.901 -0.571 . . . . 4.6 109.556 173.347 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.418 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 5.8 tp 51.39 -87.99 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.785 1.634 . . . . 2.19 113.127 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.4 mt -73.62 -29.52 62.41 Favored 'General case' 0 N--CA 1.458 -0.034 0 C-N-CA 125.743 1.617 . . . . 3.1 110.66 177.373 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 49.4 -173.26 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.948 2.099 . . . . 7.51 113.057 -179.097 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 46.64 42.59 11.6 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 125.958 1.703 . . . . 6.41 111.482 170.106 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -61.74 2.08 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 127.985 2.514 . . . . 3.79 113.613 -177.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.17 -70.15 0.97 Allowed Glycine 0 CA--C 1.53 1.0 0 N-CA-C 109.502 -1.439 . . . . 1.83 109.502 164.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -81.9 63.81 6.31 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 122.664 1.221 . . . . 2.28 110.156 -174.855 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -73.23 -28.93 62.44 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 124.553 1.141 . . . . 2.8 109.706 175.85 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 29.7 p-10 -42.02 -52.89 4.08 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.537 1.535 . . . . 4.76 112.371 173.229 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -49.2 -50.75 36.81 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.647 0.779 . . . . 4.27 110.082 176.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.45 -47.53 75.84 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.8 -0.444 . . . . 3.98 109.8 -177.259 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 16.2 tmm? -52.41 -43.69 64.95 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 123.284 0.634 . . . . 4.54 109.466 176.625 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.6 tptt -70.17 -38.32 75.38 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 122.663 0.385 . . . . 5.97 111.658 178.569 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.2 m -58.97 -34.87 72.3 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.807 0.443 . . . . 2.89 110.443 172.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 83.8 mt -69.37 -78.27 0.07 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 109.433 -0.58 . . . . 3.49 109.433 168.553 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.62 80.13 4.1 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 122.012 0.91 . . . . 2.55 110.443 -178.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.2 m -65.19 -19.16 25.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-N 115.617 -0.72 . . . . 4.69 111.318 165.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -69.42 -58.36 4.09 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 118.92 -0.562 . . . . 4.74 112.232 -168.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 121.85 -35.39 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 130.503 3.521 . . . . 4.73 110.322 -167.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . 0.444 ' C ' ' H ' ' A' ' 70' ' ' GLU . 4.0 p-10 -62.54 99.99 0.17 Allowed 'General case' 0 C--N 1.347 0.464 0 N-CA-C 105.711 -1.959 . . . . 4.22 105.711 169.852 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.0 m -78.94 36.15 0.27 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.222 1.409 . . . . 3.43 111.664 -166.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . 0.444 ' H ' ' C ' ' A' ' 68' ' ' ASP . 12.1 mp0 -121.27 121.11 37.0 Favored 'General case' 0 N--CA 1.426 -1.656 0 C-N-CA 131.647 3.979 . . . . 5.92 102.898 -178.544 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -93.15 101.25 13.54 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 106.734 -1.58 . . . . 2.12 106.734 -177.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.95 160.05 15.67 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.51 1.124 . . . . 4.42 108.575 169.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -40.45 -60.02 1.2 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.587 1.155 . . . . 6.65 111.667 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -69.14 -25.7 64.51 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.565 0.746 . . . . 2.01 112.036 -176.679 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -68.04 -59.61 3.12 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 108.497 -0.927 . . . . 1.93 108.497 172.547 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -55.44 -43.11 75.09 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.643 0.377 . . . . 4.53 110.496 -175.695 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 8.2 t-105 -39.97 -37.2 0.55 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.688 1.195 . . . . 5.13 112.171 173.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 44.2 mtt180 -39.49 -48.0 1.93 Allowed 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 120.302 1.41 . . . . 4.62 112.12 173.191 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.7 tp -51.52 -38.85 56.08 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.703 0.801 . . . . 1.9 111.492 -178.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 84.5 mt -67.05 -32.19 56.76 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 108.269 -1.011 . . . . 3.28 108.269 -176.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.556 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -69.61 -46.19 55.76 Favored Glycine 0 CA--C 1.485 -1.822 0 N-CA-C 110.025 -1.23 . . . . 1.34 110.025 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -61.79 -57.2 12.77 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 105.716 -1.957 . . . . 2.41 105.716 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.418 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 4.4 mp -38.39 -59.99 0.84 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 120.074 1.307 . . . . 3.73 112.339 172.476 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.46 -28.13 69.6 Favored 'General case' 0 C--O 1.225 -0.231 0 N-CA-C 113.153 0.798 . . . . 2.17 113.153 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.0 ttmt -81.45 -62.4 1.66 Allowed 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.814 1.246 . . . . 2.61 110.522 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -39.85 -49.5 2.39 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 126.489 1.915 . . . . 2.44 110.536 -174.007 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.2 tt -37.12 -43.71 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 125.513 1.525 . . . . 2.11 113.128 177.074 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.31 67.36 1.08 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.392 1.077 . . . . 7.58 109.86 165.457 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -75.42 158.57 32.49 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 124.389 1.075 . . . . 4.66 109.252 170.753 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -79.04 -52.98 7.49 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 109.408 -0.59 . . . . 17.57 109.408 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 24.2 ttpt -73.65 -5.49 40.81 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 119.011 -0.519 . . . . 13.84 112.341 -177.792 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -72.56 69.67 0.88 Allowed 'General case' 0 C--N 1.343 0.291 0 N-CA-C 106.999 -1.482 . . . . 6.91 106.999 160.769 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 33.5 tp -90.41 -76.33 0.43 Allowed 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 105.241 -2.133 . . . . 9.3 105.241 -171.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -139.46 131.32 27.61 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 105.907 -1.886 . . . . 11.52 105.907 176.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 17.6 tt -140.45 -57.83 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-O 118.568 -0.73 . . . . 12.87 111.224 -178.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -161.96 14.49 0.09 Allowed 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 115.114 1.524 . . . . 16.86 115.114 -178.894 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.5 mmtm -178.27 59.37 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 105.351 -2.092 . . . . 15.15 105.351 173.24 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 48.3 mttm . . . . . 0 C--O 1.258 1.552 0 CA-C-O 116.558 -1.686 . . . . 12.7 107.402 -141.608 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.387 2.6 ttp . . . . . 0 N--CA 1.476 0.841 0 N-CA-C 115.891 1.812 . . . . 7.29 115.891 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 65.61 176.16 0.21 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 115.571 1.693 . . . . 6.23 115.571 160.173 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 66.39 100.13 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.234 1.814 . . . . 4.99 115.837 161.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -156.87 161.76 28.9 Favored Pre-proline 0 CA--C 1.544 0.734 0 C-N-CA 125.061 1.345 . . . . 8.8 107.962 171.134 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -74.49 170.6 19.9 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.77 2.313 . . . . 3.74 112.427 -171.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 46.7 mt -132.02 140.2 48.84 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.114 0.966 . . . . 3.74 111.536 -153.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 6.1 t -76.27 -68.52 0.58 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.38 1.472 . . . . 2.72 114.276 178.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -169.57 -71.69 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.09 1.356 . . . . 2.19 108.702 -164.238 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.1 mt -51.58 -45.32 63.07 Favored 'General case' 0 C--N 1.341 0.199 0 O-C-N 121.37 -0.831 . . . . 2.46 109.243 166.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 47.0 mt-10 -51.55 -47.27 63.49 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.514 1.526 . . . . 3.17 111.621 172.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -59.4 -48.46 81.56 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.224 -0.923 . . . . 3.69 110.072 176.504 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 14.4 p -62.93 -40.79 98.71 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.284 -0.885 . . . . 2.16 111.282 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.358 2.9 pp -62.15 -37.87 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 O-C-N 121.159 -0.963 . . . . 2.11 110.525 174.15 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -59.04 -46.07 89.16 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 119.189 -1.004 . . . . 3.3 111.961 170.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . 0.29 1.3 t -56.03 -36.7 68.27 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 120.2 1.363 . . . . 2.0 112.002 -177.056 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 8.8 m -76.17 -35.82 29.18 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 O-C-N 120.414 -1.429 . . . . 1.88 111.578 174.464 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 94.1 t -57.63 -46.69 86.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 119.188 0.903 . . . . 2.38 110.254 174.653 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.8 t -64.54 -40.84 96.32 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.411 -0.805 . . . . 2.61 110.474 177.908 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 27.6 m -57.25 -54.87 41.89 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.478 1.036 . . . . 1.97 109.355 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -42.15 -60.79 1.33 Allowed 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 124.799 1.239 . . . . 5.75 110.582 171.877 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -57.78 -54.18 49.79 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.035 0.934 . . . . 4.99 111.683 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 36.9 p -57.33 -43.34 83.29 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 122.842 0.457 . . . . 2.69 110.908 -177.639 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -68.49 -43.64 76.46 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 118.565 0.62 . . . . 4.08 111.591 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.87 -32.77 63.96 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 125.48 1.512 . . . . 1.71 110.33 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.14 -26.34 66.2 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 117.781 -1.104 . . . . 4.78 112.581 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -52.96 -64.15 0.91 Allowed 'General case' 0 C--N 1.343 0.323 0 N-CA-C 114.799 1.407 . . . . 2.76 114.799 -153.783 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -89.43 -72.86 0.53 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.891 0.853 . . . . 2.89 110.535 -170.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.88 155.74 22.64 Favored Glycine 0 C--N 1.336 0.54 0 C-N-CA 126.634 2.064 . . . . 2.37 110.594 164.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 39.06 105.23 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 116.367 1.988 . . . . 5.46 116.367 131.891 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -72.74 15.33 0.2 Allowed 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.816 1.784 . . . . 5.63 115.816 -171.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 27.7 p-10 -90.99 -39.9 11.96 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 126.238 1.815 . . . . 4.64 110.205 175.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 11.6 p -99.67 141.33 32.62 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 127.889 2.475 . . . . 2.9 108.951 -164.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -89.25 179.62 6.07 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 107.779 -1.193 . . . . 3.11 107.779 147.091 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 17.0 t -155.66 -168.32 2.77 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 123.279 1.514 . . . . 3.56 112.191 -144.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 5.2 t -69.36 -157.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 N-CA-C 100.807 -3.775 . . . . 3.98 100.807 135.936 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -76.66 57.74 1.3 Allowed 'General case' 0 CA--C 1.549 0.915 1 O-C-N 116.153 -4.092 . . . . 2.93 112.866 -136.181 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 36.9 mt-10 -80.21 -44.53 19.6 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 127.504 2.322 . . . . 2.07 108.259 125.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -65.33 -54.35 30.2 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 122.071 -0.393 . . . . 3.78 111.756 -170.041 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 28.6 tttt -59.69 -32.5 70.55 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 118.706 -1.198 . . . . 4.19 110.367 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -57.56 -33.48 68.18 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 112.59 0.589 . . . . 2.79 112.59 172.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -63.46 -55.5 23.71 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 107.836 -1.172 . . . . 4.11 107.836 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -69.66 -38.91 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 CA-C-N 116.028 -0.533 . . . . 2.04 110.1 -171.988 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 98.1 m -62.57 -54.57 37.74 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.77 0.828 . . . . 1.69 110.684 175.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -72.36 -60.07 2.42 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.107 -0.371 . . . . 3.02 110.755 -172.655 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -80.02 -58.41 3.17 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 122.301 -0.249 . . . . 3.37 111.38 -159.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -50.53 -38.57 42.16 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 124.729 1.211 . . . . 3.23 114.242 -155.422 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -52.54 -49.15 18.45 Favored 'Trans proline' 0 N--CA 1.452 -0.914 0 C-N-CA 119.783 -3.007 . . . . 2.47 109.021 -76.745 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -51.34 -52.6 44.02 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 126.915 2.086 . . . . 4.32 112.129 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 21.6 tp -54.52 -46.9 73.6 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.607 0.242 . . . . 2.02 110.941 -163.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.435 ' C ' ' H ' ' B' ' 52' ' ' ASP . 91.9 mt -106.16 68.03 0.76 Allowed 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 124.913 1.285 . . . . 2.16 110.046 165.763 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.29 0.49 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 129.084 2.954 . . . . 7.16 117.715 158.108 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.435 ' H ' ' C ' ' B' ' 50' ' ' LEU . 9.1 t0 -107.15 90.88 3.44 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 105.233 -2.136 . . . . 3.55 105.233 162.406 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 30.2 m -97.38 21.0 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 115.391 -0.822 . . . . 2.91 109.133 164.468 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -95.17 -76.12 1.31 Allowed Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 108.239 -1.944 . . . . 3.01 108.239 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 11.5 m -79.4 52.25 1.34 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 126.637 1.975 . . . . 3.2 111.465 -164.736 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -67.98 -28.48 67.47 Favored 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 124.129 0.972 . . . . 2.43 109.4 178.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -65.12 -48.12 74.75 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.023 0.829 . . . . 4.01 109.993 173.66 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -53.66 -53.0 58.15 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.673 0.789 . . . . 2.87 109.126 173.829 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -57.75 -46.26 84.74 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 118.849 -0.596 . . . . 4.91 110.231 178.344 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -53.07 -52.72 57.64 Favored 'General case' 0 N--CA 1.462 0.137 0 C-N-CA 124.215 1.006 . . . . 2.72 109.604 178.941 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -55.73 -44.2 77.32 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.004 0.522 . . . . 4.51 110.119 176.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 16.1 m -66.89 -30.78 71.03 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.028 0.751 . . . . 2.7 113.028 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 37.4 mt -80.47 -56.41 4.2 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 125.307 1.443 . . . . 2.35 109.641 -177.248 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -67.24 -10.18 48.03 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 127.626 2.37 . . . . 1.58 115.607 -167.345 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 21.4 m -33.01 -20.79 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 C-N-CA 130.349 3.46 . . . . 2.36 119.613 -133.713 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -57.35 -27.86 62.64 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 121.117 1.78 . . . . 3.46 110.978 160.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 64.88 60.93 0.81 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.397 1.479 . . . . 3.73 110.589 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 44.6 p30 -107.22 -13.21 15.2 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.064 1.746 . . . . 1.98 111.656 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 14.3 m 69.41 15.14 8.42 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.412 1.485 . . . . 2.23 113.526 -173.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -114.48 101.12 8.83 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 106.185 -1.783 . . . . 3.11 106.185 160.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -78.11 104.16 8.5 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.975 -1.861 . . . . 2.0 105.975 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -81.43 176.8 9.4 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 121.476 0.655 . . . . 5.71 109.742 -171.452 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -80.57 82.71 6.52 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 107.809 -1.182 . . . . 6.35 107.809 -174.854 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 97.68 50.21 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.325 1 C-N-CA 133.666 4.786 . . . . 2.6 108.126 -172.593 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -89.05 -59.48 2.21 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 120.698 -1.251 . . . . 2.16 108.521 107.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -38.49 -51.75 1.58 Allowed 'General case' 0 C--N 1.345 0.384 0 C-N-CA 126.525 1.93 . . . . 4.11 112.338 -172.296 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 46.2 t90 -44.61 -34.33 2.12 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 125.737 1.615 . . . . 4.88 112.807 -176.083 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 7.8 mmm180 -40.8 -45.51 2.48 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.947 0.899 . . . . 4.77 111.7 172.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 6.1 tp -54.58 -44.49 73.03 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 118.547 0.612 . . . . 2.12 111.402 178.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 34.5 mt -64.08 -30.26 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.806 0 N-CA-C 107.302 -1.37 . . . . 2.42 107.302 -178.034 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.577 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -68.07 -44.43 77.35 Favored Glycine 0 CA--C 1.497 -1.057 0 C-N-CA 124.765 1.174 . . . . 1.67 112.088 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . 0.41 ' OE2' ' NZ ' ' B' ' 85' ' ' LYS . 2.3 mm-40 -65.57 -61.89 1.83 Allowed 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 107.203 -1.406 . . . . 2.7 107.203 178.257 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 3.8 pp -56.85 -34.64 68.0 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.038 0.835 . . . . 3.05 112.062 -178.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.67 -61.49 2.55 Favored 'General case' 0 C--N 1.34 0.188 0 O-C-N 121.611 -0.681 . . . . 2.15 110.315 172.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . 0.41 ' NZ ' ' OE2' ' B' ' 82' ' ' GLU . 0.1 OUTLIER -60.66 -33.85 73.43 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 118.291 -0.862 . . . . 2.76 110.138 -175.316 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -50.67 -33.75 23.83 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 125.457 1.503 . . . . 2.98 112.046 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 4.3 tt -56.95 -38.66 60.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 119.091 0.859 . . . . 1.94 110.634 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -82.19 -41.59 20.12 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.779 1.632 . . . . 5.17 110.225 175.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -108.48 101.58 10.74 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 125.018 1.327 . . . . 5.64 111.254 -166.057 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -39.65 -14.94 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.081 0 N-CA-C 117.432 2.382 . . . . 7.64 117.432 166.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? 86.74 59.91 0.01 OUTLIER 'General case' 0 C--N 1.341 0.221 0 C-N-CA 128.983 2.913 . . . . 6.14 109.001 -161.629 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -76.36 -144.64 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.49 1.116 . . . . 5.09 108.64 166.981 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 5.3 tp -52.88 114.15 1.33 Allowed 'General case' 0 N--CA 1.434 -1.248 0 C-N-CA 125.746 1.618 . . . . 9.83 111.904 -176.764 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.22 137.13 0.39 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.494 1.518 . . . . 7.86 112.578 159.244 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 5.7 pt -125.18 89.42 1.43 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 C-N-CA 125.243 1.417 . . . . 9.82 109.504 -177.17 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 5.5 ttp180 -155.92 153.38 29.53 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 107.527 -1.286 . . . . 9.4 107.527 173.576 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.09 137.8 0.23 Allowed 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 105.844 -1.91 . . . . 7.4 105.844 -178.14 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 10.7 tptp . . . . . 0 C--O 1.257 1.474 0 N-CA-C 103.617 -2.735 . . . . 8.52 103.617 169.689 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.9 mtp . . . . . 0 N--CA 1.472 0.67 0 N-CA-C 105.251 -2.129 . . . . 8.16 105.251 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.07 -153.77 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 124.072 0.857 . . . . 4.95 110.274 165.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.16 57.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 125.132 1.373 . . . . 6.05 108.484 -129.049 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -75.4 116.36 54.0 Favored Pre-proline 0 CA--C 1.54 0.574 0 C-N-CA 126.638 1.975 . . . . 5.66 109.68 -176.66 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -76.97 101.32 1.5 Allowed 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.507 2.138 . . . . 3.59 109.853 -178.068 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 94.7 mt -70.54 157.75 37.34 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 121.66 0.743 . . . . 3.02 110.742 175.456 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.1 m -48.44 136.89 12.11 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.307 1.843 . . . . 3.04 111.47 172.042 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -45.31 -54.17 7.49 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 119.027 0.83 . . . . 2.79 112.59 174.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.1 mt -57.67 -43.95 85.37 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 119.534 -0.867 . . . . 2.6 111.167 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -58.96 -51.31 70.62 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.928 0.785 . . . . 2.5 112.132 175.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -50.36 -55.7 14.52 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.703 0.764 . . . . 3.15 109.608 176.104 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.5 p -62.94 -42.22 99.74 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.625 -0.716 . . . . 2.14 112.395 -175.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.54 -33.28 48.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 119.651 1.114 . . . . 1.99 111.006 177.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -61.3 -57.24 13.16 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 118.196 -0.907 . . . . 3.23 109.86 176.673 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.1 t -51.13 -41.29 59.98 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.712 1.142 . . . . 2.89 111.876 -173.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.9 m -71.78 -37.35 61.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 O-C-N 120.945 -1.097 . . . . 1.97 111.317 178.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 40.3 t -60.25 -52.29 62.98 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 119.542 1.064 . . . . 1.85 110.693 172.69 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.1 t -59.53 -45.13 92.66 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.182 -0.949 . . . . 2.17 110.376 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 88.5 m -57.44 -46.91 83.05 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.877 0.762 . . . . 2.54 111.041 176.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -49.63 -56.69 9.15 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.232 -0.655 . . . . 4.82 109.232 171.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -57.43 -48.43 79.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.976 0.51 . . . . 5.05 111.478 -175.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.6 p -60.47 -56.54 20.16 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.451 -0.574 . . . . 3.59 109.451 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -55.03 -39.15 68.82 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.729 0.695 . . . . 3.95 111.469 178.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.52 -19.32 61.96 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 125.47 1.508 . . . . 2.29 111.878 -177.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.05 -30.74 70.02 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 118.308 -0.854 . . . . 4.76 111.618 175.836 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -45.73 -63.98 0.84 Allowed 'General case' 0 C--N 1.346 0.439 0 N-CA-C 113.493 0.923 . . . . 2.31 113.493 -159.996 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -98.97 80.17 2.45 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 104.155 -2.535 . . . . 3.08 104.155 177.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 34.96 -150.62 0.01 OUTLIER Glycine 0 CA--C 1.525 0.678 0 C-N-CA 127.746 2.593 . . . . 2.85 112.866 -177.505 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 72.2 mtp85 34.16 81.91 0.02 OUTLIER 'General case' 0 C--O 1.24 0.577 0 C-N-CA 126.122 1.769 . . . . 5.74 110.513 164.487 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -74.23 29.64 0.08 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.703 2.001 . . . . 4.51 113.681 -163.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -145.0 -45.77 0.23 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.068 1.347 . . . . 3.63 107.624 -170.341 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.7 p -84.7 134.04 34.36 Favored 'General case' 0 C--O 1.244 0.798 0 O-C-N 121.366 -0.833 . . . . 2.51 111.15 171.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -90.61 120.73 31.93 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.181 1.392 . . . . 3.23 107.896 171.464 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.3 t -85.55 -179.94 7.0 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.283 1.833 . . . . 2.95 110.921 170.267 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.3 t -57.29 -58.17 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 124.925 1.29 . . . . 3.68 111.532 -176.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -63.26 -48.3 78.77 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 108.138 -1.06 . . . . 3.24 108.138 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -39.15 -52.44 1.91 Allowed 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 124.965 1.306 . . . . 2.0 112.921 172.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -61.98 -53.82 50.23 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 120.941 -0.304 . . . . 4.21 110.215 175.383 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.3 tttt -58.23 -36.99 74.01 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 122.047 -0.408 . . . . 4.69 111.337 -172.877 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -53.72 -40.59 66.21 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.497 1.519 . . . . 2.39 110.887 173.482 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 tp -66.83 -44.02 82.2 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 119.35 0.977 . . . . 3.73 109.51 -176.771 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.8 m -76.79 -27.27 16.64 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 CA-C-N 115.914 -0.585 . . . . 2.09 111.264 -174.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.3 m -73.37 -54.85 7.33 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.158 0.583 . . . . 2.72 110.013 172.331 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -82.68 -58.78 2.75 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.232 1.413 . . . . 3.27 112.778 -167.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -83.57 -49.65 9.01 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.583 0.753 . . . . 3.95 110.901 -167.186 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.68 121.58 85.39 Favored Pre-proline 0 CA--C 1.541 0.611 0 N-CA-C 109.089 -0.708 . . . . 3.43 109.089 175.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -84.25 -37.4 0.14 Allowed 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.784 2.322 . . . . 3.31 111.627 179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -151.74 -47.94 0.11 Allowed 'General case' 0 C--N 1.34 0.166 0 CA-C-O 118.335 -0.84 . . . . 5.46 111.863 -166.073 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.45 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 9.6 tp -20.76 -78.26 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 127.43 2.292 . . . . 2.76 113.409 -178.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 49.8 mt -77.82 69.1 4.01 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.444 0.698 . . . . 2.6 109.489 -179.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.38 -8.68 0.14 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.084 1.354 . . . . 6.06 114.091 175.691 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.4 -8.92 56.94 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 128.09 2.556 . . . . 5.2 110.679 176.097 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.4 m -39.74 -37.24 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.404 0 C-N-CA 124.395 1.078 . . . . 3.05 113.44 179.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -46.53 -39.64 10.54 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 124.087 0.851 . . . . 2.1 112.728 176.781 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.1 t -120.39 43.92 2.59 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.771 1.228 . . . . 2.8 109.374 174.164 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -43.55 -44.98 6.4 Favored 'General case' 0 C--N 1.339 0.111 0 CA-C-O 122.144 0.973 . . . . 2.05 110.052 173.59 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.65 -26.04 65.2 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 125.751 1.62 . . . . 4.8 111.805 -172.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -73.02 -43.73 61.72 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.742 1.156 . . . . 3.56 108.934 171.842 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.06 -41.69 79.19 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 108.605 -0.887 . . . . 3.35 108.605 176.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -52.09 -50.28 61.91 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.038 0.535 . . . . 2.44 110.775 175.246 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.85 -43.21 94.75 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.427 0.558 . . . . 5.3 110.768 178.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.0 t -58.96 -40.09 83.67 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.938 0.399 . . . . 2.29 110.929 174.656 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 1.4 tp -65.5 -56.45 12.32 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.635 0.774 . . . . 4.03 109.884 -178.648 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -79.09 75.0 5.63 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.256 0.55 . . . . 1.89 110.576 -177.907 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.7 m -52.48 -25.59 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 123.293 0.637 . . . . 2.44 112.616 177.233 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -79.23 -29.16 42.59 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.625 0.648 . . . . 3.45 112.003 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 54.98 55.1 8.11 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.692 0.797 . . . . 4.02 110.114 -160.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 56.4 p30 -110.28 -8.26 14.75 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.229 1.811 . . . . 2.34 112.353 177.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.5 m 67.16 18.23 10.39 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.227 1.411 . . . . 2.57 112.86 -175.685 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -123.53 118.58 27.69 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.877 1.271 . . . . 3.32 108.023 166.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -83.22 100.94 10.9 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 106.194 -1.78 . . . . 2.43 106.194 165.203 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -62.79 164.99 7.11 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 109.19 -0.671 . . . . 4.15 109.19 169.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -39.5 -58.96 1.17 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.913 1.285 . . . . 6.05 111.218 176.565 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -70.4 -31.32 68.49 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.156 0.982 . . . . 2.32 111.357 -170.434 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -69.07 -56.77 6.71 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.876 -0.787 . . . . 1.96 108.876 173.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -55.04 -42.22 72.4 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 110.058 -0.349 . . . . 4.91 110.058 -178.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.658 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 37.3 t90 -46.18 -36.55 6.11 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 124.325 1.05 . . . . 5.92 112.286 176.186 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 8.5 mtm180 -45.71 -42.94 12.33 Favored 'General case' 0 C--N 1.346 0.427 0 CA-C-N 119.129 0.877 . . . . 4.99 111.023 174.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.4 tp -48.07 -50.09 29.3 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 123.398 0.679 . . . . 2.07 111.045 176.76 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 19.5 mm -65.25 -27.85 43.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 108.091 -1.077 . . . . 3.51 108.091 -175.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.538 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -61.13 -50.88 62.46 Favored Glycine 0 CA--C 1.494 -1.23 0 N-CA-C 109.429 -1.469 . . . . 1.6 109.429 173.345 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -76.95 -32.31 57.22 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-O 117.8 -1.095 . . . . 2.3 109.028 -171.254 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.45 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 7.0 mp -51.67 -58.02 7.56 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 120.297 1.408 . . . . 3.37 109.9 161.899 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.46 -29.62 67.93 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.792 0.837 . . . . 2.37 112.032 -176.588 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.11 -60.09 2.42 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-O 118.587 -0.72 . . . . 2.85 110.022 167.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -47.12 -48.63 23.06 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 127.103 2.161 . . . . 3.2 111.41 -168.97 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.5 tt -51.24 -33.54 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 112.477 0.547 . . . . 2.48 112.477 175.843 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.05 -46.44 6.81 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.597 2.359 . . . . 6.32 111.603 -174.452 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -81.91 -49.49 10.26 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 128.035 2.534 . . . . 4.09 112.959 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 12.1 tptm -65.48 -24.47 67.16 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.186 -0.946 . . . . 10.08 112.423 -158.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -118.9 31.53 6.6 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.806 1.242 . . . . 11.88 110.74 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -53.92 -53.75 48.31 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 115.809 1.781 . . . . 6.94 115.809 -154.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 19.0 tp -29.74 -52.48 0.13 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 130.809 3.643 . . . . 11.37 115.952 -160.594 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -55.15 121.27 8.43 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.878 -0.514 . . . . 13.45 111.616 -169.42 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 48.6 pt -67.2 171.28 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.101 0.96 . . . . 15.91 111.161 177.77 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? 66.88 -139.83 0.14 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 105.812 -1.921 . . . . 20.8 105.812 -154.831 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . 2.343 0.0 OUTLIER 152.09 -18.28 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 119.327 3.084 . . . . 12.18 119.327 159.23 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 5.5 mtpm? . . . . . 0 C--O 1.247 0.966 0 CA-C-N 125.197 3.635 . . . . 15.78 110.942 54.11 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 87.1 mtp . . . . . 0 N--CA 1.472 0.661 0 CA-C-O 117.321 -1.323 . . . . 8.95 108.76 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -126.07 -177.82 4.09 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.68 1.127 . . . . 6.65 113.869 -145.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 86.38 101.16 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.738 2.015 . . . . 5.93 113.681 167.837 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -138.38 174.89 3.77 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 129.403 3.081 . . . . 6.76 104.796 172.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -88.02 133.23 2.9 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 123.348 2.699 . . . . 3.11 110.521 173.085 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 2.1 mt -139.21 -177.63 5.0 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 113.594 0.961 . . . . 3.17 113.594 -154.277 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 10.0 t -81.03 -173.25 4.18 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.758 1.223 . . . . 2.66 110.088 166.432 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 73.8 tt0 -73.11 -54.66 7.93 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.256 0.622 . . . . 3.68 111.875 -173.263 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mt -53.28 -46.66 69.39 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.199 -0.938 . . . . 2.67 109.64 177.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 15.7 mt-10 -51.8 -54.99 22.63 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 113.917 1.08 . . . . 2.94 113.917 169.478 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -60.96 -33.97 74.03 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.882 1.219 . . . . 4.16 110.331 -177.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 13.4 m -60.94 -55.74 29.39 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.213 0.605 . . . . 2.47 110.891 173.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.28 2.3 pp -60.49 -39.23 80.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 O-C-N 121.505 -0.747 . . . . 2.35 110.87 179.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -61.12 -55.94 26.59 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.75 0.704 . . . . 2.59 110.241 175.269 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.1 t -54.54 -38.53 66.69 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.194 0.906 . . . . 2.18 111.214 -173.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 12.8 m -75.41 -37.42 38.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 O-C-N 121.356 -0.84 . . . . 2.25 111.494 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 25.0 t -58.6 -46.68 90.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 119.759 1.163 . . . . 2.32 110.785 173.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 15.0 t -65.83 -46.87 76.92 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.353 -0.842 . . . . 2.73 110.516 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 86.1 m -59.21 -45.53 90.86 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 120.081 1.309 . . . . 2.09 110.861 176.428 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -47.07 -54.94 9.22 Favored 'General case' 0 C--O 1.225 -0.196 0 N-CA-C 109.231 -0.655 . . . . 5.52 109.231 170.03 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -58.89 -51.66 69.07 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 122.977 0.511 . . . . 3.75 111.697 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 41.5 p -62.15 -35.18 77.99 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.556 -0.715 . . . . 3.25 111.229 -177.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -70.03 -44.11 69.93 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.468 0.576 . . . . 4.26 111.016 170.376 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.93 -27.13 68.63 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.356 1.463 . . . . 2.06 111.0 -173.045 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -55.72 -26.37 44.93 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 118.926 -0.559 . . . . 4.91 110.957 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.61 -70.9 0.14 Allowed 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 116.085 1.883 . . . . 4.01 116.085 -147.542 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -95.14 -76.92 0.48 Allowed 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 122.328 1.061 . . . . 3.08 113.257 -169.421 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.43 112.38 4.22 Favored Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 127.447 2.451 . . . . 2.97 109.557 168.079 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.6 ttt85 66.85 109.07 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 121.027 2.413 . . . . 5.2 115.845 149.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 21.1 pttt -53.35 -13.64 0.6 Allowed 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 116.565 2.061 . . . . 5.03 116.565 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -88.46 -46.41 9.15 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.761 0.824 . . . . 3.87 110.494 -170.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 5.4 p -107.28 163.27 13.17 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 126.69 1.996 . . . . 2.24 109.512 -175.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 mp -120.78 140.75 51.26 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-O 121.718 0.771 . . . . 4.03 112.743 170.183 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 5.1 t -86.33 -170.06 2.92 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 128.473 2.709 . . . . 2.94 110.427 174.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.413 ' C ' ' H ' ' B' ' 37' ' ' GLU . 67.7 t -66.65 -108.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.384 1 C-N-CA 132.056 4.142 . . . . 3.68 100.215 177.608 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -75.42 58.01 0.96 Allowed 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 124.068 3.122 . . . . 2.62 112.511 -175.154 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . 0.413 ' H ' ' C ' ' B' ' 35' ' ' VAL . 4.7 tt0 -123.97 -47.5 1.92 Allowed 'General case' 0 CA--C 1.542 0.639 1 C-N-CA 131.897 4.079 . . . . 2.11 106.301 154.114 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -60.7 -48.02 83.65 Favored 'General case' 0 C--N 1.344 0.336 0 O-C-N 121.282 -0.886 . . . . 4.31 109.925 166.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 13.7 ttmt -59.57 -31.84 69.82 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.217 0.532 . . . . 3.88 110.121 -171.513 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -54.73 -41.37 70.29 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 123.461 0.705 . . . . 2.93 112.241 173.901 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.1 tp -63.89 -47.24 81.41 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 120.391 1.45 . . . . 3.02 109.403 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 16.9 m -69.66 -41.0 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 CA-C-N 115.346 -0.843 . . . . 2.2 109.477 -172.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 85.4 m -68.13 -55.55 11.99 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 123.401 0.68 . . . . 1.65 110.519 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -81.84 -58.84 2.81 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.627 1.571 . . . . 3.0 111.635 -163.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.33 -41.23 25.19 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 122.017 -0.427 . . . . 4.01 111.093 -172.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.9 tp -82.59 -14.55 0.21 Allowed Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 119.129 3.011 . . . . 3.31 119.129 -158.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -38.96 -56.73 1.1 Allowed 'Trans proline' 0 CA--C 1.535 0.572 1 C-N-CA 125.601 4.201 . . . . 2.79 116.274 -133.725 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -71.44 -26.58 62.79 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.741 -0.6 . . . . 4.71 112.439 -169.013 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 39.0 tp -62.33 -77.01 0.05 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.081 0.552 . . . . 2.26 111.402 -166.144 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.81 97.68 8.75 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.293 -1.003 . . . . 2.95 108.293 168.695 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 15.6 pttp -63.54 179.33 0.47 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.007 0.432 . . . . 6.2 110.209 167.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 57.65 34.98 25.18 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.248 1.019 . . . . 5.77 109.882 177.347 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -55.55 -22.08 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 125.933 1.693 . . . . 4.29 112.999 -173.823 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -46.01 -41.95 11.35 Favored Glycine 0 CA--C 1.531 1.075 0 N-CA-C 111.316 -0.714 . . . . 2.64 111.316 168.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 82.5 p -76.28 43.11 0.29 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 117.723 0.761 . . . . 4.81 112.179 -178.993 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -74.94 -50.16 17.7 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 120.98 -1.075 . . . . 2.04 109.055 -179.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.46 -14.17 62.74 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.91 -0.494 . . . . 4.36 112.327 -161.003 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -80.54 -41.42 24.17 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.702 0.801 . . . . 3.6 111.517 165.288 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.37 -49.64 71.77 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 107.584 -1.265 . . . . 4.32 107.584 171.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -39.62 -53.83 2.09 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 124.033 0.933 . . . . 2.66 110.978 176.846 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -60.74 -37.61 82.34 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.361 0.504 . . . . 3.44 112.361 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.0 t -67.18 -30.44 70.39 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.844 0.683 . . . . 3.08 112.844 175.251 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 5.9 mp -80.32 -54.52 5.64 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.455 -0.778 . . . . 2.84 110.385 176.046 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -54.31 -12.04 0.6 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 128.562 2.745 . . . . 1.51 116.051 -170.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -35.66 -21.99 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.408 1 C-N-CA 132.404 4.281 . . . . 3.77 119.681 -130.367 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 16.8 p30 -64.82 -19.1 65.67 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 120.198 1.363 . . . . 2.87 110.949 163.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 65.13 58.8 0.87 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.323 1.049 . . . . 3.5 110.041 169.526 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -108.24 -6.54 16.3 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.395 1.878 . . . . 1.83 110.839 -178.397 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m 67.97 12.66 8.9 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.448 1.499 . . . . 2.78 113.753 -173.515 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -114.93 100.88 8.53 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.372 1.469 . . . . 3.02 107.106 162.249 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.92 100.55 0.21 Allowed 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 106.038 -1.838 . . . . 2.12 106.038 166.992 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.8 tppt? -84.22 167.63 16.48 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.729 1.612 . . . . 4.87 110.199 -167.821 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -92.1 52.44 1.97 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.646 0.736 . . . . 5.88 110.951 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -162.28 49.74 0.19 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 105.925 -1.88 . . . . 2.42 105.925 113.782 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -95.68 -61.08 1.52 Allowed 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 119.914 -1.741 . . . . 2.05 109.097 148.34 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -53.23 -37.73 62.31 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.567 1.147 . . . . 5.67 110.786 -170.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.658 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 17.7 t-105 -39.35 -37.77 0.47 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.129 1.372 . . . . 5.52 111.535 172.608 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 -37.77 -49.39 1.16 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.595 1.558 . . . . 6.62 111.605 173.302 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.8 tp -53.4 -40.79 65.34 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-O 119.741 -0.171 . . . . 1.88 110.582 -176.241 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 76.4 mt -63.75 -28.15 44.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 N-CA-C 108.602 -0.888 . . . . 2.71 108.602 -173.1 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.58 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -76.01 -45.8 15.13 Favored Glycine 0 CA--C 1.487 -1.671 0 N-CA-C 109.857 -1.297 . . . . 1.5 109.857 178.343 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -68.2 -34.63 76.62 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 107.823 -1.177 . . . . 2.28 107.823 -175.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 5.4 mt -49.23 -60.16 3.05 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 120.642 1.565 . . . . 3.06 111.087 169.388 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.46 -50.83 68.83 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 122.092 0.949 . . . . 2.02 110.127 -179.355 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 12.7 ttpp -60.18 -40.15 89.01 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 123.769 0.828 . . . . 2.65 110.329 -177.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -64.37 -43.11 95.54 Favored 'General case' 0 C--O 1.226 -0.144 0 C-N-CA 125.716 1.606 . . . . 2.77 110.417 176.704 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -32.14 47.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 119.545 -0.862 . . . . 2.43 110.836 171.023 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.91 -36.27 42.15 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 113.75 1.019 . . . . 4.27 113.75 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -121.23 150.86 40.71 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.25 1.42 . . . . 7.41 112.285 -168.141 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.53 -35.59 21.02 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 114.588 1.329 . . . . 7.17 114.588 146.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 40.9 tptt -104.6 -41.29 5.74 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 115.427 1.64 . . . . 8.64 115.427 -148.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.64 138.94 51.66 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.186 0.903 . . . . 6.91 109.411 178.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 1.3 pp 171.49 -41.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 128.16 2.584 . . . . 8.23 108.26 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -76.92 142.79 39.94 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.799 -0.815 . . . . 9.23 108.799 174.193 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 14.7 tt -155.94 170.64 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 106.843 -1.54 . . . . 7.8 106.843 -174.856 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 52.7 ttt180 -146.13 170.38 16.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 107.863 -1.162 . . . . 9.02 107.863 -176.292 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.19 136.66 0.29 Allowed 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 126.044 1.738 . . . . 7.63 107.235 179.593 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 53.2 tptt . . . . . 0 C--O 1.252 1.197 0 N-CA-C 104.971 -2.233 . . . . 9.03 104.971 154.133 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.1 mtp . . . . . 0 N--CA 1.472 0.665 0 N-CA-C 106.688 -1.597 . . . . 8.52 106.688 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.03 90.33 0.19 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.397 0.999 . . . . 7.16 112.43 -173.945 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 29.19 93.97 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 127.429 2.292 . . . . 9.37 114.607 153.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -155.34 -62.78 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.548 0 N-CA-C 107.495 -1.298 . . . . 6.6 107.495 -170.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -65.82 164.89 25.24 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 121.359 1.373 . . . . 3.69 111.049 170.684 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.1 mt -112.13 -178.38 3.4 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 127.046 2.138 . . . . 2.75 109.921 -164.298 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.5 t -70.96 167.08 19.91 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.733 -1.229 . . . . 2.8 110.093 176.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -61.56 -54.38 43.85 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.166 -0.959 . . . . 2.32 111.607 -166.922 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.7 mt -60.97 -44.24 97.6 Favored 'General case' 0 C--O 1.222 -0.357 0 O-C-N 121.344 -0.847 . . . . 2.61 111.232 177.563 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -50.87 -51.47 51.16 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.207 2.203 . . . . 2.8 112.21 174.846 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -49.84 -58.41 5.45 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.569 0.748 . . . . 4.43 109.157 170.393 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.0 m -56.08 -50.65 70.42 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.973 0.909 . . . . 2.89 111.719 -173.828 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.276 2.7 pp -61.92 -43.61 97.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 109.004 -0.739 . . . . 2.24 109.004 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -61.29 -45.69 93.42 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.305 0.957 . . . . 4.21 110.925 175.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.25 -36.53 68.64 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.614 0.766 . . . . 2.83 111.747 -178.403 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . 0.252 31.2 m -79.46 -40.13 21.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 O-C-N 120.926 -1.109 . . . . 2.22 111.5 172.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.8 t -51.2 -48.46 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 120.48 1.491 . . . . 2.19 110.989 175.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.2 t -59.55 -40.9 88.79 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.866 -0.522 . . . . 1.88 110.524 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 28.7 m -58.94 -50.08 75.39 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.434 0.694 . . . . 2.06 110.039 176.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -52.36 -57.25 10.4 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 123.423 0.689 . . . . 8.33 109.191 175.351 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -56.51 -53.38 58.19 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.635 1.174 . . . . 5.01 110.382 -172.233 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.8 t -63.4 -48.5 77.6 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 120.008 -0.677 . . . . 2.63 110.403 -176.909 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -60.62 -42.39 96.74 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 119.458 1.027 . . . . 4.78 110.773 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.2 -17.71 58.94 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 124.804 1.242 . . . . 2.0 111.965 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.7 ptt180 -71.04 -20.14 62.42 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 117.363 -1.304 . . . . 6.07 111.772 173.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -42.35 -63.0 0.83 Allowed 'General case' 0 C--N 1.346 0.456 0 CA-C-N 119.282 0.947 . . . . 3.21 112.009 -175.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -120.7 171.42 8.6 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 126.405 1.882 . . . . 2.39 106.781 -176.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -11.1 119.45 0.01 OUTLIER Glycine 0 CA--C 1.53 0.989 0 C-N-CA 127.546 2.498 . . . . 1.62 114.298 175.022 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.6 ttm180 72.56 105.16 0.07 Allowed 'General case' 0 C--O 1.237 0.421 0 C-N-CA 123.446 0.698 . . . . 4.58 112.731 167.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -75.1 50.17 0.47 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.56 1.144 . . . . 4.36 112.868 177.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -147.73 -57.6 0.24 Allowed 'General case' 0 C--O 1.227 -0.121 0 C-N-CA 125.802 1.641 . . . . 3.72 106.914 174.261 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.0 144.66 28.98 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 124.311 1.044 . . . . 2.08 111.181 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.6 mp -99.87 121.76 41.79 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.087 -1.079 . . . . 3.96 108.087 172.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.6 m -79.54 166.82 21.53 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 107.772 -1.195 . . . . 2.96 107.772 177.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -54.88 -44.66 73.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 O-C-N 120.92 -1.112 . . . . 2.93 112.695 -169.58 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -62.04 -58.18 8.83 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.468 -0.568 . . . . 2.17 109.468 176.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -37.76 -52.04 1.27 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.743 2.017 . . . . 1.88 111.744 172.514 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -58.27 -55.59 32.97 Favored 'General case' 0 N--CA 1.442 -0.834 0 C-N-CA 124.764 1.225 . . . . 4.11 109.15 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.6 tttt -59.85 -42.51 93.81 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 119.28 -0.968 . . . . 4.15 112.307 178.701 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 73.2 mt-10 -52.23 -42.46 63.62 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-N 119.172 0.897 . . . . 2.2 110.621 174.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.4 tt -66.13 -47.18 74.96 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 107.758 -1.201 . . . . 4.03 107.758 -173.664 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -64.32 -51.85 63.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 118.581 -1.248 . . . . 2.24 109.393 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 95.1 m -48.13 -53.99 14.79 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.446 1.098 . . . . 2.36 111.999 178.239 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -80.23 -54.83 5.38 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.337 1.055 . . . . 3.04 110.641 -172.617 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -83.31 -39.63 20.53 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.634 1.174 . . . . 6.37 110.457 -167.486 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -115.48 68.94 2.82 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-N 119.266 0.939 . . . . 3.51 111.288 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -64.78 -37.53 35.09 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.36 2.04 . . . . 2.74 112.302 -178.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -123.84 -34.08 3.06 Favored 'General case' 0 C--N 1.342 0.257 0 N-CA-C 113.307 0.854 . . . . 7.86 113.307 -174.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 30.2 tp -54.9 -59.85 4.17 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-N 118.471 0.578 . . . . 3.39 110.182 -175.812 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.0 mt -74.92 124.3 26.66 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 105.21 -2.145 . . . . 2.91 105.21 152.741 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.2 -7.37 21.26 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 125.455 1.502 . . . . 8.81 110.039 -176.024 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -110.22 87.89 2.63 Favored 'General case' 0 N--CA 1.435 -1.188 0 N-CA-C 104.844 -2.28 . . . . 4.46 104.844 169.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.5 m -98.26 22.63 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 114.59 -1.187 . . . . 3.33 108.865 161.811 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -93.2 -76.02 1.32 Allowed Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 107.319 -2.312 . . . . 2.64 107.319 176.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.7 m -79.22 61.52 3.35 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 126.147 1.779 . . . . 3.05 110.085 -171.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.07 -29.56 64.25 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 125.768 1.627 . . . . 2.32 109.327 178.152 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -53.72 -63.49 1.13 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.869 1.667 . . . . 4.67 112.726 174.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -58.13 -33.66 69.4 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 120.489 -1.382 . . . . 3.6 111.046 177.786 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 -56.76 17.11 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.584 -0.895 . . . . 3.26 108.584 172.276 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -46.99 -50.53 18.97 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 123.877 0.871 . . . . 3.18 110.01 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -60.19 -38.39 83.12 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 117.981 0.355 . . . . 4.57 111.183 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.7 m -68.67 -47.81 65.57 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.642 0.377 . . . . 2.39 111.95 178.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.3 mp -73.94 -48.89 27.45 Favored 'General case' 0 C--O 1.232 0.137 0 O-C-N 121.815 -0.553 . . . . 3.14 111.122 -176.1 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -75.7 78.44 2.66 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.48 0.712 . . . . 2.42 109.961 -169.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 17.5 m -47.63 -37.4 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 124.152 0.981 . . . . 3.46 113.412 -170.461 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -96.06 -8.51 33.29 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.059 0.763 . . . . 3.38 113.059 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 54.39 55.03 8.58 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 125.969 1.708 . . . . 3.67 111.329 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.3 p30 -87.43 -42.83 12.53 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.57 0.748 . . . . 2.09 110.22 174.999 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.5 m 101.9 13.96 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 130.088 3.355 . . . . 2.01 112.727 -171.043 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -112.93 111.35 22.04 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 105.514 -2.032 . . . . 3.25 105.514 162.154 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -79.93 89.93 5.32 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 103.421 -2.807 . . . . 2.31 103.421 175.286 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.3 ttpt -71.26 160.27 33.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.441 1.097 . . . . 4.07 108.349 -178.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -40.09 -60.71 0.99 Allowed 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.561 1.144 . . . . 6.31 112.975 -168.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -69.66 -20.02 63.59 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.195 0.813 . . . . 2.61 113.195 -177.97 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -76.7 -61.35 2.0 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-N 119.866 1.212 . . . . 1.83 108.288 172.796 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -45.33 -39.75 7.04 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 125.586 1.554 . . . . 4.3 110.792 176.685 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.425 ' HE1' ' CA ' ' B' ' 81' ' ' GLY . 11.6 t90 -39.07 -43.59 1.04 Allowed 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 125.243 1.417 . . . . 5.71 114.686 174.296 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.53 -38.92 32.58 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 109.793 -0.447 . . . . 7.8 109.793 178.251 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 tp -57.06 -42.39 80.51 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.862 -0.59 . . . . 1.87 111.278 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 14.9 mm -70.76 -41.07 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 107.195 -1.409 . . . . 2.95 107.195 -177.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.407 ' HA2' ' CD2' ' B' ' 77' ' ' TRP . . . -60.97 -38.35 95.34 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-N 115.24 -0.891 . . . . 1.35 111.687 178.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -81.02 -49.36 11.02 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-O 117.789 -1.1 . . . . 3.59 111.331 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . 0.258 4.0 pp -55.34 -34.0 63.84 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 120.885 1.675 . . . . 3.54 110.881 174.735 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.42 -40.34 78.13 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.219 -0.925 . . . . 2.3 112.52 168.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.3 -48.42 75.74 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 125.068 1.347 . . . . 4.22 111.484 173.793 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -62.38 -28.11 69.54 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.679 1.592 . . . . 2.84 111.936 -158.778 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.0 tt -50.73 -38.05 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 123.497 0.719 . . . . 2.81 111.279 169.073 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . 2.306 0.0 OUTLIER -86.73 -55.13 4.0 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 129.342 3.057 . . . . 5.95 110.472 176.324 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 13.1 tttm -76.03 62.69 1.68 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.465 2.306 . . . . 5.78 112.471 -168.839 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 1.2 ttpp -80.31 -18.34 49.47 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.245 -0.909 . . . . 9.75 110.364 151.493 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 16.7 pttt -125.22 -41.2 2.08 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.941 1.296 . . . . 13.13 113.263 -158.743 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 54.36 -76.95 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 108.071 -1.085 . . . . 7.37 108.071 -144.334 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -162.33 29.49 0.11 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.123 1.769 . . . . 11.84 110.879 169.628 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -154.75 170.75 20.87 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.229 -0.919 . . . . 13.82 112.722 -164.261 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 0.33 0.3 OUTLIER 52.91 71.35 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 127.847 2.459 . . . . 11.62 114.41 167.06 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 34.1 mmm-85 69.39 134.74 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.566 1.947 . . . . 15.37 112.876 162.727 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . 2.495 0.0 OUTLIER 151.83 51.06 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.43 1 C-N-CA 132.878 4.471 . . . . 13.93 104.722 -1.663 . . . . . . . . 4 3 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp . . . . . 0 C--O 1.249 1.07 1 C-N-CA 131.711 4.004 . . . . 15.5 102.372 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.998 0 CA-C-O 118.929 -0.558 . . . . 9.12 110.612 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 160.27 -171.87 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 127.779 2.432 . . . . 4.77 107.493 -177.928 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 104.86 97.05 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 117.268 2.322 . . . . 5.29 117.268 128.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . 0.512 15.3 tt0 120.99 -114.82 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.042 0 CA-C-O 115.322 -2.275 . . . . 6.58 115.071 105.902 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 65.5 Cg_endo -86.07 124.96 2.59 Favored 'Trans proline' 0 C--N 1.353 0.806 0 CA-C-N 124.562 2.665 . . . . 2.72 112.588 -167.817 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -132.24 -92.19 0.39 Allowed 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 115.718 1.747 . . . . 4.7 115.718 -166.57 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 9.2 t -130.04 -140.97 0.23 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 127.84 2.456 . . . . 2.85 111.409 -171.724 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -87.46 -63.58 1.28 Allowed 'General case' 0 C--N 1.34 0.157 0 C-N-CA 125.448 1.499 . . . . 3.12 107.948 177.206 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -50.23 -34.13 21.93 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.628 0.771 . . . . 4.49 111.354 -179.395 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -46.72 -46.83 20.52 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 122.89 0.476 . . . . 6.53 110.933 175.202 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 19.8 mt-10 -65.04 -44.15 90.04 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 108.149 -1.056 . . . . 5.02 108.149 -171.831 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 24.6 p -75.09 -27.09 59.75 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.157 -0.929 . . . . 2.31 111.682 -173.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.268 2.0 pp -74.89 -40.66 46.15 Favored 'Isoleucine or valine' 0 C--N 1.34 0.19 0 CA-C-N 119.47 1.032 . . . . 2.58 111.215 166.197 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -53.2 -56.84 13.27 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 119.305 0.957 . . . . 4.01 109.093 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.1 t -52.2 -42.35 63.44 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.048 0.451 . . . . 2.2 111.668 -173.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 19.8 m -79.3 -29.58 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 120.942 -1.099 . . . . 2.07 111.804 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 25.3 t -63.42 -41.65 93.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 119.041 0.837 . . . . 2.96 109.551 172.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . 0.255 9.8 t -67.2 -42.98 83.24 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.091 -0.957 . . . . 2.69 110.482 174.15 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 4.2 m -51.56 -56.63 12.43 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.855 1.661 . . . . 1.98 110.382 171.451 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -40.47 -62.0 0.84 Allowed 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 125.097 1.359 . . . . 5.83 110.189 172.742 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -64.81 -48.42 74.45 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.772 0.32 . . . . 3.57 111.596 -171.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 54.8 p -60.29 -35.54 75.79 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.07 0.548 . . . . 2.71 111.754 -178.571 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 -69.66 -54.66 12.82 Favored 'General case' 0 N--CA 1.458 -0.07 0 CA-C-O 121.325 0.583 . . . . 4.08 110.403 168.925 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.62 -18.48 64.96 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 126.199 1.8 . . . . 2.18 112.072 -166.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -52.55 -27.25 15.87 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 118.816 -0.611 . . . . 4.74 111.804 169.991 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.02 -68.9 0.17 Allowed 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 117.677 2.473 . . . . 3.02 117.677 -151.154 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -89.18 -76.85 0.4 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.209 0.913 . . . . 2.74 111.922 -161.013 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.16 167.43 29.11 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 127.722 2.582 . . . . 2.33 110.472 150.415 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 36.8 ttm180 53.63 101.13 0.01 OUTLIER 'General case' 0 C--O 1.238 0.458 0 C-N-CA 124.336 1.054 . . . . 4.62 113.81 136.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 14.7 pttm -60.5 -39.01 86.18 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 113.479 0.918 . . . . 4.68 113.479 -175.06 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -77.88 -19.25 55.11 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.343 0.868 . . . . 4.6 113.343 -168.755 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 96.8 p -130.32 160.52 33.69 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-N 119.544 1.065 . . . . 2.39 111.639 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 5.2 mp -113.22 161.84 16.71 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.281 1.032 . . . . 3.3 111.717 -179.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 15.2 m -140.97 170.45 15.72 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 127.095 2.158 . . . . 2.71 105.852 -178.519 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 33.0 m -88.91 54.07 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 O-C-N 121.279 -0.888 . . . . 3.94 112.024 -170.346 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -152.12 54.29 0.81 Allowed 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 105.934 -1.876 . . . . 2.13 105.934 141.818 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -160.56 -58.52 0.06 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 127.952 2.501 . . . . 1.73 104.722 -174.764 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -56.36 -60.01 4.13 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.741 -1.118 . . . . 3.45 110.309 177.599 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 41.3 tttm -58.66 -35.03 71.92 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.303 0.573 . . . . 4.7 109.565 -175.675 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . 0.288 16.3 mm-40 -63.01 -18.7 63.6 Favored 'General case' 0 N--CA 1.44 -0.954 0 N-CA-C 112.824 0.676 . . . . 5.27 112.824 -174.576 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 24.7 tp -62.24 -50.78 70.39 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.573 -0.899 . . . . 3.07 108.573 169.601 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 16.6 m -70.72 -42.73 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 109.816 -0.438 . . . . 2.14 109.816 -174.579 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 24.1 m -51.96 -55.22 21.69 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 122.688 0.395 . . . . 2.32 110.275 173.076 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -82.33 -58.72 2.81 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.835 1.05 . . . . 2.37 113.835 -168.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -79.57 -48.53 13.66 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.51 1.3 . . . . 3.89 114.51 -164.332 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -52.43 -38.78 59.93 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 115.69 1.737 . . . . 3.5 115.69 -148.725 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -63.94 -39.3 33.43 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.569 -1.846 . . . . 2.77 109.619 -58.888 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -89.09 -30.6 18.54 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.139 1.375 . . . . 4.68 112.365 -168.057 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 19.3 tp -47.57 -63.28 1.1 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.491 1.516 . . . . 2.2 111.405 -175.761 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 33.0 mt -93.09 72.42 4.65 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.372 -0.973 . . . . 2.32 108.372 163.13 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.9 147.29 0.22 Allowed 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.81 1.244 . . . . 6.25 110.305 174.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 32.0 t0 61.9 41.08 11.86 Favored 'General case' 0 C--N 1.343 0.286 0 N-CA-C 106.856 -1.535 . . . . 4.17 106.856 173.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 5.9 m 32.25 50.54 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 C-N-CA 127.748 2.419 . . . . 4.06 112.924 -172.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 65.07 19.16 65.61 Favored Glycine 0 CA--C 1.525 0.698 0 CA-C-O 118.718 -1.046 . . . . 8.67 114.174 174.094 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 5.6 p 42.22 61.24 2.04 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 118.288 1.044 . . . . 5.12 108.658 -168.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -45.51 -46.75 14.08 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 126.416 1.886 . . . . 2.49 112.648 -148.72 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -40.37 -47.72 2.59 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.598 1.959 . . . . 3.65 112.812 174.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -54.22 -60.47 3.29 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 109.332 -0.618 . . . . 4.63 109.332 176.39 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -44.69 95.84 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 118.458 -0.782 . . . . 6.02 109.242 -175.836 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 9.2 mtp -47.54 -60.89 2.22 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.586 1.085 . . . . 4.7 110.508 175.602 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -63.31 -36.8 84.89 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.382 -0.372 . . . . 4.92 110.546 -175.392 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 14.7 t -62.92 -41.28 99.4 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.015 0.526 . . . . 3.23 111.204 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 29.9 mt -77.19 -51.25 11.29 Favored 'General case' 0 CA--C 1.527 0.079 0 C-N-CA 125.317 1.447 . . . . 2.35 110.394 -172.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -53.39 -14.9 0.85 Allowed 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 116.615 2.08 . . . . 2.18 116.615 -165.834 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 17.8 m -36.43 -32.35 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 129.71 3.204 . . . . 2.82 117.468 -139.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -65.55 -12.61 54.49 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.352 0.978 . . . . 3.39 112.393 175.849 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 61.51 41.99 11.89 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 124.363 1.065 . . . . 3.95 113.012 167.336 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 48.9 p30 -91.92 -7.93 47.76 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.456 1.502 . . . . 2.21 111.48 163.103 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.0 m 65.31 10.14 6.24 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.985 1.314 . . . . 3.28 113.78 -172.072 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 35.5 mt-10 -99.44 154.12 18.46 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 108.447 -0.945 . . . . 2.9 108.447 167.001 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -111.81 93.51 4.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 106.215 -1.772 . . . . 2.27 106.215 168.971 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.69 178.98 7.72 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.412 0.685 . . . . 4.87 110.705 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 40.6 p90 -91.61 52.28 2.02 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.885 0.698 . . . . 5.77 112.885 -171.681 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -155.52 49.84 0.55 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 107.002 -1.481 . . . . 3.07 107.002 114.01 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -90.99 -60.88 1.8 Allowed 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 106.066 -1.828 . . . . 1.9 106.066 140.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 65.3 t80 -52.8 -49.74 65.01 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 124.103 0.961 . . . . 4.16 113.259 -168.323 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.407 ' CD2' ' HA2' ' A' ' 81' ' ' GLY . 0.3 OUTLIER -43.9 -34.32 1.61 Allowed 'General case' 0 C--N 1.341 0.233 0 O-C-N 123.786 0.679 . . . . 6.34 111.206 177.34 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . 0.401 ' HA ' ' CH2' ' A' ' 77' ' ' TRP . 45.3 mtp180 -51.84 -52.95 45.69 Favored 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 120.098 -0.641 . . . . 5.81 110.933 -175.835 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 3.2 tp -57.56 -28.04 63.2 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 118.251 -1.38 . . . . 2.62 110.811 -179.151 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 45.1 mt -71.84 -47.89 53.82 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.346 0 N-CA-C 107.041 -1.466 . . . . 3.01 107.041 -168.274 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.425 ' CA ' ' HE1' ' A' ' 77' ' ' TRP . . . -80.95 -27.99 47.74 Favored Glycine 0 N--CA 1.42 -2.37 0 CA-C-O 117.863 -1.521 . . . . 3.3 111.227 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -57.28 -47.45 81.42 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 105.264 -2.124 . . . . 3.39 105.264 -173.092 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 7.8 mp -38.54 -47.94 1.36 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.904 1.282 . . . . 3.83 113.173 174.283 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.74 -29.8 70.96 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.87 0.868 . . . . 2.53 111.573 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -80.28 -45.9 17.11 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 123.876 0.87 . . . . 2.38 111.24 167.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.39 -50.39 73.15 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.831 1.196 . . . . 3.57 108.193 -171.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 14.3 tt -50.49 -39.22 17.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 123.454 0.701 . . . . 2.16 111.651 174.506 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.66 -19.11 42.37 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.537 1.535 . . . . 4.46 112.598 -176.27 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 42.3 tttp -137.14 92.02 2.68 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.984 0.914 . . . . 6.23 111.888 -161.626 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 5.2 tmtp? -39.62 -59.45 1.13 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.589 1.956 . . . . 5.26 115.38 -169.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 2.4 pptp? -148.91 16.47 0.97 Allowed 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 113.556 0.947 . . . . 9.49 113.556 -165.809 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -125.36 118.22 25.43 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.654 -0.869 . . . . 4.67 108.654 -165.737 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 1.3 pp 176.41 -40.85 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 126.041 1.736 . . . . 6.02 109.321 -173.299 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 10.5 pttm -71.04 68.19 0.44 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.883 1.273 . . . . 8.05 112.043 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 4.9 tp -128.47 116.2 40.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 C-N-CA 124.666 1.186 . . . . 8.1 108.258 172.729 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 30.2 tpt180 -161.29 148.43 14.9 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 107.875 -1.157 . . . . 13.26 107.875 177.559 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 5.0 tmtp? -177.97 138.38 0.2 Allowed 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.08 1.752 . . . . 10.66 106.428 177.375 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 46.9 tptt . . . . . 0 C--O 1.257 1.461 0 N-CA-C 103.756 -2.683 . . . . 6.58 103.756 168.185 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.7 mmm . . . . . 0 N--CA 1.469 0.52 0 N-CA-C 108.324 -0.991 . . . . 8.51 108.324 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 177.87 172.68 0.61 Allowed 'General case' 0 C--O 1.231 0.118 0 C-N-CA 126.527 1.931 . . . . 3.69 106.665 -173.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 70.99 95.23 0.07 Allowed 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 126.349 1.86 . . . . 3.69 111.863 178.23 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -71.49 121.57 84.73 Favored Pre-proline 0 N--CA 1.442 -0.854 0 N-CA-C 108.61 -0.885 . . . . 5.95 108.61 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -70.14 141.15 42.97 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 121.951 1.767 . . . . 2.76 108.133 173.568 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 86.7 mt -99.1 163.73 12.45 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 108.325 -0.991 . . . . 2.59 108.325 -175.062 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.3 t -73.8 153.01 40.14 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 120.739 -1.225 . . . . 2.23 109.898 -175.631 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -45.07 -51.63 9.91 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 121.232 -0.918 . . . . 2.46 112.855 -174.279 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -58.9 -52.08 67.28 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 118.311 -0.852 . . . . 2.66 111.255 178.391 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -48.87 -55.05 12.82 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.083 2.153 . . . . 2.77 111.767 173.554 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -52.52 -52.31 55.29 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.164 0.985 . . . . 3.06 109.932 174.987 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.9 t -57.74 -50.6 72.68 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.385 0.674 . . . . 3.15 111.08 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.279 2.8 pp -62.61 -37.68 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 O-C-N 121.247 -0.908 . . . . 1.96 110.431 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -57.26 -59.4 5.16 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 119.344 0.974 . . . . 2.72 109.965 174.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.6 t -53.92 -40.78 67.02 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 118.986 0.812 . . . . 2.35 111.552 -172.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.1 m -76.34 -30.66 19.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 120.525 -1.359 . . . . 1.67 112.108 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.3 t -64.37 -44.69 97.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 119.679 1.127 . . . . 1.58 110.065 173.224 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.4 t -65.42 -42.25 92.7 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.46 -0.775 . . . . 1.74 110.242 175.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 50.5 m -55.5 -50.62 69.46 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.906 0.775 . . . . 2.37 110.147 173.678 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -48.25 -60.04 2.96 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 123.405 0.682 . . . . 4.42 110.089 172.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -52.93 -51.56 60.91 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.226 1.01 . . . . 4.77 111.571 -173.759 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.1 t -63.78 -25.15 68.05 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 118.493 -0.765 . . . . 3.36 112.17 -176.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -81.54 -42.84 19.59 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 118.951 0.796 . . . . 3.87 111.456 169.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -52.43 -40.25 61.98 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 120.872 -1.142 . . . . 2.02 110.671 -179.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -19.21 61.04 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 116.065 -1.921 . . . . 5.76 113.342 -178.804 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -45.0 -61.81 1.48 Allowed 'General case' 0 C--N 1.345 0.395 0 CA-C-N 120.758 1.617 . . . . 3.81 110.133 -168.505 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -128.77 96.74 4.46 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 126.348 1.859 . . . . 5.58 107.613 -177.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.38 149.83 0.11 Allowed Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.425 1.488 . . . . 1.99 114.334 167.325 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 51.92 82.43 0.07 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.134 0.974 . . . . 6.87 110.806 175.203 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -71.27 31.31 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.731 1.382 . . . . 4.34 114.731 -175.368 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -139.57 22.06 2.52 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.604 1.562 . . . . 4.51 108.657 167.828 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.8 m -154.82 140.48 17.99 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.925 -1.109 . . . . 3.84 113.165 -179.017 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.1 mp -103.94 117.36 34.13 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.14 1.376 . . . . 3.73 112.705 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.2 t -83.69 177.04 8.55 Favored 'General case' 0 C--O 1.227 -0.131 0 O-C-N 120.84 -1.162 . . . . 3.38 109.784 171.432 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.5 m -55.43 -50.18 67.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 112.903 0.705 . . . . 3.87 112.903 -163.695 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -62.37 -57.4 11.45 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 118.604 0.638 . . . . 3.92 109.781 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -38.1 -50.87 1.4 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.306 1.442 . . . . 2.15 110.787 173.864 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -58.64 -53.6 56.5 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 114.728 -1.124 . . . . 5.29 110.226 177.892 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -60.71 -37.21 80.91 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 120.618 -0.433 . . . . 4.08 110.06 -174.2 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -53.81 -37.45 63.56 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 119.076 -0.488 . . . . 3.63 110.937 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.8 tp -68.63 -45.72 71.11 Favored 'General case' 0 C--N 1.339 0.115 0 CA-C-N 119.881 1.219 . . . . 3.42 109.27 -177.948 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 10.2 m -69.42 -38.46 77.18 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.178 0 CA-C-O 121.457 0.646 . . . . 2.11 109.359 -173.668 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 74.8 m -69.42 -43.39 73.48 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 124.276 1.031 . . . . 2.47 110.224 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -80.14 -60.47 2.32 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.095 0.558 . . . . 2.58 111.783 -173.46 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.1 mm-40 -79.45 -37.75 36.24 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 118.407 -0.806 . . . . 3.91 113.011 -167.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.84 83.51 0.55 Allowed Pre-proline 0 N--CA 1.469 0.478 0 C-N-CA 125.127 1.371 . . . . 3.47 111.732 -165.119 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -64.81 -32.14 56.46 Favored 'Trans proline' 0 N--CA 1.449 -1.115 0 C-N-CA 122.659 2.239 . . . . 1.62 111.898 178.329 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.37 -3.36 0.42 Allowed 'General case' 0 C--N 1.347 0.487 0 N-CA-C 118.332 2.716 . . . . 6.36 118.332 -174.332 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 10.5 tp -58.89 -64.44 0.94 Allowed 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 120.536 1.516 . . . . 1.91 110.487 174.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 45.6 mt -78.67 -42.12 29.45 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 115.952 -0.567 . . . . 3.1 110.97 -175.613 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 28.5 40.66 0.0 OUTLIER 'General case' 0 C--N 1.343 0.305 0 C-N-CA 129.281 3.032 . . . . 5.03 114.603 -170.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -136.06 24.76 3.3 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.405 2.282 . . . . 5.05 109.236 -176.621 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.1 m -58.02 -28.94 35.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 124.405 1.082 . . . . 3.05 110.82 -178.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.16 -41.97 16.15 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 124.047 0.832 . . . . 2.06 111.877 172.61 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 87.3 p -104.43 34.23 3.19 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-N 117.979 0.889 . . . . 3.74 111.166 -177.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -54.47 -35.02 62.59 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 121.001 -1.062 . . . . 2.37 110.567 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -56.07 -40.35 73.44 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.395 -0.816 . . . . 4.16 111.954 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -69.2 -49.83 52.93 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 108.019 -1.104 . . . . 3.24 108.019 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.92 -42.78 65.7 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 109.328 -0.619 . . . . 3.27 109.328 177.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.5 tmm? -61.7 -52.53 63.9 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 124.686 1.194 . . . . 2.99 110.093 178.374 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -53.97 -38.93 65.52 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 118.744 -0.646 . . . . 3.83 111.906 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.1 t -60.79 -61.54 2.51 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-N 118.908 0.776 . . . . 3.24 109.198 168.75 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 28.5 mt -53.27 -61.31 2.38 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 125.29 1.436 . . . . 2.55 112.36 -166.769 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -72.13 88.77 1.12 Allowed 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.028 -0.73 . . . . 2.09 109.028 -171.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.9 m -49.07 -28.07 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 C-N-CA 124.299 1.04 . . . . 3.11 113.71 -175.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -104.56 -11.66 16.86 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.031 1.332 . . . . 3.36 112.845 178.407 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 52.69 50.4 18.22 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.473 1.109 . . . . 4.94 111.361 177.848 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.0 p30 -82.33 -20.62 37.0 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 109.077 -0.712 . . . . 1.65 109.077 166.739 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 78.95 26.57 0.45 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.244 1.418 . . . . 2.58 111.449 176.671 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -135.13 120.73 19.37 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 104.313 -2.477 . . . . 5.39 104.313 162.023 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -93.31 90.99 7.01 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.057 -1.46 . . . . 2.48 107.057 -168.037 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.0 pttt -76.22 169.59 17.93 Favored 'General case' 0 CA--C 1.528 0.113 0 O-C-N 123.147 0.279 . . . . 5.13 110.726 -178.024 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.2 p90 -36.66 -61.63 0.52 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.441 1.275 . . . . 7.83 114.441 -163.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.98 -26.56 54.05 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.539 1.063 . . . . 2.71 111.212 -175.148 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -64.98 -56.75 11.36 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 108.374 -0.973 . . . . 2.08 108.374 174.835 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -48.9 -54.93 13.34 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.871 1.268 . . . . 4.4 109.775 173.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 59.2 t90 -46.85 -41.89 16.44 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.955 0.902 . . . . 5.51 111.956 -168.799 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 23.6 ttp85 -45.06 -40.67 6.91 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 118.305 -0.855 . . . . 4.42 111.357 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 6.6 tp -45.09 -50.35 11.1 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 118.154 -0.927 . . . . 2.0 111.87 177.052 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 92.1 mt -58.81 -32.03 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 108.316 -0.994 . . . . 2.66 108.316 -176.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.527 ' CA ' ' CZ2' ' B' ' 77' ' ' TRP . . . -70.0 -50.14 30.63 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 127.072 2.273 . . . . 1.26 112.103 177.415 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -58.2 -62.9 1.49 Allowed 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 106.775 -1.565 . . . . 2.9 106.775 177.129 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . 0.262 4.3 pp -53.34 -37.42 62.31 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.301 0.955 . . . . 3.57 112.305 177.23 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.52 -62.11 1.9 Allowed 'General case' 0 C--N 1.342 0.245 0 CA-C-N 119.179 0.9 . . . . 2.19 111.073 173.855 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . 0.275 0.0 OUTLIER -70.2 -20.09 63.13 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 119.095 -1.042 . . . . 3.13 112.042 -174.75 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -56.31 -31.35 63.6 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 118.144 -0.931 . . . . 2.62 110.676 173.379 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.5 tt -58.81 -12.49 2.64 Favored 'Isoleucine or valine' 0 C--N 1.348 0.501 0 N-CA-C 113.417 0.895 . . . . 2.48 113.417 173.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 5.5 ptm85 -118.75 -38.43 3.11 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 118.918 0.781 . . . . 5.01 112.079 172.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.25 -47.5 10.73 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 116.565 2.061 . . . . 4.46 116.565 -177.028 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 24.3 tttm -65.33 -58.23 6.42 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 120.263 1.392 . . . . 11.39 111.367 -149.611 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.2 ttpm? -152.2 4.02 0.38 Allowed 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.215 1.006 . . . . 9.53 110.524 167.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -7.47 -107.09 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.68 1.592 . . . . 10.08 113.322 -139.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.5 tp -76.68 -65.02 0.99 Allowed 'General case' 0 N--CA 1.44 -0.973 0 C-N-CA 125.95 1.7 . . . . 16.28 106.783 176.531 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -132.38 111.38 11.27 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.975 1.31 . . . . 16.47 108.419 -177.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 0.332 42.5 pt 59.08 -63.96 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 C-N-CA 128.207 2.603 . . . . 9.88 115.965 175.2 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 170.26 96.11 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 105.377 -2.083 . . . . 15.88 105.377 -164.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -174.43 58.5 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 120.165 1.348 . . . . 11.31 114.301 -155.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . 2.426 0.2 OUTLIER . . . . . 0 C--O 1.253 1.25 0 CA-C-O 116.138 -1.887 . . . . 13.65 108.932 165.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.427 1.4 pmm? . . . . . 0 N--CA 1.466 0.339 0 N-CA-C 107.898 -1.149 . . . . 9.07 107.898 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -167.23 117.16 0.85 Allowed 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 118.428 -0.796 . . . . 6.77 109.836 173.131 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 23.14 99.11 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.602 1.334 . . . . 5.48 114.602 118.35 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -75.08 162.04 74.91 Favored Pre-proline 0 CA--C 1.548 0.876 0 CA-C-N 119.098 0.863 . . . . 5.6 109.831 171.027 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -78.56 155.51 27.91 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.819 3.013 . . . . 3.9 111.239 177.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 66.1 mt -155.77 -163.05 1.42 Allowed 'General case' 0 CA--C 1.555 1.141 0 N-CA-C 112.675 0.62 . . . . 4.5 112.675 -151.651 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' THR . . . . . 0.457 HG21 ' CG ' ' B' ' 10' ' ' GLU . 2.2 t -66.51 178.04 1.37 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.451 1.501 . . . . 2.12 111.224 178.226 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -59.26 -61.54 2.55 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.436 -0.79 . . . . 2.69 112.387 -175.174 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 14.4 mt -53.63 -43.61 68.84 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.162 -0.961 . . . . 2.47 111.68 175.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . 0.457 ' CG ' HG21 ' B' ' 7' ' ' THR . 69.5 mt-10 -53.73 -48.19 69.87 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 124.761 1.225 . . . . 3.54 111.785 175.45 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -59.15 -46.99 86.93 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 120.609 -1.307 . . . . 4.52 109.772 173.669 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 16.1 m -57.44 -43.78 84.17 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.479 0.712 . . . . 2.45 110.977 -175.433 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.256 2.3 pp -67.05 -41.32 87.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.149 0 CA-C-O 118.479 -0.772 . . . . 2.17 111.385 172.042 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -53.49 -56.75 14.37 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.258 0.935 . . . . 2.4 110.661 178.383 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.9 t -49.33 -45.8 45.97 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 118.996 0.816 . . . . 2.31 111.968 -174.373 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 20.3 m -72.62 -38.18 58.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 O-C-N 120.808 -1.182 . . . . 1.82 111.395 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 43.8 t -58.04 -41.28 80.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 O-C-N 121.823 -0.548 . . . . 1.93 110.218 174.179 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . 0.257 11.9 t -70.64 -41.23 72.43 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 118.205 -0.902 . . . . 2.03 111.257 176.456 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 4.0 m -51.21 -52.43 44.58 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-N 120.649 1.568 . . . . 1.76 109.991 171.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 25.2 t80 -51.9 -61.07 2.49 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.362 0.665 . . . . 5.44 110.09 174.818 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -61.74 -40.92 96.79 Favored 'General case' 0 C--N 1.334 -0.107 0 C-N-CA 123.463 0.705 . . . . 4.7 111.517 -168.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 41.1 p -60.96 -60.09 4.35 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.474 -0.565 . . . . 3.4 109.474 173.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -57.99 -35.12 70.76 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.417 0.553 . . . . 4.99 111.346 -174.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.04 -29.31 43.38 Favored 'General case' 0 CA--C 1.513 -0.448 0 C-N-CA 127.182 2.193 . . . . 2.03 110.929 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -47.06 -34.31 5.71 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 124.241 0.963 . . . . 5.29 111.873 175.527 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.84 -66.55 0.48 Allowed 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 115.963 1.838 . . . . 2.04 115.963 -146.845 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -91.2 -75.89 0.46 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 119.24 -0.984 . . . . 3.03 113.089 -167.637 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.44 156.19 23.18 Favored Glycine 0 C--N 1.338 0.667 0 C-N-CA 127.394 2.426 . . . . 3.02 109.666 160.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 47.4 102.37 0.0 OUTLIER 'General case' 0 C--O 1.242 0.684 0 N-CA-C 114.775 1.398 . . . . 5.57 114.775 144.316 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -71.5 47.28 0.12 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.13 1.372 . . . . 4.91 112.867 176.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -157.24 -51.69 0.07 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.674 0.79 . . . . 3.17 109.448 -173.409 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 33.9 p -85.36 146.39 27.03 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 123.126 0.57 . . . . 1.93 110.366 172.461 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -92.5 178.41 5.82 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 108.2 -1.037 . . . . 3.08 108.2 164.013 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 34' ' ' SER . . . . . 0.41 ' C ' ' O ' ' B' ' 35' ' ' VAL . 28.0 m -154.23 -175.98 5.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 122.077 0.941 . . . . 3.11 110.46 -143.553 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.41 ' O ' ' C ' ' B' ' 34' ' ' SER . 21.7 t -73.18 -166.15 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 N-CA-C 100.781 -3.785 . . . . 3.73 100.781 141.275 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.47 51.85 1.93 Allowed 'General case' 0 CA--C 1.552 1.057 0 O-C-N 116.709 -3.744 . . . . 3.92 113.114 -111.038 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -61.58 -59.41 5.25 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 126.796 2.038 . . . . 1.7 108.887 125.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.455 ' CZ ' ' CD2' ' B' ' 76' ' ' TYR . 0.4 OUTLIER -54.96 -44.42 74.35 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 119.727 -0.789 . . . . 3.43 111.786 -163.252 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.87 -35.36 68.83 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.477 -0.764 . . . . 3.84 111.806 176.965 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -56.39 -31.98 64.37 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.474 0.579 . . . . 3.1 111.726 177.002 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -64.43 -55.11 23.07 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 119.294 0.952 . . . . 3.7 108.648 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 13.8 m -69.05 -38.47 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 114.486 -1.233 . . . . 2.06 109.256 -170.208 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 85.5 m -63.63 -57.67 9.33 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.328 1.051 . . . . 2.05 110.958 174.09 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -76.01 -60.79 2.17 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 122.136 -0.353 . . . . 2.46 111.025 -165.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.81 -47.37 12.93 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 122.314 -0.241 . . . . 3.16 111.096 -171.596 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 2.1 tp -84.3 -16.44 0.23 Allowed Pre-proline 0 CA--C 1.544 0.738 0 N-CA-C 120.893 3.664 . . . . 2.92 120.893 -151.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -44.4 -50.97 7.45 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 123.51 2.806 . . . . 2.59 116.053 -143.576 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 42.6 t-80 -76.91 48.95 0.62 Allowed 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.777 0.717 . . . . 4.38 112.215 -176.39 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 13.2 tp -150.99 -61.62 0.18 Allowed 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 124.257 1.023 . . . . 1.96 109.738 179.02 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 96.7 mt -109.59 112.37 24.42 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.378 -0.971 . . . . 2.13 108.378 169.334 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.3 -165.06 0.71 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 108.779 -0.823 . . . . 5.83 108.779 170.709 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 64.64 24.84 13.03 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.849 1.26 . . . . 3.97 110.626 169.892 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 33.0 m -61.62 -18.94 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 125.009 1.324 . . . . 2.42 113.03 -168.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.15 -52.85 49.35 Favored Glycine 0 CA--C 1.53 1.016 0 N-CA-C 110.305 -1.118 . . . . 3.23 110.305 168.096 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 22.6 t -81.29 34.66 0.37 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.797 1.239 . . . . 2.86 111.534 -171.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -60.03 -25.19 65.12 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.201 1.4 . . . . 2.23 110.246 -174.319 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -52.29 -33.01 40.25 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.113 1.365 . . . . 3.37 113.215 173.04 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -58.25 -44.67 88.44 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 120.044 1.293 . . . . 3.46 109.049 175.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -70.73 -49.18 49.73 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 107.419 -1.326 . . . . 5.09 107.419 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 13.9 tpt -39.68 -55.89 1.81 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.687 1.13 . . . . 3.43 110.615 176.032 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -60.92 -52.46 64.95 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.592 -0.276 . . . . 4.13 111.088 178.435 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.2 m -58.62 -30.37 67.21 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.082 0.771 . . . . 2.42 113.082 -178.915 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . 0.413 HD12 ' CE2' ' B' ' 38' ' ' PHE . 60.3 mt -81.67 -55.28 4.75 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 126.183 1.793 . . . . 2.38 109.855 -176.545 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.26 2.9 t70 -68.72 -10.96 59.47 Favored 'General case' 0 C--O 1.218 -0.602 0 N-CA-C 115.083 1.512 . . . . 2.23 115.083 -170.163 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 18.9 m -31.98 -23.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 N-CA-C 120.069 3.359 . . . . 2.78 120.069 -134.888 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -51.43 -34.38 34.67 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 121.106 1.776 . . . . 3.63 110.223 157.455 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 65.48 47.5 2.25 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.993 1.317 . . . . 3.56 109.163 174.132 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 27.2 p30 -76.9 -29.13 55.6 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.188 -0.915 . . . . 1.93 108.815 168.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 4.0 m 96.14 -5.98 0.08 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 128.25 2.62 . . . . 2.94 113.503 178.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -101.68 119.13 38.29 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 107.094 -1.447 . . . . 2.77 107.094 170.389 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.23 112.33 20.65 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.696 -1.224 . . . . 2.16 107.696 178.752 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.43 173.35 11.58 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.932 2.093 . . . . 3.61 110.719 -177.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -82.72 52.73 2.18 Favored 'General case' 0 C--N 1.345 0.407 0 O-C-N 121.08 -1.013 . . . . 5.07 111.004 176.675 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -169.58 48.07 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 106.498 -1.667 . . . . 2.79 106.498 125.655 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -97.38 -64.18 1.06 Allowed 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 119.841 -1.787 . . . . 1.98 109.265 152.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.455 ' CD2' ' CZ ' ' B' ' 38' ' ' PHE . 22.6 t80 -49.07 -48.71 43.89 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 125.327 1.451 . . . . 3.93 110.138 -177.039 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 0.7 OUTLIER -53.28 -31.64 44.76 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.494 -1.23 . . . . 5.88 110.886 -169.626 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . 0.404 ' HB2' ' CD2' ' B' ' 63' ' ' LEU . 28.4 mmt180 -40.16 -46.71 2.27 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.951 0.9 . . . . 5.26 112.283 170.863 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 2.8 tp -54.45 -37.18 64.87 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 117.908 0.322 . . . . 2.23 110.886 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 84.3 mt -63.85 -32.93 58.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 108.31 -0.996 . . . . 2.39 108.31 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.54 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -72.24 -40.88 54.78 Favored Glycine 0 CA--C 1.491 -1.459 0 C-N-CA 124.523 1.059 . . . . 1.75 110.688 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mm-40 -64.67 -64.92 0.75 Allowed 'General case' 0 N--CA 1.433 -1.308 0 N-CA-C 106.075 -1.824 . . . . 2.25 106.075 177.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 3.8 pp -55.44 -34.58 64.58 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 118.533 0.606 . . . . 2.92 112.341 -173.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.65 -62.13 2.08 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 118.346 0.521 . . . . 1.99 111.042 170.127 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.302 0.0 OUTLIER -63.41 -30.63 71.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 118.219 -0.896 . . . . 3.1 111.428 -173.574 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -54.21 -26.14 26.79 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.15 0.98 . . . . 2.86 111.952 177.156 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 3.5 tt -59.4 -38.28 74.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 119.802 1.183 . . . . 2.06 110.834 172.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -82.35 -41.84 19.49 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.6 1.96 . . . . 4.65 110.583 176.747 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.32 114.61 26.42 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 126.442 1.897 . . . . 5.79 111.011 -165.981 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -63.98 -39.27 93.75 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.735 -0.603 . . . . 5.8 110.61 167.961 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -162.82 -2.62 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.21 1.004 . . . . 6.88 113.434 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -80.56 56.58 2.64 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.894 1.225 . . . . 4.75 111.598 -177.229 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . 0.475 ' CG ' ' H ' ' B' ' 94' ' ' LYS . 0.3 OUTLIER -84.16 -94.11 0.07 Allowed 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 107.805 -1.183 . . . . 6.17 107.805 168.869 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . 0.475 ' H ' ' CG ' ' B' ' 93' ' ' LEU . 0.0 OUTLIER 68.47 159.09 0.16 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 127.422 2.289 . . . . 8.95 111.615 176.176 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -145.49 147.38 18.66 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 106.908 -1.515 . . . . 8.67 106.908 173.74 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -167.03 119.54 0.95 Allowed 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 107.386 -1.339 . . . . 6.98 107.386 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -176.62 136.02 0.24 Allowed 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 106.186 -1.783 . . . . 9.32 106.186 -178.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 10.8 tptp . . . . . 0 C--O 1.253 1.239 0 N-CA-C 104.36 -2.459 . . . . 6.66 104.36 166.201 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.8 mtt . . . . . 0 N--CA 1.469 0.478 0 N-CA-C 109.477 -0.564 . . . . 6.91 109.477 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.73 62.35 7.41 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.325 0.65 . . . . 4.35 110.669 -175.106 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 51.59 57.32 6.69 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.258 1.423 . . . . 7.07 113.202 170.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -91.42 -66.3 0.13 Allowed Pre-proline 0 CA--C 1.538 0.502 0 C-N-CA 124.431 1.092 . . . . 7.59 110.969 -173.127 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -71.64 161.98 43.57 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 CA-C-N 121.05 1.411 . . . . 4.39 109.727 170.406 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.5 mt -130.62 -157.9 0.85 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.716 1.606 . . . . 3.22 108.344 -171.351 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 57.3 m -60.55 144.79 50.75 Favored 'General case' 0 C--O 1.224 -0.243 0 O-C-N 120.506 -1.371 . . . . 4.72 109.909 176.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -35.58 -66.86 0.18 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.948 1.299 . . . . 3.7 111.756 170.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.21 -32.69 74.15 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.377 -1.297 . . . . 3.45 113.022 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -52.91 -49.5 65.82 Favored 'General case' 0 C--N 1.347 0.477 0 CA-C-N 120.855 1.661 . . . . 2.25 111.515 168.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -49.5 -51.77 34.04 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 108.493 -0.929 . . . . 3.08 108.493 175.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.5 m -60.43 -53.14 61.1 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.647 -0.706 . . . . 2.35 111.862 -175.667 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.272 2.7 pp -64.88 -38.49 82.9 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 O-C-N 121.577 -0.702 . . . . 1.99 109.741 -176.513 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -62.47 -50.13 72.65 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.645 -0.66 . . . . 3.03 111.222 175.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 t -58.93 -34.65 71.96 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.073 0.851 . . . . 2.35 111.749 -173.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 23.0 m -77.13 -41.44 30.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 O-C-N 121.171 -0.956 . . . . 1.62 110.878 174.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.9 t -53.91 -47.7 63.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 118.923 0.783 . . . . 1.77 110.81 175.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.9 t -62.67 -43.16 99.51 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.454 -0.779 . . . . 1.93 110.897 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 39.1 m -59.9 -50.2 74.7 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.877 -0.514 . . . . 2.18 109.689 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -47.73 -56.93 6.26 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.461 0.705 . . . . 4.27 110.585 169.35 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -60.3 -45.32 93.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.077 0.551 . . . . 4.59 111.178 -169.757 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.4 t -61.31 -32.36 72.22 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 120.061 -0.656 . . . . 3.63 110.789 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -70.19 -43.95 69.69 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-N 119.432 1.015 . . . . 4.34 110.72 168.395 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.13 -38.59 39.76 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 124.748 1.219 . . . . 1.59 111.797 -171.271 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.8 ptt85 -75.63 -20.45 58.5 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 117.563 -1.208 . . . . 5.22 113.877 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -47.77 -57.9 5.01 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 120.1 1.318 . . . . 2.84 112.898 -166.537 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -120.66 93.57 4.08 Favored 'General case' 0 C--O 1.242 0.704 0 C-N-CA 128.541 2.736 . . . . 3.13 106.08 -171.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 48.59 -174.19 0.03 OUTLIER Glycine 0 CA--C 1.526 0.736 0 C-N-CA 125.699 1.619 . . . . 1.72 112.37 -176.361 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.3 mmt-85 29.74 97.46 0.0 OUTLIER 'General case' 0 C--O 1.24 0.596 0 C-N-CA 126.09 1.756 . . . . 5.45 112.846 164.629 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . 0.479 ' HZ2' ' CG ' ' A' ' 31' ' ' ASP . 0.0 OUTLIER -78.53 40.87 0.38 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.598 1.559 . . . . 6.44 109.167 177.749 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.479 ' CG ' ' HZ2' ' A' ' 30' ' ' LYS . 5.7 m-20 -154.81 -51.87 0.09 Allowed 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 106.285 -1.746 . . . . 4.97 106.285 -145.305 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.5 p -115.16 139.3 50.03 Favored 'General case' 0 C--O 1.246 0.889 0 C-N-CA 125.566 1.546 . . . . 2.94 111.097 172.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -101.4 117.64 35.35 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 113.727 -1.579 . . . . 3.6 108.241 -176.846 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 19.0 m -88.35 174.98 7.84 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.074 1.75 . . . . 2.56 110.999 178.776 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.5 m -58.82 -48.82 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 O-C-N 121.395 -0.816 . . . . 3.94 112.979 -172.654 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -68.35 -47.38 67.62 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-O 118.4 -0.81 . . . . 2.95 109.518 -178.262 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -41.81 -46.91 4.04 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.059 0.845 . . . . 2.1 112.02 168.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -56.71 -59.99 4.21 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.168 0.587 . . . . 4.24 110.602 172.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -57.93 -41.18 82.23 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.491 0.716 . . . . 3.54 111.32 -172.621 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -47.84 -40.63 21.85 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.137 0.975 . . . . 3.19 112.122 174.057 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.32 -52.47 65.49 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 119.617 1.098 . . . . 4.05 108.113 -178.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.1 m -72.94 -50.87 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 CA-C-N 114.919 -1.037 . . . . 2.49 109.703 -169.498 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.2 m -57.36 -44.31 84.27 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 125.401 1.48 . . . . 2.56 111.656 178.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -60.22 -62.34 1.94 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.78 0.718 . . . . 3.74 110.999 -173.284 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -145.15 38.53 1.17 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.493 0.923 . . . . 5.36 113.493 -173.033 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -129.13 31.75 0.22 Allowed Pre-proline 0 CA--C 1.549 0.934 0 N-CA-C 116.074 1.879 . . . . 2.91 116.074 178.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -62.38 -60.52 0.19 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.852 2.368 . . . . 2.65 114.232 -165.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -66.3 -37.96 86.63 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 121.337 -0.852 . . . . 5.37 111.421 -175.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.416 ' CD2' ' HB2' ' A' ' 83' ' ' LEU . 22.5 tp -65.66 -54.32 29.11 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.993 0.517 . . . . 2.45 110.027 -173.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.5 mt -107.63 87.71 2.56 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-O 121.841 0.829 . . . . 2.5 109.533 169.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.69 160.35 0.66 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 113.981 -1.463 . . . . 6.48 111.645 170.999 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 57.53 39.66 27.62 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.205 1.002 . . . . 5.39 111.098 168.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -41.28 -34.57 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 128.186 2.594 . . . . 3.72 112.658 177.073 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -39.75 -48.69 3.23 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.153 0.883 . . . . 1.91 112.006 174.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.6 t -91.95 20.72 5.49 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.763 0.825 . . . . 2.54 113.226 -172.509 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -39.2 -46.38 1.48 Allowed 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 125.642 1.577 . . . . 2.27 111.897 173.854 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -49.94 -37.5 32.22 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.932 2.093 . . . . 4.56 111.75 -174.443 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -58.49 -52.9 63.67 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 121.535 0.683 . . . . 2.96 109.781 173.456 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -49.51 76.05 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 107.933 -1.136 . . . . 3.64 107.933 -178.8 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -49.51 -54.6 17.02 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.414 0.686 . . . . 2.52 110.651 177.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -59.83 -43.78 94.41 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 122.346 -0.221 . . . . 3.74 111.203 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.6 t -60.24 -44.1 95.53 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.831 0.824 . . . . 2.47 111.185 178.18 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 11.0 mt -64.69 -46.3 82.96 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.531 1.133 . . . . 3.25 110.601 -179.046 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -69.11 77.0 0.34 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.439 1.096 . . . . 1.64 110.629 -177.04 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.0 m -46.15 -43.35 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 C-N-CA 124.673 1.189 . . . . 2.49 113.648 -172.758 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -96.82 6.6 48.36 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.436 0.694 . . . . 2.81 112.254 -176.239 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 37.5 56.8 1.42 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.831 2.053 . . . . 3.76 112.189 -177.941 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 50.6 p30 -94.42 -5.92 45.22 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.929 1.292 . . . . 1.63 110.565 177.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.9 m 67.8 19.94 9.49 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.892 1.277 . . . . 2.24 111.583 -174.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -131.03 109.39 10.47 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.685 -1.598 . . . . 3.03 106.685 174.567 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . 0.422 ' N ' ' CD2' ' A' ' 71' ' ' LEU . 0.1 OUTLIER -83.53 105.39 14.42 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 103.86 -2.644 . . . . 2.12 103.86 171.838 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 164.86 1.24 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 108.71 -0.848 . . . . 4.84 108.71 169.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -38.05 -60.55 0.74 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.923 1.289 . . . . 5.94 110.98 175.495 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -67.78 -26.64 66.2 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.229 1.012 . . . . 2.07 112.264 -175.367 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -73.36 -59.07 2.88 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.804 0.729 . . . . 2.16 109.067 174.749 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -51.8 -47.86 64.08 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 109.422 -0.584 . . . . 3.77 109.422 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.675 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 55.4 t90 -46.5 -39.53 10.95 Favored 'General case' 0 N--CA 1.44 -0.94 0 O-C-N 124.312 1.007 . . . . 5.42 111.528 -175.808 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 70.6 mtt180 -43.43 -40.99 4.04 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.676 0.671 . . . . 4.84 112.756 175.014 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 28.7 tp -52.55 -44.64 65.97 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.065 0.546 . . . . 2.07 111.149 179.036 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 55.1 mt -60.23 -28.34 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 N-CA-C 108.0 -1.111 . . . . 2.66 108.0 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.587 ' CA ' ' CZ2' ' B' ' 77' ' ' TRP . . . -68.88 -52.76 22.68 Favored Glycine 0 CA--C 1.492 -1.367 0 C-N-CA 126.547 2.022 . . . . 1.32 111.896 178.978 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.43 -59.71 5.01 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 105.792 -1.929 . . . . 2.38 105.792 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.416 ' HB2' ' CD2' ' A' ' 49' ' ' LEU 0.298 4.3 pp -54.35 -38.43 66.07 Favored 'General case' 0 CA--C 1.551 1.015 0 O-C-N 121.339 -0.851 . . . . 3.12 112.768 179.016 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.84 -29.01 70.41 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.091 -1.005 . . . . 2.37 113.528 175.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -81.06 -44.16 18.42 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.601 1.56 . . . . 2.64 109.691 174.784 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -63.29 -25.73 68.45 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.82 1.248 . . . . 2.59 111.162 -175.346 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.4 tt -48.23 -34.37 4.85 Favored 'Isoleucine or valine' 0 C--N 1.344 0.34 0 CA-C-N 119.259 0.936 . . . . 2.36 112.825 167.725 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 38.1 ttp180 -96.51 -48.6 5.48 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.611 1.164 . . . . 6.13 108.669 177.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -65.93 -14.61 61.87 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.527 0.936 . . . . 3.82 113.527 -173.197 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 7.0 pttt -49.89 -28.96 7.32 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 120.893 -1.129 . . . . 10.26 111.342 164.061 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . 2.224 26.2 ttmt 7.97 -77.0 0.0 OUTLIER 'General case' 0 C--O 1.235 0.308 0 N-CA-C 118.029 2.603 . . . . 15.05 118.029 135.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -140.16 -83.36 0.24 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.125 -1.398 . . . . 6.07 107.605 -115.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 48.7 tp -80.4 67.89 6.39 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 124.228 1.011 . . . . 9.23 108.975 -178.857 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 57.9 mttp 88.47 98.41 0.03 OUTLIER 'General case' 0 C--N 1.334 -0.079 0 C-N-CA 126.982 2.113 . . . . 11.05 110.179 161.411 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.9 mp -51.93 -66.14 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 124.95 1.3 . . . . 8.51 109.116 -175.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 36.55 70.21 0.17 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.496 1.919 . . . . 18.36 111.745 176.357 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.59 136.21 0.15 Allowed 'General case' 0 C--O 1.232 0.144 0 C-N-CA 126.933 2.093 . . . . 12.26 107.143 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.529 -0.748 . . . . 16.71 109.542 171.513 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 83.5 mtp . . . . . 0 N--CA 1.471 0.603 0 N-CA-C 107.375 -1.343 . . . . 10.17 107.375 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.427 . . 54.27 -150.48 0.39 Allowed 'General case' 0 CA--C 1.534 0.364 0 O-C-N 123.545 0.528 . . . . 7.48 110.578 -171.127 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 74.26 101.28 0.07 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.324 1.449 . . . . 6.77 112.025 172.647 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . 0.341 9.5 tt0 -101.83 -115.04 0.0 OUTLIER Pre-proline 0 CA--C 1.558 1.253 0 CA-C-O 114.843 -2.503 . . . . 7.42 110.967 -172.759 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -90.1 163.19 4.79 Favored 'Trans proline' 0 C--N 1.36 1.146 0 CA-C-N 124.554 2.662 . . . . 4.4 110.651 179.516 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.9 mt -139.81 -53.28 0.53 Allowed 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 113.759 1.022 . . . . 5.3 113.759 -155.385 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 6.8 t -170.09 -175.41 2.0 Allowed 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 120.204 1.366 . . . . 3.29 110.989 -172.937 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 70.8 tt0 -71.42 -67.25 0.53 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.848 1.204 . . . . 2.71 112.118 -167.107 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 11.9 mt -48.97 -42.34 37.31 Favored 'General case' 0 C--N 1.34 0.196 0 O-C-N 121.615 -0.678 . . . . 2.28 110.793 173.815 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 11.3 tm-20 -48.94 -61.29 2.14 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 117.76 -1.114 . . . . 5.84 112.472 169.223 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -51.51 -41.6 61.11 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 121.402 1.91 . . . . 3.75 109.946 178.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.2 t -61.83 -30.4 70.81 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 118.334 -0.841 . . . . 2.58 112.839 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.284 2.7 pp -80.51 -35.68 15.4 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 119.842 1.201 . . . . 2.18 110.892 167.341 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -52.38 -53.32 46.33 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 108.066 -1.087 . . . . 3.03 108.066 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 7.8 t -55.02 -35.4 64.38 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.115 0.783 . . . . 1.95 113.115 -175.454 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 20.0 m -80.11 -37.09 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 O-C-N 120.807 -1.183 . . . . 1.79 110.172 175.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 43.4 t -58.65 -45.57 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 123.807 0.843 . . . . 1.93 110.593 177.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 8.9 t -60.79 -44.08 97.29 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 119.853 1.206 . . . . 2.34 110.609 175.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 23.1 m -57.77 -52.16 66.61 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 119.094 0.861 . . . . 1.63 109.733 178.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -46.83 -60.88 2.13 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.186 1.394 . . . . 5.17 110.968 171.281 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -59.49 -49.72 76.68 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.977 1.311 . . . . 4.17 110.975 -171.804 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 34.6 p -56.15 -56.68 17.96 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 118.915 -0.564 . . . . 2.83 109.819 177.886 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -52.71 -47.24 67.43 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 119.099 0.863 . . . . 4.06 111.338 175.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.39 -29.7 58.99 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.366 1.467 . . . . 1.99 110.653 -175.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.07 -21.25 58.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 117.435 -1.269 . . . . 6.31 113.289 177.48 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.08 -65.03 0.71 Allowed 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 118.148 -1.421 . . . . 2.08 114.56 -156.703 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -88.41 -80.21 0.29 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 119.279 -0.968 . . . . 3.48 112.774 -162.732 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.34 170.05 29.62 Favored Glycine 0 C--N 1.34 0.774 0 C-N-CA 128.802 3.096 . . . . 2.91 110.834 148.689 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 61.29 87.58 0.09 Allowed 'General case' 0 C--O 1.241 0.622 0 N-CA-C 112.283 0.475 . . . . 5.76 112.283 140.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -74.83 52.72 0.55 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 125.631 1.572 . . . . 4.43 110.833 174.997 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -161.94 -58.74 0.05 OUTLIER 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 107.842 -1.17 . . . . 3.92 107.842 -172.013 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 17.1 m -96.66 142.27 28.9 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 124.135 0.974 . . . . 3.55 110.486 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -83.18 131.96 35.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.313 1.045 . . . . 3.28 109.058 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 1.3 p -114.8 174.44 5.97 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.848 1.259 . . . . 3.51 108.724 171.988 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.81 51.23 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.338 0.087 0 O-C-N 121.255 -0.903 . . . . 3.37 111.143 -170.229 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -155.2 53.74 0.63 Allowed 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 105.416 -2.068 . . . . 2.03 105.416 145.247 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -149.24 -54.45 0.17 Allowed 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 130.683 3.593 . . . . 2.01 104.527 173.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.48 -55.11 28.05 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.174 -0.921 . . . . 3.69 109.192 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 42.5 tttt -61.21 -41.73 97.36 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 120.296 -0.561 . . . . 3.92 111.118 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 83.4 mt-10 -51.41 -40.39 59.22 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 118.134 0.425 . . . . 3.11 111.587 177.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 10.2 tt -67.98 -47.3 68.94 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 109.15 -0.685 . . . . 2.83 109.15 -175.3 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.4 m -68.52 -47.82 75.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 109.873 -0.417 . . . . 2.18 109.873 -176.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 55.8 m -60.29 -55.26 35.83 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.381 1.072 . . . . 2.16 111.501 178.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -79.02 -58.81 3.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 118.25 0.477 . . . . 2.66 110.52 -171.851 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -80.98 -50.67 9.41 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 121.203 0.525 . . . . 2.94 110.387 -166.602 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.79 -16.93 0.23 Allowed Pre-proline 0 CA--C 1.543 0.702 0 N-CA-C 120.158 3.392 . . . . 3.15 120.158 -163.53 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -39.91 -50.69 3.26 Favored 'Trans proline' 0 CA--C 1.532 0.386 0 C-N-CA 125.038 3.825 . . . . 3.13 116.841 -134.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 13.2 t-160 -66.46 -30.94 71.39 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.968 0.729 . . . . 3.11 112.968 -172.944 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 29.2 tp -67.64 -73.49 0.14 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.573 0.624 . . . . 2.08 110.096 -170.378 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 60.6 mt -79.42 78.96 5.91 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 108.218 -1.03 . . . . 2.07 108.218 170.166 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.18 169.91 0.76 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.67 -0.695 . . . . 5.58 110.243 167.588 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 66.85 40.03 3.23 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.233 1.413 . . . . 4.76 109.602 -167.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 27.3 m -59.78 -24.3 28.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 C-N-CA 124.188 0.995 . . . . 2.97 111.854 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.6 -67.03 2.28 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 109.408 -1.477 . . . . 2.87 109.408 171.636 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.8 m -72.02 61.73 0.44 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 127.032 2.133 . . . . 3.83 111.292 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -80.9 -37.62 29.39 Favored 'General case' 0 N--CA 1.439 -1.019 0 C-N-CA 124.449 1.1 . . . . 1.87 109.178 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -54.63 -49.76 69.75 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.55 0.74 . . . . 3.53 111.342 -175.766 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.63 -38.39 81.22 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 121.872 -0.517 . . . . 4.12 111.348 176.686 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.23 -54.13 48.05 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.352 0.661 . . . . 4.71 109.392 176.595 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -52.75 -52.68 55.44 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 126.321 1.848 . . . . 2.36 110.136 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 77.3 mttt -58.33 -45.96 87.1 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.183 0.593 . . . . 5.17 110.358 178.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 12.3 t -57.96 -44.72 87.2 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.095 0.558 . . . . 2.49 110.551 177.994 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 22.9 mt -63.42 -45.03 92.83 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.136 0.575 . . . . 2.78 111.356 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.328 16.1 t0 -51.66 -8.35 0.06 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 118.799 2.888 . . . . 2.11 118.799 -169.202 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 26.9 m -34.07 -19.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.539 1 C-N-CA 131.982 4.113 . . . . 2.63 119.276 -137.099 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -36.62 62.79 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 120.366 1.439 . . . . 3.95 109.656 160.901 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 66.62 63.51 0.5 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 125.586 1.555 . . . . 4.42 109.268 -171.226 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 30.0 p30 -120.35 -16.13 8.48 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.859 2.063 . . . . 2.45 112.668 -175.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.5 m 70.87 22.37 4.74 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.247 1.819 . . . . 3.31 113.093 -176.85 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -128.5 112.44 14.34 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.16 -1.793 . . . . 3.37 106.16 166.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -81.02 110.57 16.68 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 106.403 -1.703 . . . . 2.57 106.403 174.781 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 10.5 tppt? -79.0 168.66 19.37 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.518 -0.919 . . . . 4.47 108.518 -173.834 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 20.0 p90 -91.26 50.42 1.75 Allowed 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.999 -0.438 . . . . 6.7 110.314 174.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -156.7 48.43 0.46 Allowed 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 106.661 -1.607 . . . . 2.6 106.661 119.158 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -94.65 -62.12 1.38 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.897 1.679 . . . . 2.62 109.078 142.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -44.91 -48.73 11.26 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 125.883 1.673 . . . . 4.14 110.078 -173.451 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.675 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 4.1 t-105 -44.74 -37.13 3.55 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.627 -1.178 . . . . 5.81 111.76 -178.985 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 1.7 ttt85 -40.11 -47.26 2.32 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 119.987 1.267 . . . . 7.73 110.864 174.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 15.8 tp -44.19 -47.07 9.16 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.637 0.775 . . . . 2.07 110.599 -178.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 53.9 mt -62.76 -34.0 63.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.988 0.899 . . . . 2.68 109.559 -173.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.572 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -72.53 -42.81 46.86 Favored Glycine 0 CA--C 1.487 -1.7 0 N-CA-C 109.544 -1.423 . . . . 1.85 109.544 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.262 5.0 mm-40 -67.07 -48.41 68.34 Favored 'General case' 0 N--CA 1.421 -1.882 0 N-CA-C 105.535 -2.024 . . . . 3.29 105.535 -175.819 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 7.7 mt -42.9 -58.07 2.55 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 121.262 1.846 . . . . 3.47 111.896 166.864 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.42 -23.46 49.62 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.618 0.767 . . . . 2.02 112.536 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.01 -57.21 3.74 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.453 1.101 . . . . 3.18 110.581 170.47 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -57.53 -28.03 63.13 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 129.01 2.924 . . . . 2.79 111.68 -168.11 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 2.9 tt -49.58 -44.17 18.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 O-C-N 122.014 -0.429 . . . . 2.02 110.662 168.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -85.56 -61.65 1.71 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.62 1.568 . . . . 4.88 113.67 167.861 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 35.3 tttm -56.33 129.65 41.3 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.75 1.62 . . . . 8.05 110.947 -173.652 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -84.06 -56.59 3.59 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.754 0.788 . . . . 5.43 109.167 164.222 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -147.82 -2.22 0.56 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.833 1.653 . . . . 7.36 112.113 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -92.94 54.31 2.16 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 121.736 -0.602 . . . . 4.91 110.477 -138.809 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 53.9 tp -123.68 -72.15 0.69 Allowed 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 124.123 0.969 . . . . 6.22 109.754 -172.445 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.04 168.77 11.69 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 124.17 0.988 . . . . 8.39 108.596 177.223 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 6.3 tp -153.91 43.09 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 123.192 0.597 . . . . 9.79 110.498 177.939 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -162.23 154.63 19.41 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.189 -0.944 . . . . 8.63 109.396 173.224 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . 0.404 ' NZ ' ' O ' ' B' ' 98' ' ' LYS . 22.3 tptp -177.05 138.09 0.24 Allowed 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 127.471 2.308 . . . . 8.6 105.1 -171.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . 0.404 ' O ' ' NZ ' ' B' ' 97' ' ' LYS . 9.5 tptp . . . . . 0 C--O 1.253 1.251 0 N-CA-C 103.402 -2.814 . . . . 11.29 103.402 161.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.4 mtt . . . . . 0 N--CA 1.474 0.761 0 N-CA-C 105.019 -2.215 . . . . 9.15 105.019 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.32 175.13 0.6 Allowed 'General case' 0 C--O 1.237 0.444 0 N-CA-C 109.057 -0.72 . . . . 3.66 109.057 136.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.39 99.11 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 129.108 2.963 . . . . 4.37 109.686 -175.048 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -70.56 126.17 92.18 Favored Pre-proline 0 N--CA 1.45 -0.426 0 C-N-CA 123.877 0.871 . . . . 4.66 110.565 -174.215 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.51 113.1 3.63 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 122.346 2.031 . . . . 2.83 109.269 178.394 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 61.5 mt -69.23 164.2 23.25 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.076 0.55 . . . . 2.51 110.312 177.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.4 t -76.63 162.21 27.93 Favored 'General case' 0 CA--C 1.528 0.109 0 N-CA-C 108.992 -0.744 . . . . 2.25 108.992 176.928 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.91 -53.28 59.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.171 0.988 . . . . 3.18 111.216 -169.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.5 mt -62.77 -49.87 73.29 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 118.046 -0.978 . . . . 2.46 112.563 178.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -51.1 -54.46 24.81 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 119.687 1.13 . . . . 2.15 110.683 175.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -49.26 -56.18 10.22 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.066 1.347 . . . . 3.84 110.161 174.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.3 t -53.5 -46.97 70.24 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.999 0.92 . . . . 3.2 111.392 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.311 2.8 pp -70.04 -35.49 64.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 O-C-N 120.966 -1.084 . . . . 1.92 111.42 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -59.14 -51.84 68.26 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.2 0.909 . . . . 2.79 109.977 176.11 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . 0.256 12.5 t -53.26 -38.94 63.49 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 121.801 -0.562 . . . . 2.61 112.177 -176.786 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 m -72.92 -39.35 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 O-C-N 120.461 -1.399 . . . . 2.36 111.226 175.666 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.4 t -55.22 -47.3 77.76 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.112 0 CA-C-N 118.252 0.478 . . . . 1.8 110.184 175.613 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . 0.253 10.2 t -62.11 -48.57 79.56 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 117.937 -1.03 . . . . 2.24 111.334 178.502 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 16.4 m -49.92 -52.26 34.6 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 120.395 1.452 . . . . 2.98 110.803 173.019 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -50.92 -60.0 3.55 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.228 0.611 . . . . 4.2 110.163 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -61.89 -45.16 94.95 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.96 0.504 . . . . 4.44 111.384 -170.663 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -65.3 -19.22 65.86 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 119.252 -0.404 . . . . 3.08 111.902 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -81.54 -44.11 17.78 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 118.401 0.546 . . . . 4.39 111.899 164.947 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.17 -33.11 67.12 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.453 1.501 . . . . 1.54 111.655 -168.191 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 34.2 ptt180 -62.73 -34.96 78.27 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.545 1.138 . . . . 5.3 112.439 177.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -40.86 -64.69 0.5 Allowed 'General case' 0 C--N 1.344 0.365 0 CA-C-O 122.139 0.971 . . . . 2.56 113.255 -160.039 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -106.08 81.93 1.7 Allowed 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 103.889 -2.634 . . . . 3.16 103.889 -178.076 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 48.06 -172.94 0.04 OUTLIER Glycine 0 CA--C 1.53 1.012 0 C-N-CA 126.835 2.16 . . . . 2.68 114.518 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 34.73 88.54 0.01 OUTLIER 'General case' 0 C--O 1.235 0.333 0 C-N-CA 127.267 2.227 . . . . 5.57 112.367 169.05 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -75.97 57.84 1.11 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.955 1.302 . . . . 4.84 112.784 -166.779 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -163.53 -44.79 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 126.646 1.979 . . . . 4.37 106.906 174.539 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 m -82.08 113.39 19.91 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 125.479 1.512 . . . . 2.71 109.59 -179.113 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.8 mp -84.33 136.62 33.82 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.149 -0.478 . . . . 3.8 110.05 168.889 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.9 t -81.2 174.59 11.4 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.519 1.928 . . . . 3.91 108.625 172.541 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 11.5 p -62.21 -43.01 97.4 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 O-C-N 122.079 -0.388 . . . . 3.04 110.01 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -67.58 -57.29 6.72 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 118.182 -0.913 . . . . 2.05 109.113 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -37.6 -49.16 1.08 Allowed 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.361 1.464 . . . . 1.83 112.072 169.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -60.03 -59.99 4.53 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.967 -0.458 . . . . 4.79 110.597 174.271 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -52.92 -40.67 63.78 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.281 0.491 . . . . 4.0 111.671 -176.451 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -51.82 -39.97 59.68 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 123.968 0.907 . . . . 3.28 110.574 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 57.5 tp -68.58 -45.8 71.08 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 119.543 1.065 . . . . 3.37 109.435 -176.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 35.6 m -69.62 -28.1 36.27 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.123 0 CA-C-O 120.99 0.424 . . . . 2.37 110.4 -175.699 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 63.7 m -81.09 -40.23 24.42 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 124.383 1.073 . . . . 2.87 111.105 177.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -82.78 -55.86 4.18 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 124.176 0.991 . . . . 2.85 110.067 -172.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.2 mp0 -96.71 -146.51 0.29 Allowed 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 107.616 -1.253 . . . . 4.21 107.616 169.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.0 mp 38.63 44.95 0.68 Allowed Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 126.243 1.817 . . . . 3.53 113.15 -167.284 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -59.93 -32.86 95.77 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 122.55 2.167 . . . . 1.92 111.966 179.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.94 -6.33 3.11 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 114.485 1.291 . . . . 4.15 114.485 179.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . 2.134 10.8 mp -2.05 -144.83 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 120.989 3.7 . . . . 3.08 120.989 129.485 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.454 ' C ' ' H ' ' A' ' 52' ' ' ASP . 6.2 mt -82.73 88.13 6.74 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 113.33 -1.759 . . . . 2.69 107.714 174.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.73 18.88 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.899 1.444 . . . . 5.78 114.899 177.445 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.454 ' H ' ' C ' ' A' ' 50' ' ' LEU . 64.9 m-20 -115.57 20.67 14.55 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 128.192 2.597 . . . . 5.67 109.289 -172.653 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.0 m -53.33 -15.18 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 126.681 1.992 . . . . 4.01 114.833 -172.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -56.33 -51.85 53.47 Favored Glycine 0 CA--C 1.529 0.936 0 N-CA-C 110.048 -1.221 . . . . 2.57 110.048 170.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.8 t -84.92 60.45 6.23 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 122.361 1.077 . . . . 3.76 109.826 -173.179 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -77.38 -36.5 53.46 Favored 'General case' 0 N--CA 1.438 -1.057 0 O-C-N 121.628 -0.67 . . . . 2.34 109.79 -176.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -59.61 -46.7 88.19 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.783 0.719 . . . . 4.67 110.496 178.917 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -45.04 -57.92 3.53 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.576 1.15 . . . . 3.33 109.413 170.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 6.0 mmpt? -60.28 -45.15 94.32 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 118.735 -0.65 . . . . 6.3 110.78 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -51.34 -54.94 21.4 Favored 'General case' 0 C--N 1.334 -0.087 0 CA-C-N 119.428 1.013 . . . . 2.46 109.59 178.84 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 44.6 mtmt -57.57 -37.64 73.48 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 122.584 0.354 . . . . 3.76 111.001 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 14.5 m -62.9 -47.75 81.95 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.863 -0.523 . . . . 2.72 112.165 175.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.2 mp -66.77 -60.24 2.86 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 121.27 -0.894 . . . . 3.36 109.32 -179.555 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -75.98 74.7 2.88 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.175 1.39 . . . . 1.58 109.683 -168.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.1 m -45.55 -37.19 2.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 124.93 1.292 . . . . 2.76 113.17 -175.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 11.0 p-10 -102.37 8.18 40.28 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 113.131 0.789 . . . . 3.47 113.131 -176.159 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 46.81 59.14 4.14 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.76 1.624 . . . . 3.4 112.359 172.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 40.5 p30 -108.69 -9.57 15.25 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.36 1.464 . . . . 2.0 111.76 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.2 m 62.47 25.7 15.31 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.173 0.989 . . . . 2.04 111.9 -170.663 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -122.81 100.91 7.15 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 126.194 1.798 . . . . 3.23 107.57 169.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -86.49 79.97 8.79 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 105.926 -1.879 . . . . 1.93 105.926 170.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -69.24 171.78 7.94 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 122.776 0.43 . . . . 4.89 110.706 174.209 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -37.92 -61.15 0.67 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.563 1.545 . . . . 6.59 112.842 -167.038 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -68.39 -44.5 74.97 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.582 -0.699 . . . . 3.72 111.432 -177.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -57.53 -33.15 67.79 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.209 0.603 . . . . 2.57 111.203 178.147 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 35.5 t80 -78.67 -48.19 15.51 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 118.102 0.41 . . . . 4.47 110.363 175.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.421 ' CD1' ' HA2' ' B' ' 81' ' ' GLY . 44.5 t-105 -48.54 -29.09 3.85 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.823 0.849 . . . . 5.71 111.72 176.886 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 14.4 mmm180 -37.23 -56.62 0.93 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.347 1.059 . . . . 4.47 110.859 166.766 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 26.0 tp -49.07 -43.33 40.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 123.905 0.882 . . . . 2.08 111.219 -179.588 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mp -80.72 -29.64 11.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 107.925 -1.139 . . . . 2.94 107.925 -168.501 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -56.22 -51.11 58.04 Favored Glycine 0 N--CA 1.439 -1.141 0 N-CA-C 110.259 -1.137 . . . . 1.16 110.259 164.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -63.22 -33.93 76.57 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-O 118.596 -0.716 . . . . 2.43 110.456 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 8.0 mp -57.84 -55.58 33.04 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 119.793 1.179 . . . . 3.69 109.708 173.716 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.12 -48.25 64.91 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.346 0.593 . . . . 2.04 109.914 177.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -55.65 -34.65 65.15 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 117.849 -1.072 . . . . 3.38 112.271 174.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -78.91 -14.22 59.35 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 127.406 2.283 . . . . 2.13 112.624 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -91.5 -26.72 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 N-CA-C 113.773 1.027 . . . . 2.75 113.773 157.803 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -65.5 0.75 Allowed 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 119.851 1.205 . . . . 5.46 111.579 175.277 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt -84.18 -170.29 3.02 Favored 'General case' 0 C--O 1.214 -0.784 0 N-CA-C 104.106 -2.553 . . . . 4.45 104.106 145.345 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 40.4 mttp -49.63 -46.08 49.02 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 124.72 3.418 . . . . 9.41 110.741 -21.117 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . 0.267 1.5 tppt? 153.54 61.77 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.999 1 C-N-CA 141.013 7.725 . . . . 10.35 104.747 -13.544 . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -113.76 170.91 7.91 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.618 1.567 . . . . 8.55 110.273 162.023 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . 0.292 0.6 OUTLIER 92.97 -93.61 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 129.253 3.021 . . . . 14.33 113.659 171.981 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -147.8 123.6 10.58 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-O 117.343 -1.313 . . . . 16.21 110.188 -169.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -43.09 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 121.572 1.987 . . . . 15.26 111.539 177.173 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 68.95 44.18 1.08 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.887 0.875 . . . . 17.15 110.514 -175.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . 0.42 ' HZ3' ' C ' ' A' ' 98' ' ' LYS . 10.6 tmtt? -177.65 136.38 0.19 Allowed 'General case' 0 N--CA 1.461 0.096 0 C-N-CA 126.406 1.883 . . . . 19.64 106.045 173.133 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.42 ' C ' ' HZ3' ' A' ' 97' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 N-CA-C 103.269 -2.863 . . . . 17.03 103.269 156.142 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.6 tpt . . . . . 0 C--O 1.205 -1.241 0 CA-C-O 115.599 -2.143 . . . . 13.59 106.296 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . 0.465 ' CB ' ' HA ' ' B' ' 3' ' ' ALA 0.295 . . -134.74 -144.59 0.22 Allowed 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 124.152 3.16 . . . . 5.49 115.195 -167.046 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . 0.465 ' HA ' ' CB ' ' B' ' 2' ' ' ALA 2.361 . . 104.78 101.62 0.01 OUTLIER 'General case' 0 C--N 1.352 0.71 1 C-N-CA 134.404 5.081 . . . . 4.92 112.159 27.453 . . . . . . . . 4 3 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . 0.279 2.2 mt-10 124.06 175.11 0.0 OUTLIER Pre-proline 0 N--CA 1.48 1.059 1 C-N-CA 135.003 5.321 . . . . 6.8 107.947 -178.386 . . . . . . . . 3 2 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.71 147.35 56.59 Favored 'Trans proline' 0 C--N 1.353 0.766 0 CA-C-N 122.462 1.915 . . . . 4.7 112.375 -169.111 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . 2.316 0.2 OUTLIER -90.72 -146.82 0.19 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 127.81 2.444 . . . . 3.62 112.751 -167.217 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 1.1 t -118.51 -109.68 0.35 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.738 2.015 . . . . 2.59 108.001 178.662 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -105.75 -68.72 0.85 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 126.351 1.86 . . . . 5.12 107.483 172.525 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 3.7 mp -65.79 -51.09 61.89 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.807 -0.558 . . . . 4.24 110.032 -177.283 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 -52.25 -39.58 60.52 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 119.22 -0.419 . . . . 3.84 111.375 173.301 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.57 -56.09 20.12 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.179 -0.675 . . . . 4.95 109.179 172.725 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 35.9 p -71.35 -39.63 71.19 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 119.926 -0.71 . . . . 2.49 110.822 -167.317 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.3 pp -69.67 -35.54 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 O-C-N 121.261 -0.899 . . . . 2.35 109.863 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -60.83 -55.46 32.86 Favored 'General case' 0 C--N 1.342 0.249 0 CA-C-N 119.199 0.909 . . . . 3.1 109.615 171.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.4 t -55.43 -38.84 69.5 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-O 121.911 0.862 . . . . 2.02 111.564 -170.787 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 17.0 m -72.89 -39.17 58.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 O-C-N 120.667 -1.271 . . . . 2.4 111.402 174.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 45.2 t -60.85 -44.1 96.98 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 119.447 1.021 . . . . 2.45 111.389 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 10.1 t -62.46 -45.92 90.84 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.725 1.148 . . . . 2.27 110.257 177.702 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 60.3 m -52.93 -55.18 25.31 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.345 0.593 . . . . 2.36 109.73 174.513 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -49.99 -49.83 49.19 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.611 1.164 . . . . 5.36 111.101 175.414 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -62.18 -54.31 42.9 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.889 0.875 . . . . 3.73 110.649 -175.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 15.0 t -62.13 -29.32 70.26 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 119.555 -0.858 . . . . 4.03 110.797 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -63.4 -54.02 43.29 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 118.4 0.545 . . . . 4.44 111.092 167.894 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.57 -30.28 62.97 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 126.336 1.854 . . . . 2.68 110.407 -172.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -54.85 -26.88 38.3 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.01 0.924 . . . . 4.84 112.657 176.603 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.419 ' HB3' ' CG ' ' B' ' 37' ' ' GLU . 11.2 tt0 -62.87 -68.64 0.32 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 114.063 1.134 . . . . 5.18 114.063 -157.083 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . 0.445 ' CD ' ' H ' ' B' ' 28' ' ' GLY . 0.0 OUTLIER -90.2 -74.91 0.47 Allowed 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 115.026 1.491 . . . . 5.07 115.026 -163.245 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . 0.445 ' H ' ' CD ' ' B' ' 27' ' ' GLU . . . -92.08 170.1 32.76 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 127.943 2.687 . . . . 3.22 109.779 154.965 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 38.41 102.09 0.0 OUTLIER 'General case' 0 C--O 1.24 0.58 0 C-N-CA 125.63 1.572 . . . . 4.67 114.792 142.675 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -71.09 49.73 0.14 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.631 1.572 . . . . 4.39 112.578 176.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -153.84 -53.67 0.1 Allowed 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.072 1.349 . . . . 3.72 108.17 -172.828 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.4 p -104.78 157.58 17.1 Favored 'General case' 0 C--O 1.244 0.799 0 C-N-CA 124.219 1.007 . . . . 2.75 113.305 -177.32 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -111.03 151.34 28.13 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 127.86 2.464 . . . . 3.4 109.39 -173.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 8.2 t -149.95 178.18 9.16 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.378 1.071 . . . . 3.83 108.323 169.976 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 9.2 p -83.89 53.09 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-O 121.865 0.84 . . . . 3.76 111.127 -171.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.25 56.12 0.51 Allowed 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 105.618 -1.993 . . . . 2.91 105.618 150.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . 0.419 ' CG ' ' HB3' ' B' ' 26' ' ' GLN . 1.3 tt0 -173.78 -59.92 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 104.037 -2.579 . . . . 1.83 104.037 -172.677 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -57.55 -56.46 21.6 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.33 -0.85 . . . . 3.33 109.52 172.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 16.3 ttmt -57.05 -37.8 72.31 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 122.074 -0.391 . . . . 3.93 111.179 -177.005 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.74 -30.03 71.12 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.449 -0.782 . . . . 2.93 111.683 177.833 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.25 -52.54 63.32 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 107.978 -1.119 . . . . 3.64 107.978 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 2.6 m -68.17 -42.55 84.9 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 115.125 -0.943 . . . . 1.74 109.969 -174.752 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 96.6 m -54.08 -54.16 43.24 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.941 -0.572 . . . . 1.98 110.054 173.189 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -82.15 -62.78 1.53 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.796 1.035 . . . . 2.72 113.796 -167.015 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -83.19 -36.13 24.91 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 115.932 1.827 . . . . 4.96 115.932 -163.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -46.67 -38.82 12.7 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 114.027 1.121 . . . . 2.96 114.027 -159.895 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -64.04 -20.87 68.21 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 C-N-CA 122.191 -2.004 . . . . 2.82 109.978 -62.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -93.09 -56.27 3.03 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.058 0.943 . . . . 3.87 110.986 -169.789 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . 0.428 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 7.4 tp -30.56 -72.12 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.133 1.773 . . . . 2.07 113.34 -167.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 79.7 mt -90.24 128.74 36.48 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 106.464 -1.68 . . . . 2.49 106.464 169.794 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.43 -5.28 10.81 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.797 1.239 . . . . 7.93 111.835 -173.745 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -88.74 16.61 6.51 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 128.168 2.587 . . . . 4.75 111.201 -177.634 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 14.4 m -52.42 -28.09 11.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 125.259 1.424 . . . . 2.42 111.404 177.33 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.08 -35.13 8.29 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 124.308 0.956 . . . . 3.39 112.657 172.75 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.6 t -124.77 47.83 2.07 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 117.817 0.808 . . . . 3.8 109.23 171.994 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -45.63 -39.69 8.06 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.159 0.984 . . . . 2.24 110.134 172.304 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -58.38 -25.62 62.28 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.196 0.998 . . . . 4.27 111.854 -174.561 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -58.53 -54.24 49.22 Favored 'General case' 0 C--N 1.344 0.332 0 O-C-N 121.326 -0.859 . . . . 2.87 109.399 165.872 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -49.29 75.49 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 108.421 -0.955 . . . . 3.92 108.421 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 16.3 tpt -46.23 -60.24 2.43 Favored 'General case' 0 N--CA 1.462 0.13 0 C-N-CA 123.635 0.774 . . . . 3.19 108.953 177.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -57.46 -42.15 81.96 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 122.516 0.326 . . . . 4.63 111.367 -178.859 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.5 m -65.48 -34.83 79.19 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.116 0.566 . . . . 3.36 112.442 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 39.2 mt -80.02 -44.91 19.31 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.884 1.274 . . . . 2.77 109.645 -176.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -49.35 -8.76 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 128.346 2.658 . . . . 2.32 117.17 -175.48 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 19.8 m -33.65 -28.27 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 131.024 3.73 . . . . 2.5 118.923 -124.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -67.4 -20.62 65.56 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 120.724 1.602 . . . . 3.97 110.977 170.869 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 69.85 65.52 0.24 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.059 1.344 . . . . 4.13 110.617 172.226 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 48.9 p30 -119.56 -7.39 10.13 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.37 1.868 . . . . 2.82 112.321 -176.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 14.8 m 72.73 18.61 4.17 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.337 1.855 . . . . 3.07 112.673 -174.241 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -126.11 110.28 13.33 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.362 1.465 . . . . 4.12 108.798 170.858 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -80.44 104.08 10.74 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 106.813 -1.551 . . . . 2.52 106.813 170.242 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -91.21 166.64 12.84 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.533 1.933 . . . . 4.87 110.023 -176.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -89.73 56.7 3.61 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.636 -0.665 . . . . 7.12 111.525 179.234 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -158.52 49.26 0.37 Allowed 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 106.861 -1.533 . . . . 2.99 106.861 109.895 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 77.7 mt-10 -95.58 -61.32 1.48 Allowed 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.906 2.083 . . . . 2.56 108.843 145.807 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -48.13 -38.34 17.65 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 125.779 1.632 . . . . 4.05 110.968 -174.042 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . . . . . . . . . 23.0 t90 -39.75 -41.94 1.18 Allowed 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 124.228 0.955 . . . . 5.96 111.525 176.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 31.8 mmt180 -49.3 -30.28 7.16 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-O 117.666 -1.159 . . . . 6.18 113.095 179.282 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 18.3 tp -57.66 -44.43 85.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 121.776 2.08 . . . . 2.22 111.184 174.944 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 1.4 mt -80.94 -26.94 10.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 C-N-CA 124.2 1.0 . . . . 2.66 108.832 178.319 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.421 ' HA2' ' CD1' ' A' ' 77' ' ' TRP . . . -37.56 -57.02 1.55 Allowed Glycine 0 C--N 1.347 1.159 0 C-N-CA 127.7 2.572 . . . . 2.73 110.189 159.754 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -82.46 -63.78 1.31 Allowed 'General case' 0 N--CA 1.421 -1.895 0 CA-C-N 111.644 -2.278 . . . . 2.49 108.252 -172.146 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.428 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 1.7 mp -38.49 -59.6 0.89 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 120.45 1.477 . . . . 3.24 113.428 -169.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.34 -36.1 65.92 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 123.148 0.579 . . . . 2.18 111.365 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 22.0 ttpp -80.69 -39.9 26.35 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.031 0.933 . . . . 2.82 112.329 175.756 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 5.3 mm-40 -60.45 -25.61 66.13 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 119.757 1.162 . . . . 3.19 112.266 -177.039 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 1.5 tp -44.1 -44.44 2.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 N-CA-C 109.566 -0.531 . . . . 2.23 109.566 167.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 -85.71 -60.15 2.1 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.805 2.042 . . . . 5.76 113.198 171.172 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 29.0 tttm -66.25 115.0 5.76 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 125.616 1.566 . . . . 7.28 111.574 -166.9 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 12.2 ttmt -76.09 -61.23 2.01 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.463 -0.569 . . . . 5.31 109.463 170.252 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -176.59 72.41 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 126.271 1.828 . . . . 7.06 108.142 -178.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -131.6 151.23 51.77 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 106.085 -1.82 . . . . 5.17 106.085 153.609 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 1.6 pt? 175.12 -51.75 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 128.362 2.665 . . . . 5.2 107.83 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 161.93 174.22 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 128.839 2.856 . . . . 8.05 107.468 -177.919 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 8.5 tp -147.71 50.83 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-O 121.971 0.891 . . . . 9.97 109.723 178.791 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 8.4 ttm180 -165.32 -147.08 0.09 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.38 1.072 . . . . 8.0 108.445 175.125 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -176.66 138.98 0.3 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 128.923 2.889 . . . . 10.63 104.261 -174.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 34.6 tptt . . . . . 0 C--O 1.255 1.381 0 N-CA-C 103.834 -2.654 . . . . 7.71 103.834 172.105 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.7 mtt . . . . . 0 N--CA 1.476 0.839 0 N-CA-C 105.696 -1.964 . . . . 8.87 105.696 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.99 162.32 19.58 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 119.683 1.129 . . . . 4.34 109.885 169.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 62.91 80.0 0.24 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.514 1.526 . . . . 4.02 112.137 177.195 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -81.2 114.44 49.07 Favored Pre-proline 0 N--CA 1.446 -0.625 0 C-N-CA 124.545 1.138 . . . . 4.92 109.685 -178.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -79.53 98.87 1.18 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.559 2.172 . . . . 2.98 109.575 -177.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.61 177.47 7.47 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.586 -0.524 . . . . 3.54 109.586 170.88 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.1 m -58.05 147.07 30.75 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.394 -0.816 . . . . 4.73 110.778 -173.005 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -53.96 -49.38 68.89 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.526 -0.734 . . . . 2.7 110.285 175.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.7 mt -59.22 -39.87 84.07 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 117.98 -1.009 . . . . 2.8 112.891 172.332 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -54.31 -50.27 67.73 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 120.583 1.538 . . . . 2.62 111.465 170.059 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.1 mm-40 -50.48 -53.33 30.66 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.322 -0.622 . . . . 4.15 109.322 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.9 p -67.14 -43.53 82.12 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 121.746 -0.596 . . . . 2.03 111.932 -174.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.276 1.8 pp -62.2 -41.04 89.86 Favored 'Isoleucine or valine' 0 C--N 1.342 0.242 0 CA-C-N 119.961 1.255 . . . . 1.95 110.587 176.08 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -58.36 -47.48 83.68 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.285 0.948 . . . . 3.22 110.388 174.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -59.53 -35.32 73.97 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.626 0.602 . . . . 2.07 112.626 -175.582 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.0 m -80.16 -38.83 18.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 O-C-N 120.541 -1.35 . . . . 1.79 111.187 173.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.5 t -57.95 -44.12 86.09 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 118.708 0.685 . . . . 1.65 110.528 178.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.6 t -61.08 -46.69 89.62 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.375 -0.828 . . . . 1.64 110.075 177.173 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.7 m -56.68 -49.9 73.73 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.687 0.676 . . . . 2.07 109.778 177.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -47.83 -57.45 5.62 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.986 0.914 . . . . 4.58 110.951 170.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -67.26 -46.83 72.52 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.124 0.57 . . . . 3.89 111.123 -168.163 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 40.1 p -56.67 -28.49 60.81 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.577 0.751 . . . . 3.33 111.517 176.706 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -75.49 -55.18 5.94 Favored 'General case' 0 C--O 1.222 -0.384 0 C-N-CA 123.339 0.655 . . . . 3.78 111.969 165.938 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.61 -28.37 54.82 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 126.907 2.083 . . . . 1.74 112.173 -169.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -74.35 -18.79 60.63 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.563 1.145 . . . . 4.21 113.083 -179.456 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.66 -67.93 0.22 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.204 0.911 . . . . 3.69 112.516 -175.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -108.48 172.69 6.7 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 126.861 2.064 . . . . 2.6 106.703 -174.469 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -9.35 116.73 0.01 OUTLIER Glycine 0 CA--C 1.532 1.127 0 C-N-CA 127.481 2.467 . . . . 2.24 114.814 172.715 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? 64.03 107.34 0.03 OUTLIER 'General case' 0 C--O 1.239 0.529 0 C-N-CA 124.701 1.201 . . . . 5.01 113.279 171.658 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -65.57 58.82 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.086 0.954 . . . . 4.46 111.298 164.376 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -166.51 -47.91 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.788 1.635 . . . . 4.46 108.834 -171.374 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 13.9 p -95.85 129.2 43.16 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 125.446 1.499 . . . . 2.67 109.164 173.458 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.7 mp -84.11 136.24 34.08 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.018 -1.105 . . . . 3.7 108.018 161.167 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.1 t -80.24 170.91 15.77 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 125.097 1.359 . . . . 3.55 107.808 167.919 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.4 p -58.99 -41.33 82.88 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 O-C-N 121.882 -0.511 . . . . 4.04 109.872 176.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -66.33 -59.6 3.56 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 118.481 -0.771 . . . . 2.4 109.211 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -37.51 -54.16 1.14 Allowed 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 124.145 0.978 . . . . 1.92 112.048 169.822 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -59.88 -51.89 67.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.633 -0.258 . . . . 4.22 111.128 178.441 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.8 tttm -56.9 -38.96 73.55 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.568 0.622 . . . . 4.76 109.67 -176.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -66.32 -19.94 65.95 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 118.816 -0.611 . . . . 5.02 112.125 -176.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -61.52 -55.82 26.86 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-N 119.638 1.108 . . . . 3.55 108.053 169.824 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.0 m -71.0 -44.21 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-O 121.811 0.815 . . . . 2.71 109.605 -169.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 38.2 m -68.38 -42.2 79.45 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 124.979 1.312 . . . . 2.21 110.179 -175.765 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -75.79 -50.76 14.28 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.769 0.713 . . . . 2.85 110.646 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -149.45 73.23 1.18 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.314 0.506 . . . . 4.1 112.185 -173.847 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.8 tp -154.65 45.79 0.27 Allowed Pre-proline 0 CA--C 1.549 0.904 0 N-CA-C 112.766 0.654 . . . . 3.16 112.766 155.093 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -62.59 -74.58 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 124.116 3.211 . . . . 1.98 114.726 -162.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 23.0 t-160 -63.62 -24.4 67.78 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 121.47 -0.769 . . . . 5.68 111.107 -169.116 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.6 tp -74.2 -75.43 0.16 Allowed 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 122.617 0.367 . . . . 1.99 110.447 177.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.6 mt -95.71 65.78 2.64 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 108.636 -0.876 . . . . 3.04 108.636 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -54.68 -30.75 56.41 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 114.253 -1.34 . . . . 6.72 111.936 178.599 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -73.35 72.16 1.29 Allowed 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.988 0.899 . . . . 3.47 108.906 162.731 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.2 t -77.11 -6.52 9.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 127.954 2.501 . . . . 4.0 109.557 161.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.89 -69.56 1.36 Allowed Glycine 0 C--N 1.345 1.041 0 C-N-CA 124.745 1.164 . . . . 2.47 110.493 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.54 52.89 1.47 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 123.159 1.457 . . . . 5.15 109.766 -176.347 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.3 -25.61 59.57 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 126.818 2.047 . . . . 2.8 110.049 -174.736 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -42.32 -45.67 4.32 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 126.513 1.925 . . . . 4.6 111.576 169.158 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -45.94 -52.83 10.97 Favored 'General case' 0 C--N 1.346 0.433 0 N-CA-C 108.992 -0.744 . . . . 6.39 108.992 177.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 1.5 mppt? -74.83 -63.28 1.29 Allowed 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 106.015 -1.846 . . . . 5.4 106.015 -174.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -47.5 -55.4 9.2 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 123.56 0.744 . . . . 2.7 110.369 -170.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.2 ttpp -73.22 -19.0 61.18 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 115.252 -0.885 . . . . 6.68 111.557 -169.528 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 44.9 m -82.81 -38.11 23.56 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.365 0.666 . . . . 2.73 112.536 166.125 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 72.0 mt -69.09 -51.1 42.19 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.391 1.476 . . . . 2.84 109.91 -172.733 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -72.74 73.35 1.09 Allowed 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.108 -1.071 . . . . 2.27 108.108 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.6 m -52.58 -40.86 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 124.222 1.009 . . . . 3.24 112.512 -170.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -88.99 -2.79 58.75 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.317 0.488 . . . . 2.94 112.317 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 58.07 55.08 5.44 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.001 1.32 . . . . 4.24 110.958 170.562 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 53.0 p30 -108.48 -3.24 18.31 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.667 1.587 . . . . 2.45 112.378 -177.219 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.8 m 80.35 0.05 1.96 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.66 1.984 . . . . 2.5 113.511 -178.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -110.4 131.23 55.23 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 119.065 0.848 . . . . 3.05 109.023 168.627 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -87.9 90.83 8.53 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 105.898 -1.89 . . . . 2.48 105.898 161.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.94 148.78 7.22 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.568 1.076 . . . . 4.36 108.25 169.26 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -38.78 -49.53 1.62 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.026 1.284 . . . . 6.37 113.494 178.979 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -66.46 -34.9 78.97 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.986 0.736 . . . . 3.58 112.986 177.512 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.53 -55.31 18.48 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 119.272 0.942 . . . . 2.65 109.476 172.951 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 30.9 t80 -45.86 -51.63 12.69 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 123.848 0.859 . . . . 4.16 109.664 175.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.68 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 2.1 t-105 -45.89 -33.56 3.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 117.41 -1.281 . . . . 5.29 112.275 178.967 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -40.64 -47.97 2.84 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 120.237 1.381 . . . . 6.99 110.471 171.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 28.0 tp -41.7 -50.34 4.23 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 124.528 1.131 . . . . 2.41 111.524 176.132 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 85.5 mt -62.51 -30.7 49.76 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 N-CA-C 108.888 -0.782 . . . . 2.8 108.888 -172.271 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.543 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -74.67 -44.97 24.19 Favored Glycine 0 CA--C 1.491 -1.435 0 N-CA-C 109.996 -1.242 . . . . 1.61 109.996 176.447 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -61.21 -31.03 70.8 Favored 'General case' 0 N--CA 1.436 -1.134 0 N-CA-C 107.752 -1.203 . . . . 2.1 107.752 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.6 mt -71.08 -56.86 5.24 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 119.266 0.939 . . . . 3.24 110.826 172.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.45 -24.75 47.63 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.963 0.905 . . . . 2.05 111.856 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -80.41 -61.01 2.11 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 126.709 2.004 . . . . 2.56 109.013 171.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -50.39 -40.92 51.13 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.978 1.311 . . . . 2.55 111.237 -176.347 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 10.0 tt -54.85 -34.57 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 O-C-N 120.671 -1.268 . . . . 2.16 112.345 177.071 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -93.07 -62.56 1.36 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.46 1.504 . . . . 5.56 108.588 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -73.79 74.93 1.59 Allowed 'General case' 0 C--O 1.222 -0.377 0 C-N-CA 125.491 1.516 . . . . 4.87 108.422 168.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . 0.495 65.5 mttt -37.34 -3.55 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.996 1 C-N-CA 132.501 4.32 . . . . 11.21 121.606 -176.207 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . 0.289 1.5 tmtm? 118.24 -0.79 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.819 1 C-N-CA 133.919 4.888 . . . . 10.85 109.652 179.001 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.24 72.03 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 129.833 3.253 . . . . 5.72 109.097 172.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 19.8 tp -115.8 -70.71 0.78 Allowed 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 126.006 1.722 . . . . 12.0 108.685 -177.188 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -145.12 134.19 22.66 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 105.648 -1.982 . . . . 16.88 105.648 176.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 2.3 mp 69.01 138.77 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 C-N-CA 125.618 1.567 . . . . 15.74 109.566 -173.749 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.99 163.36 22.41 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.309 -0.869 . . . . 16.98 111.136 179.24 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . 2.212 9.7 mtpp -179.73 138.34 0.13 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 128.414 2.686 . . . . 16.21 105.141 -152.295 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . 2.39 0.2 OUTLIER . . . . . 0 C--O 1.257 1.489 2 C-N-CA 134.215 5.006 . . . . 12.73 110.412 4.016 . . . . . . . . 3 2 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.419 23.4 ptm . . . . . 0 CA--C 1.543 0.711 0 N-CA-C 112.185 0.439 . . . . 11.64 112.185 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.23 -165.15 0.07 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.249 0.931 . . . . 9.22 111.727 170.041 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 103.92 107.68 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 127.738 2.415 . . . . 5.98 115.419 -179.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . 0.494 15.1 tt0 -157.56 -111.81 0.0 OUTLIER Pre-proline 0 CA--C 1.547 0.861 0 CA-C-O 115.475 -2.202 . . . . 6.26 112.509 102.424 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -69.89 150.57 67.58 Favored 'Trans proline' 0 C--N 1.35 0.648 0 CA-C-N 124.038 2.478 . . . . 3.12 111.669 -169.722 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 49.3 mt -120.97 -100.22 0.43 Allowed 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 114.338 1.236 . . . . 3.42 114.338 -162.402 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 2.0 t -166.28 -111.02 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 120.944 1.702 . . . . 2.73 112.991 -166.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -125.28 -72.74 0.65 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.762 2.025 . . . . 2.35 110.434 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.9 mt -48.89 -49.51 39.42 Favored 'General case' 0 C--O 1.233 0.209 0 O-C-N 121.656 -0.653 . . . . 2.32 110.798 175.59 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -44.29 -52.74 7.3 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.185 0.994 . . . . 3.89 112.515 171.287 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -57.38 -36.81 71.72 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 119.235 0.925 . . . . 4.61 110.396 178.619 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 3.8 t -63.01 -50.14 71.9 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 122.947 0.499 . . . . 2.98 110.606 178.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.3 2.6 pp -61.44 -35.24 65.37 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 O-C-N 121.335 -0.853 . . . . 2.08 110.979 173.873 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -58.95 -57.78 11.57 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.874 -0.584 . . . . 3.11 110.145 174.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.8 t -52.49 -38.54 59.71 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.618 1.099 . . . . 2.06 111.685 -170.756 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 26.2 m -73.93 -39.82 51.96 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 O-C-N 121.414 -0.804 . . . . 2.02 111.492 175.499 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 38.4 t -57.73 -48.34 83.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 119.092 0.86 . . . . 2.2 111.015 173.339 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.1 t -64.38 -38.89 92.61 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.567 1.076 . . . . 2.12 110.856 177.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 85.8 m -58.16 -52.95 63.4 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 120.022 1.283 . . . . 2.02 109.666 174.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -47.26 -54.76 10.07 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.208 1.003 . . . . 4.9 110.279 173.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -55.2 -46.47 75.87 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.809 1.244 . . . . 5.17 111.329 -179.149 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 58.8 m -54.45 -44.27 72.36 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.403 0.681 . . . . 4.25 110.052 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -68.04 -47.3 68.76 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 120.457 -0.497 . . . . 4.39 110.959 171.357 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.45 -30.68 65.21 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.77 1.628 . . . . 2.19 111.467 -170.147 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 -19.32 64.79 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 118.153 -0.927 . . . . 4.52 112.665 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.404 ' HB3' ' CG ' ' B' ' 37' ' ' GLU . 2.3 tt0 -56.16 -68.13 0.24 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 117.902 -1.047 . . . . 4.84 111.562 -160.753 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -74.82 0.47 Allowed 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 114.433 1.272 . . . . 4.49 114.433 -162.847 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.77 160.16 27.37 Favored Glycine 0 N--CA 1.442 -0.924 0 C-N-CA 127.637 2.542 . . . . 2.31 109.906 156.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 36.56 104.95 0.0 OUTLIER 'General case' 0 C--O 1.237 0.42 0 N-CA-C 115.961 1.837 . . . . 6.22 115.961 140.556 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -69.01 46.13 0.06 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.866 1.266 . . . . 4.51 114.331 174.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -128.29 -58.2 1.2 Allowed 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 126.481 1.913 . . . . 3.53 106.341 168.726 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 2.1 p -94.15 146.49 23.95 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 125.209 1.403 . . . . 2.28 112.463 -166.101 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -102.95 154.27 19.39 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 126.094 1.757 . . . . 2.98 107.894 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 11.1 t -154.49 176.8 11.92 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 107.512 -1.292 . . . . 2.84 107.512 169.105 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 11.3 p -84.47 53.74 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-O 121.862 0.839 . . . . 3.59 111.188 -170.008 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.65 54.75 0.48 Allowed 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 105.895 -1.891 . . . . 2.5 105.895 149.153 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . 0.404 ' CG ' ' HB3' ' B' ' 26' ' ' GLN . 1.8 tt0 -172.38 -52.61 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.292 1.837 . . . . 2.22 106.532 -170.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -55.96 -57.82 10.47 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.564 -1.198 . . . . 3.27 109.771 173.375 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -56.22 -34.29 66.18 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.882 -0.599 . . . . 5.3 111.302 -175.478 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -54.31 -38.25 65.75 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.337 0.655 . . . . 3.45 110.765 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tt -67.15 -49.43 64.81 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.83 -0.804 . . . . 3.21 108.83 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 10.7 m -70.27 -35.08 61.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.295 -0.866 . . . . 1.79 110.155 -174.054 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 86.7 m -69.93 -50.79 38.58 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.018 0.927 . . . . 1.79 110.619 176.939 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -75.65 -61.52 1.89 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.565 0.746 . . . . 2.44 111.135 -169.696 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -80.79 -53.48 6.45 Favored 'General case' 0 C--O 1.227 -0.101 0 CA-C-O 121.343 0.592 . . . . 4.39 109.715 -175.384 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.61 -16.37 0.23 Allowed Pre-proline 0 CA--C 1.541 0.633 1 N-CA-C 121.857 4.021 . . . . 3.08 121.857 -144.985 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -48.96 -43.22 36.38 Favored 'Trans proline' 0 C--N 1.349 0.576 0 CA-C-N 123.473 2.276 . . . . 3.93 115.56 -149.387 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 65.4 t-80 -75.41 59.5 1.08 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.938 0.79 . . . . 3.62 110.669 173.432 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 10.3 tp -164.13 -91.57 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.209 1.404 . . . . 2.99 107.227 175.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 80.5 mt -78.79 86.98 4.68 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 120.968 -1.083 . . . . 2.4 109.126 171.113 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.33 169.51 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.386 -1.279 . . . . 7.35 111.566 153.041 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 88.78 5.12 0.19 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 127.446 2.299 . . . . 5.32 112.025 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 24.7 m -50.6 -34.09 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.96 0.904 . . . . 3.09 112.543 -175.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -49.83 -33.62 20.45 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.623 1.106 . . . . 3.25 112.992 175.657 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 8.3 t -130.71 57.15 1.74 Allowed 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.444 -0.947 . . . . 4.88 108.444 170.102 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -44.23 -39.18 4.25 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 124.645 1.178 . . . . 1.97 109.878 167.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -30.81 -47.68 0.1 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.331 2.653 . . . . 4.06 113.134 168.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -61.75 -52.47 64.08 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.073 0.464 . . . . 3.17 110.505 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.97 -47.97 81.37 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 107.963 -1.125 . . . . 4.4 107.963 177.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -50.15 -52.49 34.84 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 123.464 0.706 . . . . 2.59 110.295 179.023 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 17.8 ttmm -60.13 -44.13 95.15 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 122.305 -0.247 . . . . 3.67 110.911 178.717 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 16.1 m -63.22 -28.79 70.28 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.379 0.672 . . . . 3.06 112.394 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 26.2 mt -80.04 -57.15 3.77 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.353 1.061 . . . . 2.13 110.231 178.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -58.34 -9.76 1.72 Allowed 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 126.96 2.104 . . . . 1.63 116.487 -166.315 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 27.7 m -34.06 -19.47 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 130.869 3.668 . . . . 2.71 119.705 -140.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 7.8 p-10 -61.61 -22.71 65.48 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 121.314 1.87 . . . . 3.77 111.397 162.076 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 61.25 62.18 1.42 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 125.979 1.712 . . . . 3.61 111.099 175.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 38.9 p30 -105.84 -15.94 14.79 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.662 1.585 . . . . 2.25 110.954 174.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 74.31 9.42 4.45 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.366 1.466 . . . . 3.01 111.968 -173.3 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -111.03 101.93 10.43 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 105.915 -1.883 . . . . 3.65 105.915 171.098 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -75.66 108.93 8.84 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 106.653 -1.61 . . . . 2.11 106.653 174.314 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -83.98 160.28 21.07 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.436 1.894 . . . . 5.0 109.356 -176.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -86.05 52.68 2.55 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.775 -0.578 . . . . 5.42 111.933 172.978 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -159.37 48.65 0.31 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.881 -1.155 . . . . 2.72 107.881 114.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -93.31 -61.72 1.51 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.685 1.594 . . . . 2.15 107.779 142.904 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -48.54 -46.05 38.28 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 125.816 1.646 . . . . 4.05 111.011 -175.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.68 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 50.1 t90 -49.79 -36.48 26.41 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 123.883 0.74 . . . . 4.81 112.455 -169.812 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -42.24 -40.1 2.3 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.969 0.908 . . . . 5.21 111.91 173.645 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 10.6 tp -53.59 -45.28 69.93 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.212 1.005 . . . . 2.0 111.888 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 59.2 mt -64.3 -31.26 52.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 N-CA-C 107.211 -1.403 . . . . 2.37 107.211 178.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.559 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -64.59 -48.29 74.56 Favored Glycine 0 CA--C 1.492 -1.398 0 C-N-CA 125.894 1.711 . . . . 1.59 112.079 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -66.59 -62.72 1.31 Allowed 'General case' 0 N--CA 1.425 -1.708 0 CA-C-O 117.294 -1.336 . . . . 2.39 107.648 177.026 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 3.4 pp -54.47 -35.29 62.9 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 120.48 1.491 . . . . 2.96 113.041 -175.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.69 -61.63 2.38 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.347 0.522 . . . . 2.29 110.435 170.394 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -65.96 -31.95 73.16 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 117.763 -1.113 . . . . 2.75 111.79 -171.151 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -42.73 -38.09 1.97 Allowed 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 128.335 2.654 . . . . 2.74 111.226 175.806 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 2.7 tt -50.56 -40.49 19.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 122.622 0.369 . . . . 2.08 110.216 177.099 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.4 -59.51 2.36 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.983 2.113 . . . . 6.44 112.738 166.804 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 14.1 tttt -68.19 63.08 0.09 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 129.247 3.019 . . . . 7.54 111.672 -172.022 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -80.94 -19.84 43.34 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.409 -0.807 . . . . 6.76 111.05 169.053 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.19 -42.36 4.65 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.017 1.727 . . . . 11.17 110.699 -167.195 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.03 72.46 5.55 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.909 1.284 . . . . 4.28 111.357 -160.096 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 12.1 tp -104.05 -55.72 2.32 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 127.693 2.397 . . . . 8.2 109.544 178.611 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 12.0 mttp -74.62 72.14 1.93 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.576 0.75 . . . . 10.18 112.252 -170.435 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 2.3 pp -73.68 168.25 2.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 123.044 0.537 . . . . 6.92 110.567 167.529 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -163.52 166.24 22.8 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 107.025 -1.472 . . . . 8.26 107.025 -178.549 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -176.92 138.11 0.25 Allowed 'General case' 0 C--O 1.235 0.329 0 C-N-CA 126.372 1.869 . . . . 6.85 108.381 178.607 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? . . . . . 0 C--O 1.253 1.243 0 CA-C-O 117.486 -1.245 . . . . 11.22 107.767 159.636 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.8 mtt . . . . . 0 N--CA 1.473 0.725 0 N-CA-C 107.751 -1.203 . . . . 9.39 107.751 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.88 -170.94 0.18 Allowed 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 124.062 0.851 . . . . 4.92 110.24 163.289 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 102.37 80.29 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 128.836 2.855 . . . . 4.09 107.969 -159.527 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -81.78 147.45 58.75 Favored Pre-proline 0 N--CA 1.45 -0.427 0 C-N-CA 124.163 0.985 . . . . 5.36 110.701 -173.658 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.24 103.62 1.43 Allowed 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.761 2.308 . . . . 3.02 109.128 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -61.41 152.82 28.67 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 108.124 -1.065 . . . . 2.35 108.124 169.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.4 t -71.25 173.51 7.64 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 119.867 -0.733 . . . . 2.1 109.564 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -65.45 -59.76 3.67 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 121.536 -0.728 . . . . 3.01 110.101 -171.937 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.6 mp -55.33 -42.26 73.55 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 121.628 -0.67 . . . . 2.51 110.188 -176.817 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -53.25 -54.35 37.5 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.733 2.013 . . . . 2.72 111.655 171.925 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.03 -49.94 70.31 Favored 'General case' 0 C--N 1.341 0.204 0 N-CA-C 108.877 -0.786 . . . . 5.4 108.877 178.927 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.1 m -65.6 -46.85 77.78 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 111.765 0.283 . . . . 2.92 111.765 -175.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 pp -65.51 -34.77 72.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 O-C-N 120.969 -1.082 . . . . 2.15 108.878 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -60.3 -55.0 38.99 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.864 0.757 . . . . 2.99 109.351 170.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -51.53 -40.1 58.99 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.857 0.863 . . . . 2.01 111.686 -174.48 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 m -74.8 -41.18 47.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 O-C-N 120.971 -1.081 . . . . 2.02 111.4 173.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 40.2 t -57.53 -48.24 83.45 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 119.588 1.085 . . . . 1.95 111.535 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -59.32 -43.1 92.73 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 119.666 1.121 . . . . 1.76 110.455 178.126 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 60.1 m -59.22 -54.71 43.78 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.179 0.514 . . . . 1.82 109.78 176.886 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 2.2 t80 -44.15 -52.15 7.53 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.994 1.318 . . . . 4.24 110.676 171.144 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 26.9 t80 -66.2 -49.35 67.6 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.908 1.283 . . . . 4.04 110.691 -171.486 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 t -62.91 -36.95 85.07 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 110.093 -0.336 . . . . 2.77 110.093 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -64.52 -48.17 76.11 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 118.539 0.608 . . . . 3.88 111.236 169.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -52.76 -35.37 56.25 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 125.235 1.414 . . . . 1.99 110.998 -171.695 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -59.16 -34.29 71.93 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 126.427 1.891 . . . . 6.37 112.818 177.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -46.17 -61.63 1.69 Allowed 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.451 1.023 . . . . 2.34 112.738 -167.054 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -104.92 114.02 27.97 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 128.524 2.73 . . . . 2.92 106.375 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 40.17 99.99 0.01 OUTLIER Glycine 0 CA--C 1.533 1.204 0 C-N-CA 126.36 1.933 . . . . 1.81 116.432 162.232 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 72.93 106.47 0.07 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.554 0.742 . . . . 5.46 112.899 168.744 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.0 pttt -66.59 18.78 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 115.913 1.82 . . . . 5.59 115.913 178.865 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.3 p-10 -89.16 -34.32 16.74 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.816 1.246 . . . . 4.26 109.53 162.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.7 p -83.86 128.6 34.65 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.471 1.109 . . . . 3.7 110.834 -171.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -86.09 123.6 31.58 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 107.338 -1.356 . . . . 2.92 107.338 151.402 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.1 m -109.53 176.05 5.22 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 126.318 1.847 . . . . 3.71 109.074 -171.935 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 71.4 t -63.69 -49.65 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 O-C-N 121.814 -0.554 . . . . 3.95 111.519 -167.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -70.12 -48.89 55.65 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.272 -1.01 . . . . 3.06 108.272 -176.612 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -42.67 -53.54 4.44 Favored 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 124.672 1.189 . . . . 1.91 112.343 173.682 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.01 -56.05 14.41 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.184 -0.673 . . . . 3.77 109.184 176.892 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 30.4 ttmt -58.61 -39.1 79.49 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 120.283 -0.567 . . . . 3.87 111.766 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -54.55 -38.85 67.11 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.615 0.643 . . . . 3.2 111.755 176.302 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -61.07 -54.03 49.77 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 107.582 -1.266 . . . . 3.42 107.582 -177.173 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 16.4 m -68.98 -40.88 81.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 114.581 -1.19 . . . . 2.19 109.852 -170.245 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 98.1 m -59.99 -51.91 67.65 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 124.197 0.999 . . . . 3.1 110.61 174.811 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -74.16 -57.18 4.13 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.425 0.29 . . . . 3.23 110.976 -170.375 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -136.43 68.11 1.44 Allowed 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.669 0.387 . . . . 4.15 111.907 -177.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.3 tp -155.9 56.32 1.28 Allowed Pre-proline 0 CA--C 1.54 0.562 0 O-C-N 121.538 -0.727 . . . . 2.67 111.062 161.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -63.34 -61.12 0.14 Allowed 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 123.835 3.023 . . . . 1.85 112.715 -170.526 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -84.64 -51.62 6.71 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 119.351 0.978 . . . . 4.87 110.38 -172.261 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -31.9 -62.3 0.21 Allowed 'General case' 0 C--O 1.234 0.28 0 C-N-CA 126.402 1.881 . . . . 2.63 113.506 -172.469 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.5 mt -125.59 54.5 1.48 Allowed 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.047 1.339 . . . . 2.37 108.399 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.75 3.6 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 116.913 2.19 . . . . 5.81 116.913 -175.145 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -109.04 46.3 0.99 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.543 1.537 . . . . 4.8 107.331 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.9 m -55.85 -17.52 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 C-N-CA 125.766 1.627 . . . . 3.04 112.567 -176.361 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -44.43 -44.91 8.22 Favored Glycine 0 CA--C 1.532 1.135 0 N-CA-C 110.912 -0.875 . . . . 1.52 110.912 167.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.7 t -91.84 31.55 1.22 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 117.213 0.507 . . . . 2.85 112.088 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -52.61 -43.75 65.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 121.419 -0.801 . . . . 2.48 109.21 168.118 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -39.9 -57.35 1.61 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.982 1.313 . . . . 3.55 111.565 170.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.2 tp10 -60.12 -51.33 70.05 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 116.485 -0.325 . . . . 5.26 110.253 -178.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.92 -39.88 75.28 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 118.92 -1.112 . . . . 7.21 110.628 -179.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -57.3 -57.4 12.81 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 122.848 0.459 . . . . 2.54 110.673 176.277 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.13 -33.48 74.56 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 120.394 -0.522 . . . . 4.75 111.218 -176.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.3 t -59.45 -50.93 72.03 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.289 1.436 . . . . 2.58 110.997 172.102 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.8 mp -63.76 -50.09 70.4 Favored 'General case' 0 C--O 1.239 0.547 0 O-C-N 121.385 -0.822 . . . . 2.75 111.562 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -80.07 71.5 6.8 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 121.0 -0.28 . . . . 1.72 110.478 -167.369 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.8 m -49.53 -40.36 14.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.644 1.177 . . . . 2.98 113.525 -174.274 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -82.5 -8.64 59.61 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 123.519 0.728 . . . . 2.33 112.504 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 55.92 50.39 14.03 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.766 1.626 . . . . 4.39 110.426 168.88 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.5 p30 -100.49 -12.46 19.3 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.766 1.626 . . . . 2.01 110.96 179.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 20.7 m 72.43 17.41 4.76 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 125.893 1.677 . . . . 2.34 111.864 -179.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -116.06 113.26 22.94 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 106.11 -1.811 . . . . 3.96 106.11 163.792 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.82 89.07 7.12 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 104.543 -2.391 . . . . 2.21 104.543 173.38 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.9 tttp -75.87 158.04 32.58 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.921 -0.77 . . . . 5.87 108.921 -176.15 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -38.63 -61.07 0.75 Allowed 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.099 1.148 . . . . 6.09 114.099 -163.551 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -69.23 -26.55 64.85 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.684 -0.635 . . . . 2.94 112.209 -177.156 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -68.52 -59.69 2.97 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.639 -0.874 . . . . 2.07 108.639 171.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -56.37 -38.84 71.99 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 118.786 -0.626 . . . . 4.64 111.057 -175.855 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.495 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 0.1 OUTLIER -38.19 -45.19 0.92 Allowed 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 116.609 -1.662 . . . . 6.68 107.85 174.75 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 48.3 mtm-85 -38.55 -44.96 1.01 Allowed 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.85 1.659 . . . . 7.05 112.529 -179.036 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 23.5 tp -52.05 -56.97 11.01 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 120.593 1.542 . . . . 2.02 111.75 174.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 19.1 mm -59.44 -38.97 77.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 C-N-CA 126.403 1.881 . . . . 3.27 108.245 -179.172 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.58 -56.88 11.7 Favored Glycine 0 N--CA 1.437 -1.245 0 N-CA-C 108.497 -1.841 . . . . 2.28 108.497 172.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -63.51 -49.67 72.62 Favored 'General case' 0 N--CA 1.438 -1.056 0 C-N-CA 125.804 1.642 . . . . 2.65 108.617 -171.906 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 21.5 mt -42.34 -53.53 4.14 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 119.451 1.023 . . . . 3.22 112.12 -173.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.32 -35.18 62.4 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.97 1.308 . . . . 2.04 112.665 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.4 ttpp -77.7 -51.25 10.88 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.461 -0.774 . . . . 2.93 110.233 172.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.6 mm-40 -60.99 -30.74 70.46 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.059 0.943 . . . . 4.17 112.243 -171.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 5.2 tt -56.61 -40.21 67.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 119.046 0.839 . . . . 2.4 110.736 170.473 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.92 -55.52 5.69 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.422 -0.955 . . . . 5.82 108.422 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 3.8 tttm -85.11 47.33 1.39 Allowed 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 126.617 1.967 . . . . 4.34 109.897 -170.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.61 -56.99 2.41 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 124.574 1.15 . . . . 7.55 113.388 -163.954 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 62.5 mttt -156.47 53.85 0.54 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 105.565 -2.013 . . . . 9.77 105.565 163.885 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -75.43 61.35 1.25 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.415 1.486 . . . . 5.15 112.085 -165.74 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -164.45 26.07 0.07 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.353 1.061 . . . . 9.68 111.402 174.001 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 5.6 ptpt 177.15 -170.2 0.08 Allowed 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.071 1.748 . . . . 11.6 107.911 -176.269 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 0.402 11.3 tt 49.25 -129.14 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 116.331 -1.795 . . . . 9.67 110.799 -167.964 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -122.98 -67.1 0.97 Allowed 'General case' 0 C--N 1.342 0.28 0 CA-C-N 122.313 2.324 . . . . 14.46 111.768 -172.382 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 49.5 mtmt -175.85 48.81 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 128.194 2.598 . . . . 13.02 105.137 -167.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . 2.438 35.1 tttm . . . . . 0 C--O 1.259 1.599 0 N-CA-C 104.148 -2.538 . . . . 12.24 104.148 -142.55 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 109.092 -0.707 . . . . 6.78 109.092 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.432 . . 76.21 -159.0 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 109.588 -0.523 . . . . 4.98 109.588 -169.939 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.58 93.31 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 128.458 2.703 . . . . 5.81 110.222 -176.722 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . 0.271 30.8 tt0 -102.54 -97.12 0.0 OUTLIER Pre-proline 0 CA--C 1.553 1.078 0 CA-C-O 116.639 -1.648 . . . . 6.22 111.902 -171.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -79.25 156.21 25.74 Favored 'Trans proline' 0 C--N 1.352 0.72 0 CA-C-N 123.92 2.436 . . . . 3.52 111.085 -177.391 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 53.2 mt -140.75 163.7 32.19 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.638 1.175 . . . . 3.6 110.474 -166.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 14.0 t -94.39 -167.98 1.76 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 124.642 1.177 . . . . 2.19 108.971 164.389 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -71.83 -63.74 1.07 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.598 0.759 . . . . 2.53 112.765 -169.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 28.0 mt -50.77 -51.32 51.49 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 120.62 1.554 . . . . 2.16 111.26 173.481 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -51.98 -41.37 62.08 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.897 2.479 . . . . 3.39 110.416 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -64.73 -58.57 5.9 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.203 1.401 . . . . 4.35 110.437 171.162 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 86.0 p -53.89 -36.07 62.28 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.409 -0.807 . . . . 2.19 112.292 -172.447 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.9 -32.95 46.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 O-C-N 121.952 -0.467 . . . . 2.27 112.185 174.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.97 -54.11 43.52 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 119.261 0.937 . . . . 3.63 109.047 170.503 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.2 m -38.75 -51.69 1.7 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.498 1.119 . . . . 3.6 111.663 -178.64 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 34.2 m -70.57 -39.46 76.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 121.098 -1.002 . . . . 1.94 111.99 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 55.6 t -57.1 -54.11 34.52 Favored 'Isoleucine or valine' 0 C--N 1.339 0.114 0 CA-C-N 118.655 0.661 . . . . 2.55 109.859 174.842 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -59.24 -46.42 88.53 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.47 0.577 . . . . 1.99 110.798 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 96.7 m -55.26 -51.52 66.37 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.014 -1.054 . . . . 2.17 110.627 174.784 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -51.47 -47.2 63.25 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.67 -0.644 . . . . 8.39 111.442 173.795 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -57.68 -48.36 79.76 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.586 1.154 . . . . 3.88 111.227 -179.235 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 81.4 p -57.27 -37.44 72.37 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.767 -0.583 . . . . 2.57 111.143 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -72.44 -40.67 66.89 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 118.145 0.43 . . . . 4.42 110.568 173.026 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -51.73 -37.56 51.54 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 125.868 1.667 . . . . 1.83 110.025 -176.43 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -55.18 -29.72 58.44 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 118.081 -0.962 . . . . 4.94 112.088 -178.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -51.73 -65.61 0.53 Allowed 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 114.786 1.402 . . . . 2.23 114.786 -151.921 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -91.02 -77.35 0.42 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 119.082 -1.047 . . . . 3.98 113.521 -166.024 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.71 159.27 24.68 Favored Glycine 0 C--N 1.337 0.593 0 C-N-CA 127.279 2.371 . . . . 2.48 109.86 153.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 80.4 mtt-85 49.51 102.91 0.01 OUTLIER 'General case' 0 C--O 1.242 0.706 0 N-CA-C 115.127 1.529 . . . . 4.74 115.127 142.043 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -67.99 32.62 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.775 2.03 . . . . 3.83 114.473 173.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -144.41 -58.47 0.37 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 106.911 -1.515 . . . . 4.12 106.911 -164.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 32.4 p -79.18 111.68 15.64 Favored 'General case' 0 N--CA 1.438 -1.042 0 N-CA-C 107.345 -1.354 . . . . 2.86 107.345 168.6 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -57.55 135.16 56.62 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 106.993 -1.484 . . . . 2.92 106.993 162.061 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 13.0 m -109.65 152.36 25.68 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.84 1.256 . . . . 3.47 108.952 -174.21 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 10.4 p -87.6 49.15 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 O-C-N 120.254 -1.529 . . . . 3.6 110.83 -179.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -157.75 52.71 0.46 Allowed 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 106.08 -1.822 . . . . 2.18 106.08 138.639 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 70.2 mt-10 -131.74 -49.32 0.96 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 130.963 3.705 . . . . 2.23 105.233 161.958 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -50.28 -57.16 8.47 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 120.506 -0.478 . . . . 4.44 110.09 171.587 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . 0.292 15.7 ttmt -59.73 -41.81 91.75 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-O 117.94 -1.029 . . . . 3.6 111.522 -178.413 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -50.5 -48.71 56.81 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 119.461 1.028 . . . . 3.26 110.267 173.365 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.97 -46.58 77.55 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.507 -0.923 . . . . 2.87 108.507 -169.997 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.0 m -68.93 -44.41 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 C-N-CA 120.728 -0.389 . . . . 1.75 110.294 -176.637 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 86.1 m -58.63 -50.27 74.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.567 0.747 . . . . 2.16 110.466 178.047 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -80.14 -59.65 2.63 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 123.585 0.754 . . . . 2.22 110.981 -169.286 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -75.54 -50.58 15.22 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 113.143 0.794 . . . . 4.42 113.143 -169.056 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.08 -27.91 3.57 Favored Pre-proline 0 CA--C 1.539 0.523 0 N-CA-C 115.248 1.574 . . . . 2.95 115.248 -151.266 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -63.56 -12.1 29.4 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 121.824 -2.157 . . . . 2.97 111.046 -68.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 35.2 t60 -113.64 -32.44 6.17 Favored 'General case' 0 C--N 1.344 0.347 0 C-N-CA 125.736 1.614 . . . . 3.72 111.373 -174.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 23.3 tp -50.77 -51.99 45.09 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.399 0.545 . . . . 2.25 110.22 -175.298 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 98.1 mt -99.89 140.77 33.62 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 105.694 -1.965 . . . . 2.1 105.694 153.943 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.0 28.29 2.13 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 126.756 2.022 . . . . 5.61 108.273 -167.192 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -142.47 32.22 1.48 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 125.858 1.663 . . . . 6.1 108.562 -156.646 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 11.4 m -74.7 -10.58 13.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 C-N-CA 125.599 1.56 . . . . 2.43 112.711 -173.759 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.91 -65.32 3.48 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 107.165 -2.374 . . . . 2.89 107.165 162.279 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 2.4 p -72.01 40.01 0.07 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.016 2.126 . . . . 4.29 112.724 175.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -64.26 -30.01 71.08 Favored 'General case' 0 N--CA 1.441 -0.887 0 O-C-N 120.986 -1.071 . . . . 2.15 108.205 165.876 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.1 -52.78 32.04 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.942 -0.551 . . . . 4.5 110.302 173.823 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -47.17 -59.5 3.11 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 124.023 0.929 . . . . 3.3 109.351 175.376 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 7.6 mmpt? -60.75 -51.38 69.57 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.047 -0.524 . . . . 5.8 109.752 -172.234 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.5 ttp -56.0 -47.05 78.46 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 123.259 0.624 . . . . 3.29 110.419 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -60.62 -40.8 93.2 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.738 1.215 . . . . 5.25 110.355 179.257 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 20.0 m -71.43 -31.21 66.95 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.868 0.867 . . . . 2.26 112.269 175.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 22.2 mt -73.04 -55.33 6.67 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.988 0.915 . . . . 2.78 109.54 179.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . 0.411 ' O ' ' N ' ' B' ' 66' ' ' ASN . 23.8 t70 -71.04 -10.45 59.77 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.628 2.371 . . . . 1.55 116.892 -161.162 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 24.7 m -33.26 -17.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 131.626 3.971 . . . . 2.65 119.36 -142.222 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' B' ' 64' ' ' ASP . 2.3 m120 -40.63 -43.69 1.97 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.831 1.196 . . . . 3.37 110.559 151.366 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 65.53 61.16 0.7 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.324 1.45 . . . . 3.81 109.677 -170.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 18.0 p30 -119.63 -16.45 8.83 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.059 2.144 . . . . 2.27 113.0 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 8.2 t 74.44 5.24 4.55 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.384 1.874 . . . . 4.52 114.47 -178.7 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -106.21 109.72 21.74 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 124.991 1.316 . . . . 3.52 107.791 166.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -90.63 89.36 7.5 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.681 0.792 . . . . 2.4 108.918 -179.015 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 3.3 ttpp -84.79 177.48 7.99 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 128.082 2.553 . . . . 4.27 112.08 -171.552 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -82.03 53.42 2.21 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.493 -1.38 . . . . 5.88 113.869 -168.314 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -168.19 51.62 0.05 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 124.841 2.258 . . . . 2.83 106.12 122.624 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -95.6 -63.25 1.18 Allowed 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 126.93 2.092 . . . . 2.13 108.815 150.576 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -68.8 -26.34 65.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.308 -1.315 . . . . 6.57 112.824 -165.409 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.504 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 0.0 OUTLIER -45.13 -50.1 11.46 Favored 'General case' 0 C--N 1.347 0.472 0 N-CA-C 107.58 -1.267 . . . . 5.86 107.58 170.7 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 75.5 mtm-85 -48.12 -36.41 13.27 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-O 117.203 -1.379 . . . . 7.41 113.402 -165.054 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 5.4 tp -53.63 -51.42 63.16 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 120.923 1.692 . . . . 2.13 111.299 174.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 24.5 mt -63.74 -40.18 88.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 126.045 1.738 . . . . 2.27 107.587 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -45.27 -54.79 7.04 Favored Glycine 0 N--CA 1.443 -0.85 0 N-CA-C 108.891 -1.683 . . . . 2.25 108.891 171.51 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -68.0 -53.71 23.97 Favored 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 125.964 1.706 . . . . 2.18 109.004 -172.812 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 18.3 mt -40.31 -49.18 2.74 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.18 1.392 . . . . 3.58 111.401 -177.104 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -47.1 -45.17 21.89 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.489 0.716 . . . . 2.4 111.687 177.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -81.06 -37.98 28.14 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.651 0.612 . . . . 2.38 112.651 172.324 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -65.68 -21.14 66.52 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.388 0.994 . . . . 3.3 112.508 -172.388 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 1.9 tp -45.33 -45.31 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 O-C-N 120.92 -1.113 . . . . 2.28 109.217 165.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.4 -54.29 5.59 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.191 0.996 . . . . 7.14 111.035 174.609 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 68.1 mttt -87.9 122.49 31.59 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 125.454 1.502 . . . . 5.65 112.072 -171.563 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 11.0 mptt -83.98 -36.93 22.84 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 120.494 -1.379 . . . . 8.89 110.728 -176.283 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -148.89 -1.5 0.49 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.692 1.197 . . . . 6.75 111.72 -176.351 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -97.68 53.54 1.13 Allowed 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.527 -0.733 . . . . 5.57 110.361 -138.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 1.6 pt? -125.02 -73.87 0.63 Allowed 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.333 0.864 . . . . 6.36 113.333 -175.556 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 13.5 mptt 23.65 52.71 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 127.038 2.135 . . . . 9.78 113.517 -161.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 20.0 tt -76.02 110.05 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 N-CA-C 109.207 -0.664 . . . . 9.6 109.207 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.69 102.61 2.22 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.326 0.651 . . . . 8.66 109.447 -177.484 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 24.7 tptt -176.01 135.06 0.27 Allowed 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 106.845 -1.539 . . . . 7.43 106.845 -174.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 1.3 tmtm? . . . . . 0 C--O 1.254 1.298 0 N-CA-C 103.187 -2.894 . . . . 7.97 103.187 168.22 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.472 0.638 0 N-CA-C 105.913 -1.884 . . . . 9.27 105.913 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.11 167.81 15.3 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.932 0.787 . . . . 4.01 109.245 164.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 89.32 57.73 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 127.931 2.492 . . . . 5.39 108.75 -171.32 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -68.75 114.74 24.61 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 125.397 1.479 . . . . 4.35 108.747 -175.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.77 105.48 2.09 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.407 2.071 . . . . 3.46 110.0 -173.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.72 160.71 26.14 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 108.206 -1.035 . . . . 4.1 108.206 168.427 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -64.15 154.99 32.99 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 121.056 -1.027 . . . . 3.31 110.388 -174.812 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -33.47 -48.29 0.25 Allowed 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 125.287 1.435 . . . . 2.48 112.297 160.666 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.2 mt -67.15 -45.01 78.35 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 118.257 -0.878 . . . . 2.31 110.223 -175.068 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -58.12 -53.35 59.24 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.519 1.527 . . . . 2.46 111.013 172.486 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -47.29 -60.35 2.55 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.366 1.066 . . . . 3.36 109.017 176.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.4 p -60.67 -49.12 78.79 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.732 0.642 . . . . 1.89 112.732 -177.347 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.254 2.4 pp -62.38 -38.79 82.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 O-C-N 120.854 -1.154 . . . . 1.67 109.99 -177.074 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -62.32 -48.79 78.28 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 119.736 -0.785 . . . . 3.36 110.699 173.226 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -55.98 -40.66 73.63 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.755 0.788 . . . . 2.12 111.652 -176.953 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.8 m -75.2 -36.94 38.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 O-C-N 120.573 -1.329 . . . . 1.85 111.088 176.417 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.4 t -56.42 -46.69 82.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 119.592 1.087 . . . . 1.69 110.648 174.233 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.3 t -64.76 -43.08 94.47 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.565 -0.709 . . . . 1.84 110.877 178.435 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.8 m -57.55 -51.99 67.25 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.487 0.585 . . . . 1.85 110.068 176.88 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -45.74 -56.6 5.1 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 124.052 0.941 . . . . 4.4 109.883 170.456 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -53.14 -51.61 61.4 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 123.441 0.696 . . . . 4.88 111.543 -175.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.9 t -60.38 -36.72 78.72 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 120.1 -0.64 . . . . 3.64 111.571 -178.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -69.92 -39.91 75.86 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 119.901 1.228 . . . . 3.74 111.096 171.22 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.02 -31.7 71.32 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 121.072 -1.017 . . . . 1.61 111.525 -168.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -80.02 -18.33 50.49 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 117.494 -1.241 . . . . 4.74 113.537 -178.6 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -45.24 -60.97 1.84 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.848 1.204 . . . . 2.31 113.787 -170.732 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -111.42 92.09 3.91 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 127.408 2.283 . . . . 2.93 106.116 -177.848 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 46.14 -168.21 0.05 OUTLIER Glycine 0 CA--C 1.527 0.821 0 C-N-CA 125.697 1.618 . . . . 1.75 112.693 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 48.7 mtm-85 27.65 91.79 0.01 OUTLIER 'General case' 0 C--O 1.24 0.574 0 C-N-CA 126.456 1.902 . . . . 7.05 112.525 166.282 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -79.6 53.28 1.55 Allowed 'General case' 0 C--O 1.232 0.142 0 C-N-CA 128.483 2.713 . . . . 5.27 108.662 -172.683 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -175.51 -60.79 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 106.945 -1.502 . . . . 4.02 106.945 -156.404 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.2 p -84.52 134.12 34.44 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-O 122.34 1.066 . . . . 2.93 112.141 170.671 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.5 mm? -95.55 124.59 39.65 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.857 1.263 . . . . 3.57 108.506 176.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.6 t -82.61 173.83 11.59 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.355 1.462 . . . . 3.13 109.058 173.252 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 32.9 m -70.21 -42.86 79.07 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 O-C-N 122.014 -0.429 . . . . 3.93 110.82 -175.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -67.45 -49.05 65.37 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 118.272 -0.871 . . . . 2.48 109.643 176.224 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -39.77 -50.64 2.37 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.119 1.367 . . . . 2.22 110.307 168.506 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -57.67 -59.11 5.69 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.861 -0.609 . . . . 3.96 110.95 175.21 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -52.09 -42.17 63.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.522 -0.308 . . . . 4.39 111.18 -176.095 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -51.89 -42.37 62.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 123.256 0.622 . . . . 3.17 111.459 177.941 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -63.08 -50.14 71.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 119.303 0.956 . . . . 4.01 108.788 -176.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.2 m -72.48 -32.24 41.08 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.168 0 CA-C-N 115.804 -0.635 . . . . 2.02 110.3 -172.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 92.7 m -75.42 -38.71 59.67 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.169 0.987 . . . . 2.33 110.735 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -79.86 -55.67 4.81 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.285 0.634 . . . . 2.5 110.239 -173.127 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -92.47 -126.74 0.09 Allowed 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.446 -0.946 . . . . 4.38 108.446 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.9 mm? 29.5 63.46 0.82 Allowed Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 127.578 2.351 . . . . 3.82 114.499 179.136 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -71.58 -44.59 1.0 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.602 2.202 . . . . 1.74 112.298 -179.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -146.05 61.36 1.25 Allowed 'General case' 0 C--N 1.341 0.233 0 CA-C-N 118.907 0.776 . . . . 4.44 109.956 -172.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.436 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 3.8 tp -144.33 -113.67 0.1 Allowed 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 107.726 -1.213 . . . . 2.08 107.726 -176.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 76.9 mt -59.0 162.12 4.49 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.776 0.716 . . . . 2.22 109.186 162.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.38 -159.13 0.56 Allowed 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.889 0.875 . . . . 7.17 109.211 -166.018 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 55.07 37.15 28.45 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.828 1.251 . . . . 3.77 108.866 -175.178 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.43 -24.42 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 C-N-CA 126.124 1.77 . . . . 4.27 112.505 -167.679 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.93 -53.72 40.79 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 110.298 -1.121 . . . . 2.03 110.298 171.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 34.0 t -84.17 46.63 1.22 Allowed 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.554 0.742 . . . . 2.59 110.098 -174.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -53.68 -32.54 52.12 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.07 0.948 . . . . 2.21 110.116 -176.494 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -38.04 -47.72 1.13 Allowed 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 127.321 2.248 . . . . 3.71 113.158 175.329 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -64.21 -46.24 84.72 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.861 -0.524 . . . . 4.02 109.992 -175.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.29 -52.66 63.78 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.037 -1.097 . . . . 4.53 108.037 175.417 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -46.52 -56.72 5.57 Favored 'General case' 0 C--O 1.225 -0.196 0 C-N-CA 123.406 0.683 . . . . 2.81 111.061 177.759 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -66.19 -37.57 85.92 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.103 0.411 . . . . 4.26 111.329 -176.017 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.7 t -58.64 -45.17 89.86 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.982 -0.449 . . . . 2.77 110.602 173.711 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 19.2 mt -70.2 -58.93 3.23 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.726 0.81 . . . . 2.57 110.417 -176.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -78.61 75.64 5.12 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 124.074 0.949 . . . . 1.88 109.057 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.5 m -51.32 -28.16 7.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 123.417 0.687 . . . . 3.49 112.184 176.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -70.08 -33.6 72.1 Favored 'General case' 0 CA--C 1.529 0.156 0 O-C-N 121.989 -0.444 . . . . 3.96 110.91 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 53.15 53.67 11.54 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.739 1.215 . . . . 4.68 109.29 -161.149 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -102.35 -13.18 17.42 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.429 1.891 . . . . 1.97 111.525 176.1 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.9 m 66.17 17.57 10.77 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.073 1.349 . . . . 2.34 112.837 -177.0 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -111.56 112.12 23.62 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.751 -1.574 . . . . 3.12 106.751 158.351 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -82.97 93.7 7.6 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 104.256 -2.498 . . . . 1.88 104.256 166.227 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.14 161.96 25.81 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.346 -0.983 . . . . 3.76 108.346 176.383 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.63 -60.54 0.95 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.57 1.148 . . . . 6.99 112.955 -169.073 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -69.15 -22.3 63.95 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.666 0.786 . . . . 2.13 111.68 -175.242 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -72.69 -56.67 4.95 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 118.448 0.567 . . . . 2.4 109.597 173.017 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -52.72 -48.77 66.44 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.301 -0.629 . . . . 4.11 109.301 178.097 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.475 ' NE1' ' CA ' ' B' ' 81' ' ' GLY . 58.8 t-105 -46.66 -35.87 6.45 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.693 -1.139 . . . . 6.0 111.257 -179.02 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 77.9 mtt-85 -41.47 -45.86 3.31 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 120.182 1.356 . . . . 5.35 111.568 176.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 7.9 tp -49.94 -40.8 44.76 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 122.764 0.426 . . . . 1.94 110.408 -177.586 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 25.7 mt -74.79 -26.14 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 N-CA-C 109.09 -0.707 . . . . 2.13 109.09 -174.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.434 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -56.37 -43.69 89.89 Favored Glycine 0 CA--C 1.501 -0.786 0 N-CA-C 109.83 -1.308 . . . . 1.28 109.83 164.453 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 24.8 mm-40 -80.6 -30.77 36.83 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 117.687 -1.149 . . . . 3.11 110.546 -178.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.436 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 8.6 mp -54.38 -59.86 4.12 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 122.189 2.268 . . . . 3.37 108.391 167.756 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.58 -53.66 51.65 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.978 0.894 . . . . 1.74 110.6 -178.766 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.6 ttpp -63.36 -40.71 98.02 Favored 'General case' 0 C--O 1.211 -0.954 0 CA-C-O 116.683 -1.627 . . . . 2.65 110.746 -178.261 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -51.09 -51.15 56.19 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 122.233 2.288 . . . . 3.23 108.834 178.091 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.8 mt -52.57 -47.39 48.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 N-CA-C 111.417 0.154 . . . . 3.03 111.417 171.529 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . 2.144 41.6 mtt85 -38.98 -58.38 1.12 Allowed 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 115.462 1.653 . . . . 8.69 115.462 161.393 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -81.05 162.02 23.94 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 127.374 2.27 . . . . 5.05 113.737 -127.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -45.26 -47.43 12.86 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 127.544 2.338 . . . . 15.99 113.163 -167.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.6 ttpt -133.49 22.97 4.02 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 117.74 -1.124 . . . . 9.93 111.165 -174.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.0 t70 24.36 -114.16 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.033 2.133 . . . . 8.36 111.854 173.323 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 24.9 tp -86.85 -39.23 16.05 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.614 1.565 . . . . 13.63 107.878 160.885 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -141.51 178.67 7.29 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 125.482 1.513 . . . . 11.93 107.483 171.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 47.0 mm -55.82 130.14 17.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 N-CA-C 107.191 -1.411 . . . . 9.84 107.191 147.058 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.69 -174.94 4.18 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 126.867 2.067 . . . . 14.77 105.449 -178.166 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -174.13 135.17 0.46 Allowed 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 105.032 -2.21 . . . . 13.85 105.032 -174.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 32.3 tptt . . . . . 0 C--O 1.251 1.133 0 N-CA-C 102.915 -2.994 . . . . 12.47 102.915 159.28 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.393 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.054 0 N-CA-C 109.866 -0.42 . . . . 7.63 109.866 . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -171.69 -169.07 0.65 Allowed 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.984 2.114 . . . . 5.75 107.613 -169.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 106.24 101.64 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 129.374 3.069 . . . . 6.89 114.605 -172.714 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . 0.338 8.0 tt0 179.53 -147.65 0.0 OUTLIER Pre-proline 0 CA--C 1.542 0.652 1 C-N-CA 132.227 4.211 . . . . 9.07 107.255 153.397 . . . . . . . . 3 2 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 67.2 Cg_endo -56.29 135.25 69.1 Favored 'Trans proline' 0 C--N 1.353 0.795 0 CA-C-N 125.023 2.83 . . . . 3.29 112.88 -151.27 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -167.08 166.35 15.19 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.912 0.885 . . . . 6.1 109.398 -155.897 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 13.4 t -82.49 -165.45 1.04 Allowed 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 119.306 0.957 . . . . 1.91 111.016 -179.483 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -72.62 -60.76 2.08 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 123.633 0.773 . . . . 2.13 111.41 -167.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 10.6 mt -56.68 -37.74 71.27 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 120.492 -1.38 . . . . 2.06 110.617 177.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 89.1 mt-10 -59.5 -43.48 93.34 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.757 0.823 . . . . 2.94 111.848 174.325 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.01 -46.06 86.2 Favored 'General case' 0 C--N 1.339 0.146 0 O-C-N 120.79 -1.194 . . . . 5.11 108.917 177.531 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -59.03 -46.29 88.58 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.742 -0.663 . . . . 2.74 110.816 -176.877 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.2 pp -66.98 -40.49 85.74 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 O-C-N 121.529 -0.732 . . . . 1.88 110.997 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.51 -55.14 37.07 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.179 0.899 . . . . 3.2 110.541 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.8 t -52.84 -36.56 58.99 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.103 0.865 . . . . 1.91 111.593 -173.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 24.3 m -78.01 -38.29 24.1 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 O-C-N 121.237 -0.914 . . . . 1.93 111.746 175.046 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 26.0 t -56.5 -51.0 70.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 119.395 0.998 . . . . 1.72 110.466 173.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 15.3 t -61.36 -40.09 93.02 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.421 1.009 . . . . 1.97 110.85 178.918 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 68.1 m -57.23 -54.63 44.65 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.421 -0.799 . . . . 2.0 110.278 173.491 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -45.53 -53.3 9.16 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 123.814 0.846 . . . . 5.25 109.654 172.663 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -58.73 -52.33 66.14 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.194 1.398 . . . . 3.72 110.721 -174.485 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 4.6 t -66.41 -26.57 67.3 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.995 -0.526 . . . . 3.31 111.684 -177.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -80.15 -36.95 34.43 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 120.033 1.288 . . . . 4.07 111.422 168.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.32 -32.17 72.89 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 120.833 -1.167 . . . . 1.93 109.927 -173.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -19.54 65.27 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 117.421 -1.276 . . . . 5.42 113.44 178.936 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -51.1 -64.7 0.73 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 115.168 1.544 . . . . 2.13 115.168 -158.909 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -91.27 -77.37 0.42 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 119.757 -0.777 . . . . 2.83 112.581 -169.902 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.99 156.92 23.15 Favored Glycine 0 C--N 1.338 0.652 0 C-N-CA 127.77 2.605 . . . . 2.68 110.368 158.146 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 48.3 101.32 0.01 OUTLIER 'General case' 0 C--O 1.244 0.81 0 N-CA-C 115.772 1.767 . . . . 4.42 115.772 142.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 7.1 pttt -67.73 55.44 0.06 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 128.113 2.565 . . . . 4.38 112.121 172.952 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -155.86 -49.05 0.08 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 126.465 1.906 . . . . 3.51 107.156 -157.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 49.0 p -99.75 149.22 23.56 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 125.524 1.53 . . . . 2.24 111.203 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -93.08 117.68 30.34 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 107.168 -1.419 . . . . 3.33 107.168 139.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 4.6 t -83.2 -170.65 3.15 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 126.054 1.741 . . . . 2.84 108.648 161.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.456 ' C ' ' H ' ' B' ' 37' ' ' GLU . 0.1 OUTLIER -64.83 -103.83 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.362 0 C-N-CA 130.252 3.421 . . . . 3.99 102.475 -166.798 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -75.5 55.96 0.85 Allowed 'General case' 0 CA--C 1.551 0.995 0 O-C-N 118.918 -2.364 . . . . 2.76 111.45 -178.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . 0.456 ' H ' ' C ' ' B' ' 35' ' ' VAL . 2.3 tt0 -116.43 -56.89 2.25 Favored 'General case' 0 N--CA 1.448 -0.561 1 C-N-CA 132.68 4.392 . . . . 2.84 103.716 158.404 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.58 -48.58 66.13 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.757 0.823 . . . . 3.83 109.221 173.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -51.18 -42.53 60.91 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 120.635 -0.426 . . . . 4.64 111.118 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -59.26 -37.87 78.68 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 118.111 0.414 . . . . 2.91 111.778 177.463 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 tt -68.76 -48.96 62.38 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.939 0.79 . . . . 2.94 109.639 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 2.4 m -66.57 -39.5 84.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 120.877 0.37 . . . . 1.82 110.039 -175.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 97.0 m -63.43 -56.5 15.71 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.455 0.702 . . . . 2.0 110.727 174.862 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -80.36 -57.4 3.62 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.749 0.419 . . . . 2.2 111.617 -164.794 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -79.46 -46.78 16.82 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 111.826 0.306 . . . . 3.23 111.826 -164.178 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 4.5 mm? -59.25 -37.55 53.48 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 113.505 0.928 . . . . 3.41 113.505 -166.102 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -60.11 -33.82 94.89 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 121.706 -2.206 . . . . 2.36 110.083 -62.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -84.64 -46.41 11.53 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.254 1.021 . . . . 4.74 112.871 -164.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 3.5 tp -42.02 -59.15 1.83 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.085 1.354 . . . . 1.8 111.428 -176.99 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 29.7 mt -79.74 66.09 5.1 Favored 'General case' 0 C--N 1.34 0.165 0 CA-C-O 122.111 0.958 . . . . 2.83 110.867 172.108 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -30.32 137.05 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 125.647 1.579 . . . . 6.55 112.257 152.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 27.1 t0 56.2 71.25 0.57 Allowed 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.924 1.689 . . . . 3.52 110.121 -167.262 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 24.8 m -72.4 -1.37 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-N 112.262 -2.245 . . . . 2.23 111.462 159.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -80.7 -56.65 3.07 Favored Glycine 0 C--N 1.342 0.898 0 N-CA-C 109.389 -1.485 . . . . 2.66 109.389 -174.171 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.29 52.04 0.73 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 122.362 1.077 . . . . 3.16 110.618 179.348 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -61.3 -40.18 93.22 Favored 'General case' 0 N--CA 1.439 -0.992 0 O-C-N 120.891 -1.13 . . . . 2.47 108.933 179.251 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -54.09 -53.17 56.88 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.398 1.079 . . . . 3.48 111.547 175.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -50.13 -60.16 3.22 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.862 1.265 . . . . 2.41 109.226 176.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.42 -57.31 13.51 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.427 -0.583 . . . . 5.02 109.427 -175.581 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -43.52 -54.89 4.57 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.912 1.685 . . . . 2.99 110.733 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 16.1 mtpp -56.61 -47.13 80.32 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.767 0.427 . . . . 4.67 111.454 175.429 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.2 t -60.71 -31.9 71.16 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 118.979 -0.534 . . . . 2.64 112.253 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 7.0 mp -75.54 -53.73 8.15 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.06 0.845 . . . . 3.25 110.061 174.458 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -53.65 -9.29 0.2 Allowed 'General case' 0 C--O 1.222 -0.374 0 N-CA-C 117.462 2.393 . . . . 2.19 117.462 -167.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.6 m -35.54 -23.04 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 129.649 3.18 . . . . 3.03 119.119 -127.674 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -51.38 -32.36 25.78 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.429 1.468 . . . . 4.08 111.544 159.072 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 64.01 55.05 1.61 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.579 0.751 . . . . 3.28 109.155 177.342 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 51.7 p30 -91.83 -17.67 24.96 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.519 1.128 . . . . 2.27 110.562 173.836 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 79.95 13.11 1.01 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.455 1.502 . . . . 2.46 112.544 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -124.33 101.81 7.37 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 106.857 -1.534 . . . . 3.0 106.857 167.117 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.13 106.6 7.82 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 106.684 -1.598 . . . . 2.55 106.684 175.854 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 48.9 tttt -83.78 178.84 7.76 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.506 1.522 . . . . 4.34 110.652 -162.652 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -83.53 80.19 9.19 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.994 1.318 . . . . 6.2 110.553 177.932 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . 0.363 28.4 t-20 123.9 -164.79 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 113.37 -3.205 . . . . 4.84 103.915 -110.082 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -31.86 -37.7 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 124.519 3.327 . . . . 2.39 116.798 -148.762 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -40.53 -53.97 2.59 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 121.112 1.778 . . . . 4.47 111.503 166.307 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.47 ' CH2' ' CD1' ' A' ' 77' ' ' TRP . 58.6 t90 -40.1 -32.03 0.15 Allowed 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 126.768 2.027 . . . . 4.99 114.838 173.542 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -46.54 -45.22 18.51 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 121.114 1.779 . . . . 7.96 110.276 170.532 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.7 tp -44.82 -49.74 10.61 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 124.725 1.21 . . . . 2.16 111.497 177.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . 0.322 8.7 tt -75.35 -21.84 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 N-CA-C 106.569 -1.641 . . . . 3.87 106.569 -166.789 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.475 ' CA ' ' NE1' ' A' ' 77' ' ' TRP . . . -59.03 -50.62 65.88 Favored Glycine 0 CA--C 1.491 -1.408 0 C-N-CA 125.003 1.287 . . . . 1.75 110.46 167.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -67.62 -47.39 69.75 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 106.871 -1.529 . . . . 2.19 106.871 -176.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 10.6 mp -44.0 -61.06 1.58 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 120.678 1.581 . . . . 3.19 111.803 171.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.31 -44.42 84.12 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.84 0.856 . . . . 1.96 111.561 -177.152 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -65.3 -54.04 35.03 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.977 1.311 . . . . 2.62 110.227 -177.756 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -57.01 -38.91 73.79 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.582 1.553 . . . . 2.46 110.931 -173.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 2.0 tt -51.38 -36.46 17.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 118.814 0.733 . . . . 2.32 111.082 175.293 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.45 -49.82 10.17 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.736 0.815 . . . . 6.93 109.754 174.615 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -115.58 97.0 5.9 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 126.264 1.826 . . . . 6.71 111.927 -160.168 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . 0.415 ' NZ ' ' OD2' ' B' ' 92' ' ' ASP . 18.0 pttp -39.49 -43.51 1.27 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.726 1.211 . . . . 6.22 114.038 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? -162.58 42.63 0.12 Allowed 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 119.715 1.143 . . . . 6.28 109.606 154.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . 0.415 ' OD2' ' NZ ' ' B' ' 90' ' ' LYS . 1.0 OUTLIER -106.57 78.72 1.29 Allowed 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 122.981 0.512 . . . . 4.81 110.054 -155.968 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 21.8 tp -139.85 -64.46 0.48 Allowed 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 124.001 0.921 . . . . 7.55 108.64 170.151 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.55 171.83 7.36 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.532 0.605 . . . . 9.06 110.235 -178.277 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 40.7 pt -140.77 28.39 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 125.334 1.454 . . . . 9.11 109.984 169.433 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 10.4 tpt85 -161.66 168.41 23.43 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 108.33 -0.989 . . . . 6.57 108.33 -175.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -176.27 137.92 0.31 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 129.952 3.301 . . . . 7.81 103.171 -168.208 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? . . . . . 0 C--O 1.256 1.413 0 N-CA-C 102.887 -3.005 . . . . 6.83 102.887 158.264 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.6 mtt . . . . . 0 N--CA 1.472 0.641 0 N-CA-C 106.169 -1.789 . . . . 7.35 106.169 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.7 171.27 13.59 Favored 'General case' 0 C--O 1.232 0.16 0 O-C-N 124.049 0.843 . . . . 4.96 109.769 168.492 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.66 86.5 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 C-N-CA 129.059 2.944 . . . . 3.91 108.843 -176.334 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.2 mp0 -85.8 123.09 72.76 Favored Pre-proline 0 N--CA 1.448 -0.557 0 C-N-CA 123.864 0.866 . . . . 4.5 110.26 -156.449 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.52 104.81 1.64 Allowed 'Trans proline' 0 N--CA 1.45 -1.032 0 C-N-CA 122.313 2.009 . . . . 2.95 109.564 -179.208 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 64.5 mt -59.28 152.11 21.7 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 108.951 -0.759 . . . . 2.47 108.951 170.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.3 t -70.17 171.76 9.19 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 120.436 -0.505 . . . . 2.16 110.188 -178.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -63.77 -55.58 22.06 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 121.109 -0.995 . . . . 2.89 110.914 -172.634 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.1 mp -57.13 -41.33 78.86 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 118.833 -1.147 . . . . 2.75 110.148 -176.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -57.59 -51.15 70.68 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 127.835 2.454 . . . . 2.46 111.284 175.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -52.87 63.83 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 108.665 -0.865 . . . . 5.12 108.665 177.887 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.9 m -61.09 -46.93 88.65 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 111.805 0.298 . . . . 2.87 111.805 -175.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . 0.401 ' CD1' HG13 ' B' ' 87' ' ' ILE . 2.3 pp -64.1 -41.72 93.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 O-C-N 120.822 -1.174 . . . . 2.02 109.923 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -59.47 -49.25 78.51 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.402 1.001 . . . . 3.58 110.494 177.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.2 -40.52 74.15 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.597 0.713 . . . . 1.81 111.032 -175.785 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.4 m -75.45 -36.33 35.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 O-C-N 120.696 -1.252 . . . . 1.5 111.413 175.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 45.7 t -58.56 -46.56 89.93 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 CA-C-N 119.684 1.129 . . . . 1.85 110.064 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -63.43 -44.07 95.61 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.54 -0.743 . . . . 1.83 110.47 177.397 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 76.6 m -54.75 -48.32 72.74 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-N 119.01 0.823 . . . . 1.76 110.262 177.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -54.92 -61.19 2.47 Favored 'General case' 0 C--O 1.226 -0.148 0 N-CA-C 109.818 -0.438 . . . . 4.5 109.818 172.243 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -60.88 -48.76 80.32 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.261 0.624 . . . . 4.45 110.996 -163.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -62.64 -25.4 68.1 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 119.333 -0.365 . . . . 2.93 111.154 179.815 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -82.7 -58.97 2.67 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 123.407 0.683 . . . . 4.13 111.114 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -45.12 -24.28 0.23 Allowed 'General case' 0 C--O 1.238 0.472 1 C-N-CA 132.647 4.379 . . . . 2.16 115.55 178.776 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.53 -23.62 51.38 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 123.918 0.761 . . . . 4.32 112.082 169.261 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -38.49 -66.76 0.24 Allowed 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 127.231 2.213 . . . . 2.25 113.435 -163.7 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -99.99 34.25 2.36 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 108.755 -0.831 . . . . 3.11 108.755 -174.357 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 65.0 -168.04 29.72 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-O 122.374 0.985 . . . . 2.57 110.707 -164.202 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? 53.66 72.96 0.4 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.194 -1.039 . . . . 11.35 108.194 -178.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.2 pttt -61.81 -34.9 76.74 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 123.491 0.717 . . . . 5.29 111.876 -170.424 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -83.93 14.1 4.37 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 118.494 -0.765 . . . . 3.54 111.669 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.3 p -125.69 145.45 50.17 Favored 'General case' 0 C--N 1.348 0.542 0 C-N-CA 124.279 1.032 . . . . 3.28 111.601 175.851 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mt -102.75 123.41 46.37 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 108.769 -0.826 . . . . 3.56 108.769 149.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.33 177.74 8.37 Favored 'General case' 0 C--O 1.225 -0.231 0 O-C-N 121.223 -0.923 . . . . 3.16 110.15 167.574 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 93.2 t -46.44 -59.31 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 C-N-CA 123.754 0.822 . . . . 3.26 111.167 178.855 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -58.19 -59.17 5.71 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 118.757 -0.639 . . . . 2.83 109.687 -177.23 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -39.19 -47.94 1.69 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.777 1.231 . . . . 2.23 111.998 171.555 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -58.86 -58.06 10.28 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.707 0.803 . . . . 5.11 110.492 177.813 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 21.6 ttmt -61.03 -38.66 86.92 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.874 -0.33 . . . . 3.83 110.691 -174.546 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -51.86 -35.05 43.51 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 118.687 -0.673 . . . . 2.58 111.367 173.574 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.82 -43.33 75.77 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 119.978 1.263 . . . . 3.18 108.352 -176.475 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.8 m -65.57 -42.97 94.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 N-CA-C 109.542 -0.54 . . . . 2.89 109.542 -175.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.0 m -57.7 -49.34 76.86 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.807 0.843 . . . . 3.2 111.261 170.743 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -56.46 12.66 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.769 1.228 . . . . 4.34 111.933 -171.046 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -152.48 70.85 0.92 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 119.02 0.827 . . . . 4.14 111.278 -175.719 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . 0.414 ' N ' ' CD ' ' A' ' 47' ' ' PRO . 2.7 tp -156.5 31.41 0.04 OUTLIER Pre-proline 0 CA--C 1.542 0.668 0 N-CA-C 114.855 1.428 . . . . 2.59 114.855 174.372 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.414 ' CD ' ' N ' ' A' ' 46' ' ' LEU . 39.0 Cg_endo -63.03 -64.99 0.06 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 121.916 1.744 . . . . 2.18 113.586 -172.074 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -87.04 41.63 0.98 Allowed 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.096 -1.003 . . . . 4.66 111.611 -160.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.5 tp -141.95 -82.5 0.2 Allowed 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.172 0.989 . . . . 2.48 110.844 -172.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 32.0 mt -87.96 75.39 8.8 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 107.736 -1.209 . . . . 2.01 107.736 -178.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . 0.407 ' NZ ' ' OE1' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -43.13 143.61 0.77 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.568 -1.196 . . . . 7.93 110.33 160.437 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.1 t0 65.31 81.5 0.2 Allowed 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.537 1.535 . . . . 4.4 110.042 -159.985 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -88.57 3.7 5.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-N 113.539 -1.664 . . . . 3.19 110.681 163.972 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -94.77 -57.78 1.22 Allowed Glycine 0 C--N 1.342 0.897 0 N-CA-C 109.777 -1.329 . . . . 1.91 109.777 -170.013 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.5 t -90.9 30.19 1.24 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.096 1.359 . . . . 3.49 110.007 173.212 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -40.59 -38.25 0.84 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 126.244 1.818 . . . . 2.81 110.963 166.507 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -42.44 -41.92 3.08 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.328 2.251 . . . . 4.51 111.157 175.906 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -56.42 -54.65 43.09 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.548 1.139 . . . . 2.79 111.089 173.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.1 -53.79 54.24 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 106.735 -1.58 . . . . 3.91 106.735 -179.291 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -45.62 -52.12 11.14 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.081 0.953 . . . . 2.89 111.147 178.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -64.52 -29.86 70.89 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.611 -0.68 . . . . 4.88 112.493 178.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.8 t -67.83 -48.14 67.05 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.373 0.533 . . . . 2.45 110.438 173.917 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.1 mp -57.97 -48.45 79.95 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.729 -0.607 . . . . 3.14 110.167 177.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -71.8 81.65 0.88 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.515 -0.311 . . . . 2.72 110.272 -172.702 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.1 m -47.8 -36.57 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 124.032 0.933 . . . . 2.43 113.499 -174.119 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.0 p-10 -98.52 -0.12 43.95 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.295 0.85 . . . . 2.91 113.295 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 44.2 58.6 3.64 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 126.985 2.114 . . . . 5.1 112.517 178.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 45.4 p30 -100.14 -3.48 31.66 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.888 1.275 . . . . 1.69 112.317 178.271 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 28.1 m 65.17 21.92 12.18 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.977 1.311 . . . . 2.36 113.144 -174.466 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -129.43 100.6 5.62 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 105.329 -2.1 . . . . 4.09 105.329 171.652 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -81.62 88.16 6.24 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 103.151 -2.907 . . . . 2.16 103.151 176.142 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -54.2 155.59 3.61 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.746 -1.205 . . . . 5.13 107.746 176.577 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -37.18 -55.77 0.96 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.239 1.016 . . . . 6.39 112.815 -173.095 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -76.31 -18.27 59.03 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.191 0.812 . . . . 4.04 113.191 -175.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -73.79 -60.05 2.43 Favored 'General case' 0 CA--C 1.529 0.161 0 O-C-N 121.364 -0.835 . . . . 2.07 108.905 166.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -43.09 -47.79 6.11 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 124.387 1.075 . . . . 5.0 110.435 176.587 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.626 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 39.8 t90 -39.77 -41.14 1.06 Allowed 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 124.641 1.176 . . . . 5.73 112.613 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -46.45 -38.33 8.98 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 117.976 -1.012 . . . . 6.91 112.557 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.0 tp -53.2 -48.11 68.35 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 120.082 1.31 . . . . 1.99 110.346 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 53.0 mt -59.14 -30.02 42.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 N-CA-C 108.161 -1.051 . . . . 2.62 108.161 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.569 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -67.13 -50.81 43.09 Favored Glycine 0 CA--C 1.491 -1.444 0 C-N-CA 125.922 1.725 . . . . 1.28 111.399 177.012 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -67.9 -23.84 65.15 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 107.651 -1.24 . . . . 2.21 107.651 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 13.4 mt -68.01 -54.11 20.88 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 120.636 1.562 . . . . 3.04 111.647 166.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.95 -28.4 62.15 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.906 0.883 . . . . 1.72 111.527 -178.386 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -79.87 -52.67 7.59 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.727 1.611 . . . . 2.7 107.459 173.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.407 ' OE1' ' NZ ' ' A' ' 51' ' ' LYS 2.099 11.0 pt-20 -31.79 -61.05 0.24 Allowed 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 129.414 3.085 . . . . 2.93 113.42 171.916 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 8.3 tt -56.27 -32.33 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 CA-C-N 115.748 -0.66 . . . . 2.2 112.277 -172.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.33 -57.15 2.88 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.737 0.815 . . . . 5.45 109.506 176.097 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -46.99 -34.5 5.64 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 128.866 2.866 . . . . 3.66 113.065 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 11.0 tttt -29.98 -27.82 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 120.01 3.337 . . . . 9.57 120.01 -128.375 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -174.53 35.4 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 126.134 1.774 . . . . 9.51 111.844 163.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -74.08 77.73 1.73 Allowed 'General case' 0 N--CA 1.465 0.315 0 O-C-N 120.882 -1.136 . . . . 6.09 109.076 176.541 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -153.62 -34.35 0.11 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 113.778 1.029 . . . . 9.43 113.778 170.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -159.12 178.03 10.46 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.473 -0.936 . . . . 12.1 108.473 175.37 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 71.9 mt 67.77 -80.22 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 125.313 1.445 . . . . 11.51 108.997 -170.96 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.4 mmm-85 158.24 174.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 128.838 2.855 . . . . 13.27 107.004 -175.284 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 43.8 tttt -177.64 108.35 0.06 Allowed 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.26 1.824 . . . . 12.07 106.392 -178.329 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.33 0 N-CA-C 103.915 -2.624 . . . . 10.8 103.915 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 77.4 mtm . . . . . 0 N--CA 1.478 0.965 0 CA-C-O 117.658 -1.163 . . . . 6.8 109.471 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 76.54 -177.85 0.13 Allowed 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.274 1.43 . . . . 5.99 113.29 -175.965 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.48 67.44 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 129.547 3.139 . . . . 7.57 112.771 179.595 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -76.74 -71.68 0.18 Allowed Pre-proline 0 N--CA 1.444 -0.728 0 C-N-CA 126.967 2.107 . . . . 7.12 114.531 -169.728 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -42.15 133.37 4.53 Favored 'Trans proline' 0 C--N 1.355 0.898 1 C-N-CA 126.398 4.732 . . . . 3.71 115.358 -150.381 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -145.45 149.22 34.3 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 122.56 0.344 . . . . 4.18 110.99 -148.48 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 4.7 t -74.17 -168.35 0.63 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.107 1.363 . . . . 2.26 111.286 174.452 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 62.0 tt0 -67.5 -59.99 2.93 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 122.176 0.989 . . . . 2.44 111.989 -173.799 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -53.47 -40.73 65.54 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 120.552 -1.342 . . . . 2.02 110.676 176.49 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -57.81 -49.83 75.31 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.365 0.666 . . . . 2.88 112.208 173.528 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -61.44 -38.0 85.56 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 120.463 -1.398 . . . . 3.98 110.552 177.433 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 9.4 t -59.73 -49.29 78.33 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.066 0.546 . . . . 2.6 110.981 177.385 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.268 2.4 pp -62.49 -35.2 68.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 O-C-N 121.035 -1.041 . . . . 1.94 111.069 173.121 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -54.79 -59.93 4.06 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.077 -0.963 . . . . 2.81 111.063 174.027 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 12.8 t -50.65 -43.33 57.15 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.758 1.163 . . . . 1.98 112.052 -171.676 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.3 m -69.74 -43.81 79.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 O-C-N 120.967 -1.083 . . . . 1.97 110.887 177.115 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 41.1 t -55.06 -53.4 34.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-O 118.669 -0.682 . . . . 2.2 110.465 175.933 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 9.3 t -58.86 -45.97 88.87 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.334 0.97 . . . . 2.06 110.801 178.732 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 94.6 m -52.95 -55.29 24.48 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.71 0.686 . . . . 1.84 110.266 177.011 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -54.54 -44.04 72.5 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.751 -0.593 . . . . 8.65 111.482 174.762 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -64.95 -26.9 68.5 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.621 1.168 . . . . 3.49 112.299 -177.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 67.2 p -69.88 -61.29 1.84 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.366 0.985 . . . . 2.82 108.644 167.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -54.45 -29.55 49.94 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 113.105 0.78 . . . . 4.14 113.105 -177.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -51.0 -33.02 23.03 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 126.209 1.804 . . . . 2.17 111.017 176.114 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -37.95 76.03 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 117.337 -1.316 . . . . 6.34 110.825 178.616 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.468 ' CB ' ' HG2' ' B' ' 37' ' ' GLU . 1.5 tp60 -39.69 -65.82 0.35 Allowed 'General case' 0 C--O 1.24 0.582 0 O-C-N 124.962 1.414 . . . . 3.14 111.974 -143.542 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -95.24 -73.47 0.58 Allowed 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 125.531 1.769 . . . . 3.72 113.473 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.11 123.43 7.48 Favored Glycine 0 C--N 1.338 0.67 0 CA-C-O 115.584 -2.787 . . . . 2.98 112.811 178.137 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 53.2 ttt85 52.44 102.83 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 121.752 2.776 . . . . 5.56 115.08 149.694 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.61 50.32 0.18 Allowed 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 116.231 1.937 . . . . 7.41 116.231 -172.604 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -137.08 -54.09 0.7 Allowed 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 126.243 1.817 . . . . 3.33 107.618 177.006 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 56.4 p -73.38 145.84 45.59 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.834 1.253 . . . . 2.27 110.568 175.001 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.04 -173.3 4.65 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 108.496 -0.927 . . . . 3.03 108.496 157.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . 0.273 3.9 t -157.4 -167.98 2.46 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 122.771 1.272 . . . . 3.02 113.581 -158.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 15.9 t -68.17 -131.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.651 1 N-CA-C 98.204 -4.739 . . . . 3.74 98.204 151.319 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 15.2 t30 -75.26 56.1 0.8 Allowed 'General case' 0 CA--C 1.557 1.217 0 O-C-N 118.062 -2.899 . . . . 2.87 112.323 -160.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . 0.468 ' HG2' ' CB ' ' B' ' 26' ' ' GLN . 58.0 mt-10 -102.85 -50.81 3.43 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 128.971 2.908 . . . . 1.91 107.688 139.966 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -56.07 -52.16 65.27 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.223 -1.028 . . . . 4.17 108.223 174.023 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . 0.266 53.5 tttm -54.28 -45.7 72.54 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 118.602 -1.239 . . . . 4.77 110.24 -175.113 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -57.93 -39.62 78.48 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 119.116 -0.468 . . . . 2.83 112.219 176.873 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 4.7 tt -66.87 -46.01 76.33 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 119.626 1.103 . . . . 2.82 109.699 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 27.4 m -69.94 -44.27 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-O 121.551 0.691 . . . . 2.0 109.219 -173.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 86.8 m -66.0 -49.98 65.88 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.262 1.025 . . . . 2.15 109.855 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -80.52 -62.46 1.67 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.256 0.222 . . . . 2.67 111.173 -171.471 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -83.9 -44.12 14.59 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 122.897 0.479 . . . . 3.09 112.14 -167.867 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.8 tp -82.71 -18.79 0.26 Allowed Pre-proline 0 CA--C 1.548 0.869 0 N-CA-C 118.768 2.877 . . . . 2.93 118.768 -167.54 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -46.2 -44.6 19.53 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 124.091 3.194 . . . . 3.25 117.158 -133.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -62.47 -44.26 96.82 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.182 0.808 . . . . 3.2 113.182 -172.222 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . 0.454 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 12.0 tp -57.34 -77.04 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.604 1.162 . . . . 2.34 112.6 -163.654 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 5.8 mt -67.06 -40.75 87.17 Favored 'General case' 0 C--N 1.339 0.144 0 O-C-N 121.728 -0.608 . . . . 3.97 110.336 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 12.1 tptp 62.82 171.28 0.14 Allowed 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.194 0.998 . . . . 8.64 111.611 -174.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 12.9 t0 46.66 62.41 2.34 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 123.812 1.768 . . . . 3.7 108.623 -160.418 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 26.9 m -84.19 28.17 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 112.446 -2.161 . . . . 2.73 109.933 162.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -104.61 -63.75 0.66 Allowed Glycine 0 C--N 1.341 0.821 0 N-CA-C 107.654 -2.178 . . . . 2.85 107.654 172.093 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.75 54.4 1.82 Allowed 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.851 1.261 . . . . 4.06 110.315 -174.73 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -61.26 -35.68 77.94 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 125.134 1.373 . . . . 2.03 110.224 -172.443 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -29.26 -57.88 0.15 Allowed 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 126.367 1.867 . . . . 4.0 114.125 171.178 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -49.09 -60.29 2.91 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.053 0.941 . . . . 2.32 109.528 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 2.9 mtmt -61.1 -49.04 78.91 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.893 -1.049 . . . . 5.39 109.672 -176.948 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -51.8 -51.96 52.61 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.953 0.797 . . . . 3.42 110.83 178.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -64.94 -34.73 79.11 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 122.729 0.412 . . . . 4.97 110.978 -178.593 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 5.3 t -67.72 -37.17 81.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.387 0.675 . . . . 2.27 111.774 174.796 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 79.5 mt -69.13 -58.81 3.57 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.019 0.928 . . . . 2.54 109.482 177.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . 0.417 ' O ' ' N ' ' B' ' 66' ' ' ASN 0.314 2.1 t70 -55.8 -9.51 0.57 Allowed 'General case' 0 C--O 1.221 -0.407 0 N-CA-C 117.461 2.393 . . . . 2.84 117.461 -165.638 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 28.1 m -34.54 -24.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 129.172 2.989 . . . . 2.5 118.717 -127.627 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . 0.417 ' N ' ' O ' ' B' ' 64' ' ' ASP . 0.3 OUTLIER -53.2 -34.56 57.54 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.816 1.189 . . . . 4.5 111.232 160.784 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 66.07 56.12 0.86 Allowed 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.751 1.621 . . . . 5.13 111.727 171.078 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -89.96 -33.05 16.53 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 114.651 -1.159 . . . . 3.55 109.374 158.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 4.1 m 101.3 -4.27 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 128.154 2.581 . . . . 2.98 114.005 175.054 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -101.22 132.54 46.67 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 106.401 -1.703 . . . . 5.28 106.401 164.905 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -99.79 118.5 36.39 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 106.61 -1.626 . . . . 2.26 106.61 -167.75 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 6.9 tptm -79.74 176.37 9.78 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.841 0.856 . . . . 3.89 109.104 -171.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -80.4 76.1 7.23 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 107.911 -1.144 . . . . 5.65 107.911 -174.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 97.91 53.98 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.304 1 C-N-CA 133.589 4.756 . . . . 2.68 108.922 -164.812 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -87.89 -61.84 1.63 Allowed 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 121.092 -1.005 . . . . 1.73 108.6 107.655 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -45.11 -43.64 9.84 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.651 1.18 . . . . 6.09 114.076 -162.176 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.626 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 16.9 t-105 -39.94 -36.62 0.48 Allowed 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.416 1.487 . . . . 5.89 112.495 177.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 10.4 mtt180 -38.36 -51.06 1.52 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.434 1.016 . . . . 5.34 111.601 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 2.7 tp -53.36 -38.77 63.6 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 123.099 0.25 . . . . 2.27 110.627 -175.356 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 70.7 mt -63.42 -25.47 38.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-O 121.729 0.776 . . . . 2.58 109.604 -174.063 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.552 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -74.48 -40.88 38.24 Favored Glycine 0 CA--C 1.49 -1.531 0 N-CA-C 109.674 -1.37 . . . . 1.64 109.674 179.076 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.94 -52.93 53.67 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 105.559 -2.015 . . . . 2.34 105.559 178.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.454 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 9.5 mp -42.22 -61.56 1.14 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.646 1.112 . . . . 3.24 111.709 172.232 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.44 -44.38 92.95 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.771 0.796 . . . . 1.9 111.805 -175.614 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 28.8 ttmt -62.69 -55.0 30.87 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.246 1.419 . . . . 2.8 110.426 -179.061 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -57.62 -44.62 85.65 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.056 0.942 . . . . 2.4 109.834 -170.922 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . 0.401 HG13 ' CD1' ' A' ' 13' ' ' ILE . 0.2 OUTLIER -39.89 -48.34 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 125.433 1.493 . . . . 3.08 112.67 166.149 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.54 -34.05 31.38 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.234 1.014 . . . . 4.78 110.606 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 43.4 mttm -132.36 103.46 6.22 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 126.353 1.861 . . . . 6.81 110.731 -163.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 54.7 pttt -38.95 -44.3 1.06 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.326 1.05 . . . . 7.46 113.139 173.09 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 32.2 tttt -168.85 28.85 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 121.648 0.737 . . . . 7.47 111.889 162.06 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.3 59.43 5.63 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 124.881 1.272 . . . . 4.73 110.122 -155.459 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 18.0 tp -116.43 -77.02 0.57 Allowed 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 124.776 1.23 . . . . 6.99 108.635 -177.367 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 173.86 177.8 0.12 Allowed 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 126.412 1.885 . . . . 8.65 108.295 179.06 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -128.74 110.43 21.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 105.881 -1.896 . . . . 8.29 105.881 161.2 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 4.9 ttt-85 -177.82 167.72 2.11 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 125.464 1.506 . . . . 7.2 107.891 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -177.33 138.78 0.24 Allowed 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 105.051 -2.203 . . . . 11.01 105.051 -158.621 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.19 0 N-CA-C 105.52 -2.03 . . . . 8.41 105.52 160.938 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.1 mtt . . . . . 0 N--CA 1.474 0.742 0 N-CA-C 109.676 -0.49 . . . . 7.2 109.676 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.55 176.73 11.04 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.681 1.192 . . . . 3.24 108.007 -178.851 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.0 92.45 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 129.142 2.977 . . . . 4.07 109.866 -173.83 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -73.76 131.14 82.3 Favored Pre-proline 0 N--CA 1.443 -0.822 0 C-N-CA 124.834 1.254 . . . . 6.22 109.967 -172.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.97 96.85 0.79 Allowed 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 122.575 2.183 . . . . 3.12 110.308 179.206 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 93.4 mt -57.83 157.52 7.44 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.574 0.75 . . . . 2.51 111.033 173.614 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.4 t -75.24 159.79 31.13 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 108.806 -0.813 . . . . 2.72 108.806 176.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 68.2 tt0 -51.1 -45.95 61.68 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 123.481 0.712 . . . . 4.28 110.803 -177.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.4 mt -64.74 -55.97 16.56 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.396 -0.811 . . . . 2.49 111.028 -177.929 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -49.24 -54.29 17.44 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.155 1.382 . . . . 2.19 110.678 176.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -50.26 -59.89 3.51 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 124.377 1.071 . . . . 3.9 109.609 174.997 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.1 p -56.61 -43.75 80.49 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.558 -0.714 . . . . 2.11 111.296 -174.494 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.308 2.7 pp -66.81 -42.94 89.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-O 118.743 -0.646 . . . . 1.94 110.44 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -61.04 -49.95 75.3 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 119.435 -0.906 . . . . 3.41 109.912 175.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 m -46.02 -51.38 13.69 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.005 1.722 . . . . 2.76 112.64 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 30.1 m -71.64 -40.33 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 O-C-N 120.335 -1.478 . . . . 1.73 110.163 178.634 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 36.2 t -55.07 -43.03 68.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 123.024 0.53 . . . . 1.99 110.586 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.7 t -61.99 -52.61 63.3 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.276 0.944 . . . . 1.87 110.716 178.027 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.9 m -57.69 -50.71 72.29 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.584 1.084 . . . . 2.17 110.529 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -45.21 -55.59 5.66 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 124.965 1.306 . . . . 4.25 110.517 171.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -58.16 -51.93 67.69 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.953 0.901 . . . . 5.32 110.58 -177.527 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 12.4 p -56.69 -38.74 72.69 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 119.41 -0.329 . . . . 3.19 111.306 -179.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -65.32 -52.88 51.01 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 121.386 0.612 . . . . 3.74 110.983 171.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.2 -19.88 65.64 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.143 1.377 . . . . 2.0 112.062 -170.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.31 -33.32 75.57 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 117.977 -1.011 . . . . 6.76 110.148 173.463 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -38.99 -77.17 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.86 0.864 . . . . 3.86 112.411 -173.11 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 71.9 mt-10 -100.96 173.38 6.51 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 127.203 2.201 . . . . 2.49 106.663 -174.777 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -33.42 141.29 0.08 OUTLIER Glycine 0 CA--C 1.538 1.49 0 C-N-CA 125.978 1.752 . . . . 2.01 115.214 -173.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? 62.2 105.32 0.03 OUTLIER 'General case' 0 C--O 1.237 0.438 0 C-N-CA 125.22 1.408 . . . . 5.67 111.753 -177.996 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -73.34 50.6 0.31 Allowed 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.281 0.845 . . . . 4.41 113.281 176.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.7 p-10 -172.31 -32.6 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 127.429 2.292 . . . . 3.85 109.346 171.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.7 m -78.11 130.08 35.96 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.755 -0.831 . . . . 2.59 108.755 170.85 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -83.54 154.12 24.0 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 106.449 -1.686 . . . . 3.19 106.449 162.659 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.4 m -122.46 170.88 9.53 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 107.204 -1.406 . . . . 3.57 107.204 161.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.1 p -48.48 -52.1 9.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 N-CA-C 112.804 0.668 . . . . 3.18 112.804 -165.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -62.82 -57.74 9.83 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.555 -0.736 . . . . 2.53 109.798 -178.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -38.47 -51.1 1.57 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.08 1.352 . . . . 1.66 111.413 174.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.77 -49.02 78.03 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 114.966 -1.016 . . . . 4.42 109.716 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -59.95 -39.57 86.03 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 118.671 -0.68 . . . . 4.95 110.33 -176.574 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -53.66 -44.05 69.33 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 118.259 0.481 . . . . 3.68 110.753 171.755 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.12 -49.61 73.75 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 108.523 -0.917 . . . . 4.38 108.523 -173.154 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.5 m -68.95 -52.21 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 N-CA-C 108.852 -0.796 . . . . 2.2 108.852 -175.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.9 m -52.79 -51.56 60.25 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.5 1.12 . . . . 2.78 111.199 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -72.43 -50.89 23.05 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 122.543 0.337 . . . . 3.59 110.268 -175.041 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -94.69 -26.63 16.23 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.094 0.776 . . . . 4.12 113.094 -161.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.8 mp -107.96 93.42 10.76 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 119.167 0.894 . . . . 3.56 110.11 -175.879 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -72.07 -44.34 0.91 Allowed 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.24 1.96 . . . . 2.36 111.453 -177.97 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.2 t-160 -150.63 44.33 0.84 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.161 0.505 . . . . 4.77 110.692 -174.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 19.8 tp -95.48 -80.98 0.41 Allowed 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.01 -1.478 . . . . 2.85 107.01 167.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.3 mt -75.73 84.24 2.72 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.279 -0.637 . . . . 2.69 109.279 172.829 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.01 143.48 1.12 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.664 -0.698 . . . . 6.47 110.718 163.38 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 67.43 39.11 3.0 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 125.774 1.63 . . . . 4.19 110.475 177.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -49.83 -25.59 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 125.96 1.704 . . . . 4.2 113.991 -177.941 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.53 -44.08 21.85 Favored Glycine 0 CA--C 1.532 1.143 0 N-CA-C 111.183 -0.767 . . . . 1.97 111.183 170.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 47.1 t -74.66 45.79 0.26 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.113 1.765 . . . . 2.92 111.038 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -66.04 -49.92 66.0 Favored 'General case' 0 N--CA 1.445 -0.725 0 O-C-N 120.846 -1.159 . . . . 2.41 108.347 174.585 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.12 -38.15 56.49 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.797 1.639 . . . . 4.11 111.904 -167.429 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -55.41 -53.69 53.03 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.755 -0.591 . . . . 3.26 110.925 170.993 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.45 -46.06 89.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.974 -0.75 . . . . 3.69 108.974 175.789 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 18.7 tmm? -44.91 -52.72 8.38 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 123.875 0.87 . . . . 2.69 109.158 179.584 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -68.82 -39.89 79.79 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.843 -0.617 . . . . 5.52 111.423 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.1 t -58.73 -30.04 67.17 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.895 0.702 . . . . 3.29 112.895 175.644 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -88.43 -45.26 10.11 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.536 -0.727 . . . . 3.03 109.431 175.717 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -75.2 61.25 1.13 Allowed 'General case' 0 C--N 1.342 0.256 0 C-N-CA 124.775 1.23 . . . . 1.64 111.012 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 25.7 m -58.67 -34.11 50.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.934 0.894 . . . . 2.63 112.281 -174.558 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -82.74 -8.4 59.59 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.347 0.499 . . . . 2.94 112.347 177.189 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . 0.266 2.9 tp60 50.93 66.55 1.14 Allowed 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.878 2.071 . . . . 5.35 113.407 178.25 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.8 p30 -113.17 -4.98 13.69 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.685 1.194 . . . . 2.45 111.774 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.4 m 62.53 15.38 7.84 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.304 1.041 . . . . 2.65 113.454 -171.995 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -112.11 109.6 19.42 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.602 1.561 . . . . 3.47 107.066 165.046 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -88.35 74.86 8.58 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 105.472 -2.047 . . . . 2.63 105.472 170.68 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.68 159.91 33.57 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.008 0.433 . . . . 3.96 110.886 177.488 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 15.5 p90 -37.59 -55.96 1.07 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.888 1.675 . . . . 6.97 114.057 -162.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.11 -40.27 90.59 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.85 0.75 . . . . 2.51 111.721 -177.046 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -76.46 -44.0 37.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 120.087 1.312 . . . . 3.0 109.686 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -44.55 -50.16 9.73 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 118.551 0.614 . . . . 4.8 109.961 167.784 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.634 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 1.2 t-105 -46.51 -32.23 3.23 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 116.938 -1.506 . . . . 4.96 112.418 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -38.69 -49.08 1.55 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 120.694 1.588 . . . . 5.69 109.939 172.621 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.8 tp -48.42 -46.04 37.0 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.834 0.854 . . . . 1.92 110.251 -176.545 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 91.3 mt -62.99 -31.77 53.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 109.12 -0.696 . . . . 2.83 109.12 -171.137 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.556 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -67.99 -45.71 71.19 Favored Glycine 0 CA--C 1.488 -1.624 0 N-CA-C 109.656 -1.378 . . . . 1.34 109.656 178.046 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -69.33 -49.03 59.51 Favored 'General case' 0 N--CA 1.422 -1.873 0 N-CA-C 105.825 -1.917 . . . . 2.39 105.825 -173.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 9.5 mt -41.26 -59.1 1.62 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 120.881 1.673 . . . . 3.69 111.631 166.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.36 -30.74 63.05 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.513 0.725 . . . . 1.91 111.716 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 -57.23 4.93 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 123.228 0.611 . . . . 2.92 110.439 171.001 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -50.25 -48.05 54.86 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 128.689 2.796 . . . . 2.22 108.968 -174.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.8 tt -61.6 -21.22 24.97 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 113.849 1.055 . . . . 2.73 113.849 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 49.8 ttt85 -96.8 -60.37 1.61 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.303 1.441 . . . . 6.34 109.129 178.861 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 40.5 pttt -70.76 7.12 1.21 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.432 1.093 . . . . 5.01 113.799 -179.381 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 23.1 tttt -50.46 -27.48 6.57 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.561 1.544 . . . . 9.11 114.472 -164.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 43.5 tttp -160.95 -35.27 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.68 0.792 . . . . 9.54 111.065 171.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.7 t0 20.27 63.48 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 128.873 2.869 . . . . 6.33 115.083 -178.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.2 pp -129.24 -44.53 1.26 Allowed 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 125.46 1.504 . . . . 10.86 107.288 163.822 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 33.7 mttm -64.42 81.55 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 106.887 -1.523 . . . . 13.98 106.887 149.759 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 9.1 tp -48.03 152.26 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 129.921 3.288 . . . . 13.88 114.441 -167.358 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . 0.286 15.9 ptt180 56.9 -160.25 0.23 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 127.023 2.129 . . . . 18.97 112.907 167.213 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -177.78 68.54 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.086 0 N-CA-C 106.943 -1.503 . . . . 14.71 106.943 -161.772 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . 2.406 50.8 mtmt . . . . . 0 C--O 1.252 1.208 0 N-CA-C 105.701 -1.963 . . . . 12.74 105.701 -144.329 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.438 34.2 ttm . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 108.808 -0.812 . . . . 10.84 108.808 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.2 -167.63 2.88 Favored 'General case' 0 CA--C 1.523 -0.093 0 C-N-CA 124.497 1.119 . . . . 6.78 110.001 -165.078 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 103.67 100.68 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 129.721 3.209 . . . . 7.92 111.375 -171.486 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -75.75 -48.37 3.79 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.808 2.043 . . . . 10.07 115.065 -173.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -71.56 107.62 2.21 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 121.503 1.469 . . . . 3.83 110.869 -168.795 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 42.3 mt -135.75 -168.22 2.17 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.419 1.488 . . . . 4.62 109.097 -172.569 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 11.6 t -75.57 178.62 5.87 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 119.123 0.874 . . . . 2.81 109.94 -177.704 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -61.59 -63.09 1.38 Allowed 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.526 0.679 . . . . 3.41 110.508 -172.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 mp -56.48 -44.13 80.33 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 121.447 -0.783 . . . . 3.11 109.783 -175.613 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.41 -46.03 69.59 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.541 1.936 . . . . 3.82 112.244 173.75 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.65 -51.44 69.37 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.468 -0.77 . . . . 4.73 109.225 176.353 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 91.7 p -65.98 -41.01 91.7 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.074 -0.512 . . . . 2.87 110.721 -171.833 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.279 2.4 pp -64.16 -39.46 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 CA-C-O 118.264 -0.874 . . . . 2.32 109.299 174.482 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.0 -45.92 91.48 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 117.564 -1.655 . . . . 4.88 112.469 173.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . 0.266 1.1 t -56.43 -35.27 67.65 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 120.313 1.415 . . . . 2.18 110.98 -174.428 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 20.7 m -77.0 -34.12 21.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 O-C-N 120.684 -1.26 . . . . 1.93 112.34 171.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 60.2 t -53.82 -51.22 46.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 120.722 1.601 . . . . 2.34 110.496 169.835 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.3 t -65.03 -43.19 93.23 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.819 0.736 . . . . 2.23 110.348 -177.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 72.0 m -55.94 -53.47 56.42 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.512 0.596 . . . . 1.94 110.28 174.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -47.28 -55.34 8.88 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.975 0.91 . . . . 5.42 109.951 172.652 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -56.41 -52.89 62.95 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.764 1.626 . . . . 3.73 110.819 -173.757 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.8 t -63.99 -25.2 68.02 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 122.134 -0.354 . . . . 3.21 111.42 -175.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -80.95 -44.1 18.74 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 119.159 0.89 . . . . 4.21 110.921 168.18 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.52 -32.59 70.44 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.712 1.205 . . . . 2.29 110.572 -172.363 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.72 -20.05 63.08 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 117.315 -1.326 . . . . 5.74 113.366 177.721 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.98 -67.16 0.32 Allowed 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 115.462 1.653 . . . . 2.55 115.462 -155.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -91.92 -77.03 0.44 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 119.394 -0.922 . . . . 2.77 113.062 -168.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.18 169.05 31.62 Favored Glycine 0 C--N 1.336 0.575 0 C-N-CA 127.555 2.502 . . . . 3.01 110.604 160.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 48.29 98.54 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.949 1.092 . . . . 5.6 113.949 137.219 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 18.0 pttm -77.9 51.18 0.93 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.318 1.847 . . . . 5.29 112.804 -174.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 19.5 p30 -172.36 -51.17 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.102 1.761 . . . . 3.56 108.387 -163.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 53.7 p -74.23 150.06 40.5 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.045 0.538 . . . . 2.12 110.306 170.711 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 mp -123.71 119.73 30.63 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 123.17 0.588 . . . . 3.99 110.044 161.748 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 50.1 m -90.35 175.63 7.03 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.869 -0.789 . . . . 2.95 108.869 170.71 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 11.0 p -84.03 51.77 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 O-C-N 121.004 -1.06 . . . . 3.71 110.709 -175.58 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -159.93 55.1 0.36 Allowed 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 106.084 -1.821 . . . . 3.57 106.084 159.365 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -178.49 -56.12 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 127.9 2.48 . . . . 1.94 104.546 -166.151 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -60.1 -59.38 5.51 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.604 -0.887 . . . . 4.82 108.604 165.228 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 54.3 tttt -58.18 -35.83 72.17 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 119.903 -0.719 . . . . 3.39 111.365 -174.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -49.56 -42.8 45.15 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 119.302 -0.38 . . . . 4.27 111.9 172.694 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 tp -66.42 -49.15 67.73 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.773 -0.825 . . . . 2.88 108.773 -172.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 9.4 m -69.09 -38.16 77.79 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.163 0 CA-C-N 116.083 -0.508 . . . . 2.03 110.016 -174.182 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 94.1 m -61.1 -54.86 39.41 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.124 -0.489 . . . . 2.5 110.134 173.717 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -82.01 -60.35 2.26 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.686 0.794 . . . . 2.08 112.884 -167.724 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -81.23 -38.95 26.12 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 114.276 1.213 . . . . 3.16 114.276 -160.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -48.93 -44.3 70.23 Favored Pre-proline 0 CA--C 1.532 0.271 0 N-CA-C 114.922 1.453 . . . . 2.9 114.922 -155.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -77.51 -36.13 1.35 Allowed 'Trans proline' 0 N--CA 1.448 -1.177 0 N-CA-C 108.92 -1.223 . . . . 3.14 108.92 -44.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -88.79 -35.74 16.47 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 125.231 1.412 . . . . 3.98 110.373 -173.375 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 15.9 tp -42.14 -63.53 0.73 Allowed 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 114.043 1.127 . . . . 1.99 114.043 -172.593 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 35.4 mt -83.39 162.57 21.0 Favored 'General case' 0 C--N 1.338 0.107 0 CA-C-O 121.459 0.647 . . . . 2.42 109.4 175.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' B' ' 86' ' ' GLU . 0.0 OUTLIER -142.44 154.03 44.21 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 124.762 1.225 . . . . 6.4 108.002 178.315 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 30.2 t0 66.68 82.11 0.19 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 126.486 1.914 . . . . 3.75 109.461 -164.557 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 34.7 m -93.93 11.5 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 CA-C-N 113.735 -1.575 . . . . 2.68 109.485 162.96 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.57 -71.17 1.3 Allowed Glycine 0 C--N 1.339 0.738 0 N-CA-C 106.703 -2.559 . . . . 2.94 106.703 174.807 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.33 55.11 2.16 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 123.13 1.443 . . . . 3.63 109.652 -179.154 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.66 -34.33 74.15 Favored 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 124.235 1.014 . . . . 1.93 108.774 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -44.69 -46.28 10.23 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.4 1.48 . . . . 4.24 112.075 171.841 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -55.49 -48.54 74.42 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.635 0.652 . . . . 2.67 110.215 177.309 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -59.15 -51.67 69.0 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 107.36 -1.348 . . . . 4.14 107.36 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 9.9 tmm? -50.26 -60.57 2.85 Favored 'General case' 0 C--O 1.227 -0.081 0 C-N-CA 124.841 1.256 . . . . 4.04 110.233 -174.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt -59.19 -36.85 76.07 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.591 -0.242 . . . . 5.99 111.6 -175.647 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -68.93 -38.2 79.36 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.943 0.897 . . . . 2.54 111.348 178.53 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 24.0 mt -73.4 -54.26 8.74 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.28 1.032 . . . . 2.77 109.992 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -62.88 -10.2 12.45 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 128.009 2.524 . . . . 2.53 116.244 -166.291 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 21.4 m -33.73 -24.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 119.384 3.105 . . . . 2.69 119.384 -134.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -55.17 -27.43 45.66 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 120.894 1.679 . . . . 3.54 111.106 165.063 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 74.35 61.15 0.08 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.557 1.143 . . . . 4.59 110.548 164.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 46.8 p30 -117.92 -16.29 9.92 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.053 1.741 . . . . 1.91 112.587 -177.323 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 1.3 t 69.57 21.33 6.74 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.715 1.143 . . . . 3.3 112.209 -173.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -122.14 99.7 6.57 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 106.124 -1.806 . . . . 3.12 106.124 158.844 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.41 98.09 1.74 Allowed 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.99 -1.856 . . . . 2.21 105.99 172.089 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -84.65 174.99 9.52 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 118.412 0.551 . . . . 5.42 110.484 -179.648 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -92.45 58.8 3.26 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.306 0.642 . . . . 7.02 111.768 -173.701 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -158.28 51.02 0.41 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 108.008 -1.108 . . . . 2.82 108.008 101.248 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -91.04 -62.47 1.44 Allowed 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.043 -1.465 . . . . 2.32 107.043 145.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -52.17 -46.98 65.71 Favored 'General case' 0 CA--C 1.512 -0.509 0 C-N-CA 124.595 1.158 . . . . 5.85 111.163 -167.681 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.634 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 56.2 t90 -45.08 -37.54 4.32 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 114.437 -1.256 . . . . 5.24 111.724 -175.341 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -39.69 -45.19 1.65 Allowed 'General case' 0 C--N 1.344 0.33 0 C-N-CA 124.031 0.933 . . . . 5.07 112.483 173.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 17.4 tp -49.59 -45.83 48.44 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.017 0.927 . . . . 2.51 111.551 -178.859 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 70.3 mt -64.53 -26.18 39.66 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.625 0 N-CA-C 108.052 -1.092 . . . . 2.34 108.052 -177.426 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.528 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -70.14 -45.28 56.9 Favored Glycine 0 CA--C 1.503 -0.691 0 C-N-CA 127.066 2.269 . . . . 1.62 112.44 177.549 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -68.53 -53.41 23.27 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 106.73 -1.581 . . . . 2.01 106.73 -177.637 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . 0.254 3.8 pp -58.22 -37.19 74.38 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 119.962 -0.695 . . . . 2.9 111.585 174.614 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.78 -57.91 10.95 Favored 'General case' 0 C--N 1.34 0.155 0 O-C-N 121.119 -0.988 . . . . 2.18 111.655 175.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 4.5 ptpt -63.08 -36.71 84.48 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.407 -0.806 . . . . 3.01 110.504 -178.449 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' B' ' 51' ' ' LYS . 2.2 mm-40 -44.22 -39.26 4.29 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 124.716 1.206 . . . . 4.9 111.908 -173.449 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 5.2 tt -47.1 -45.32 8.4 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 123.118 0.567 . . . . 1.76 111.677 178.589 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -84.34 -50.63 7.65 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.034 0.534 . . . . 6.3 111.957 166.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 27.8 mttp -82.61 86.29 6.85 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 121.263 -0.898 . . . . 5.85 111.638 -169.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -39.57 -45.99 1.7 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.229 1.412 . . . . 6.36 112.754 176.445 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 4.9 pttt 162.47 68.15 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.786 2.435 . . . . 7.54 110.356 163.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . 0.404 ' OD2' ' NZ ' ' B' ' 94' ' ' LYS . 2.9 t0 -146.81 154.27 41.16 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.382 -0.97 . . . . 6.43 108.382 157.71 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 1.8 pt? 167.73 -61.25 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 129.099 2.96 . . . . 6.02 107.695 -171.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . 0.424 ' N ' ' CD ' ' B' ' 94' ' ' LYS . 0.0 OUTLIER 40.6 -171.94 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.893 2.077 . . . . 8.17 112.519 -158.11 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 6.7 tp -169.32 137.96 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 N-CA-C 106.467 -1.679 . . . . 9.66 106.467 171.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -163.71 96.35 0.83 Allowed 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 107.907 -1.145 . . . . 8.21 107.907 176.931 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.79 135.4 0.3 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 106.742 -1.577 . . . . 9.29 106.742 -162.847 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 10.5 tptp . . . . . 0 C--O 1.254 1.332 0 N-CA-C 105.033 -2.21 . . . . 9.44 105.033 170.052 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.6 mtt . . . . . 0 N--CA 1.473 0.721 0 N-CA-C 107.562 -1.273 . . . . 8.34 107.562 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -169.1 174.41 6.27 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 126.436 1.894 . . . . 3.88 106.48 -176.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 85.22 81.45 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 126.743 2.017 . . . . 3.75 110.316 -176.826 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -58.27 124.57 71.49 Favored Pre-proline 0 N--CA 1.448 -0.537 0 C-N-CA 125.766 1.627 . . . . 4.56 110.111 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.65 107.65 2.36 Favored 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 122.467 2.111 . . . . 2.85 109.511 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 77.8 mt -65.47 159.71 23.78 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.554 0.742 . . . . 2.36 110.25 175.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 6.1 t -76.85 170.0 17.29 Favored 'General case' 0 N--CA 1.458 -0.037 0 N-CA-C 109.271 -0.64 . . . . 2.49 109.271 -179.466 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -64.49 -42.85 95.62 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 108.477 -0.934 . . . . 2.86 108.477 -171.058 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.8 mp -63.99 -57.52 9.48 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 118.422 -0.799 . . . . 3.35 111.522 176.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -48.61 -52.6 22.21 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.4 1.48 . . . . 2.76 109.943 178.192 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -51.99 -59.62 4.14 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.794 1.238 . . . . 3.17 109.527 175.011 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.0 p -55.38 -43.35 75.06 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.489 -0.757 . . . . 2.24 111.771 -175.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.311 2.7 pp -65.37 -44.23 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 CA-C-O 118.687 -0.673 . . . . 1.87 110.57 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -60.57 -48.79 80.22 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.484 1.038 . . . . 3.87 110.104 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 m -45.65 -46.26 14.51 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.836 1.654 . . . . 3.1 112.613 175.026 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 23.7 m -80.46 -33.55 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 O-C-N 120.817 -1.177 . . . . 1.74 111.712 177.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.5 t -57.7 -39.32 69.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 121.467 -0.77 . . . . 1.81 110.434 175.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.1 t -64.81 -43.14 94.11 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.975 0.807 . . . . 1.62 111.15 175.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.0 m -55.48 -51.55 66.6 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 120.925 -1.109 . . . . 1.87 110.161 173.41 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -48.23 -60.17 2.86 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 109.698 -0.482 . . . . 5.07 109.698 173.221 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -54.16 -53.31 55.2 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.636 0.774 . . . . 5.29 111.225 -173.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 22.0 p -57.08 -60.39 3.66 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 122.551 0.341 . . . . 3.27 110.451 -178.578 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -56.15 -40.58 74.06 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-O 121.178 0.513 . . . . 3.99 111.231 178.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.2 -26.92 68.35 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 121.093 -1.005 . . . . 2.07 110.735 -174.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 52.6 ttp180 -79.62 -19.21 49.78 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 117.724 -1.131 . . . . 7.87 112.448 -177.616 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -41.16 -67.34 0.26 Allowed 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.505 1.048 . . . . 2.1 113.623 -173.867 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -98.43 79.81 2.55 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 104.138 -2.541 . . . . 2.56 104.138 178.474 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 38.86 -155.51 0.02 OUTLIER Glycine 0 CA--C 1.525 0.709 0 C-N-CA 127.01 2.243 . . . . 3.35 112.586 -176.364 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 74.9 mtp85 31.66 87.37 0.01 OUTLIER 'General case' 0 C--O 1.24 0.558 0 C-N-CA 126.681 1.992 . . . . 5.78 110.716 165.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -82.21 43.87 0.83 Allowed 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 127.517 2.327 . . . . 5.71 109.025 -168.603 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -155.51 -52.84 0.09 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 105.521 -2.029 . . . . 4.06 105.521 -142.322 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 16.5 p -106.72 136.78 45.93 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 125.732 1.613 . . . . 2.62 109.917 169.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -83.82 130.31 34.93 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 105.98 -1.859 . . . . 2.98 105.98 157.816 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 21.2 t -81.32 177.39 9.02 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.332 1.453 . . . . 3.53 107.62 169.069 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 76.5 t -62.2 -52.1 64.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 121.728 -0.607 . . . . 3.89 110.03 -174.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -60.67 -55.74 29.58 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 118.701 -0.666 . . . . 2.74 109.62 177.056 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -39.0 -54.24 1.69 Allowed 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 126.028 1.731 . . . . 1.99 111.968 173.601 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -57.0 -54.18 49.63 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.434 0.693 . . . . 4.17 109.291 177.516 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 48.4 tttt -56.81 -39.19 73.71 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.258 0.466 . . . . 3.29 112.258 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -49.9 -33.07 16.16 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 119.41 1.005 . . . . 3.0 111.882 177.568 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -63.38 -46.13 87.88 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 108.256 -1.016 . . . . 3.32 108.256 -178.549 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.4 m -75.77 -38.9 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-N 115.771 -0.65 . . . . 2.28 109.913 -174.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 50.0 m -61.45 -44.47 97.05 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.875 0.87 . . . . 2.97 111.378 174.994 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -76.44 -57.88 3.61 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.88 -0.415 . . . . 2.97 109.88 -170.262 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -100.81 -124.65 0.17 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.074 -0.713 . . . . 3.52 109.074 -175.852 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.4 mp 24.22 64.21 0.41 Allowed Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 127.625 2.37 . . . . 2.9 113.762 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -78.59 -49.49 0.08 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.221 1.947 . . . . 1.77 111.331 -171.655 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -112.48 -28.68 7.77 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.277 1.431 . . . . 4.43 111.335 -173.998 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.418 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 6.5 tp -65.03 -79.52 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.061 1.344 . . . . 1.96 110.997 -171.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.1 mt -78.46 165.34 23.88 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 108.345 -0.983 . . . . 3.08 108.345 165.236 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.74 161.1 9.09 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 105.816 -1.92 . . . . 7.17 105.816 -166.635 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 46.7 t0 60.11 78.27 0.28 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 123.057 1.408 . . . . 5.01 108.82 -163.492 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.1 m -85.3 12.42 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 113.552 -1.658 . . . . 3.88 110.089 166.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.97 -66.48 1.66 Allowed Glycine 0 C--N 1.34 0.779 0 N-CA-C 106.444 -2.662 . . . . 2.19 106.444 167.426 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.3 t -78.23 61.0 2.62 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 122.291 1.043 . . . . 2.89 110.841 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -79.77 -39.68 30.42 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 125.471 1.508 . . . . 2.05 108.513 169.728 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -40.7 -53.2 2.84 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.853 1.661 . . . . 4.88 112.167 171.045 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -48.81 -56.61 8.18 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.193 1.397 . . . . 3.02 111.094 174.258 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.56 -51.94 65.4 Favored 'General case' 0 C--O 1.225 -0.235 0 N-CA-C 108.406 -0.961 . . . . 3.86 108.406 177.016 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -47.75 -52.24 19.3 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 123.941 0.896 . . . . 2.44 110.12 -176.151 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -62.95 -39.4 94.51 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 118.08 0.4 . . . . 3.7 111.685 178.183 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.4 t -60.13 -37.06 78.92 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.934 -0.479 . . . . 2.18 111.567 175.762 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.6 mp -77.42 -55.56 5.29 Favored 'General case' 0 CA--C 1.528 0.103 0 O-C-N 121.141 -0.975 . . . . 3.25 110.93 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -76.45 69.72 2.94 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.076 0.95 . . . . 1.78 110.035 -174.963 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 20.5 m -49.36 -33.09 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 124.534 1.134 . . . . 2.53 112.827 -176.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -96.44 0.78 50.91 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.196 0.813 . . . . 3.36 113.196 -176.752 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 44.93 65.49 1.08 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.885 1.674 . . . . 5.64 112.541 176.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 30.6 p30 -107.48 -8.34 16.28 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.614 1.166 . . . . 2.09 111.089 171.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 44.0 m 61.08 23.82 13.97 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.523 1.129 . . . . 2.06 112.438 -171.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -120.39 108.94 14.74 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 106.691 -1.596 . . . . 3.25 106.691 163.703 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -80.53 89.16 5.64 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 103.686 -2.709 . . . . 2.37 103.686 177.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.8 ttpm? -68.49 161.17 28.35 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.734 1.214 . . . . 4.85 108.945 -174.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -37.7 -62.04 0.57 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.403 1.081 . . . . 6.66 113.279 -168.054 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -70.25 -33.33 71.49 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 111.701 0.26 . . . . 2.1 111.701 -176.597 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -61.84 -60.01 4.29 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 108.826 -0.805 . . . . 1.99 108.826 177.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -48.34 -52.92 19.41 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 124.048 0.939 . . . . 3.61 109.505 174.496 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.554 ' CE2' ' CZ2' ' B' ' 77' ' ' TRP . 12.8 t-105 -51.01 -29.38 12.34 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 117.498 -1.239 . . . . 5.63 111.435 -178.195 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.431 HH21 ' CD ' ' A' ' 82' ' ' GLU . 36.6 ttt180 -43.75 -43.81 6.27 Favored 'General case' 0 C--N 1.351 0.659 0 CA-C-N 120.471 1.487 . . . . 6.53 110.712 171.667 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.5 tp -44.53 -45.54 9.38 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 122.851 0.46 . . . . 2.1 110.854 178.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.5 mp -69.51 -32.74 54.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 108.961 -0.755 . . . . 2.92 108.961 -175.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.431 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -58.74 -44.84 95.55 Favored Glycine 0 CA--C 1.506 -0.469 0 N-CA-C 110.175 -1.17 . . . . 1.51 110.175 169.346 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.431 ' CD ' HH21 ' A' ' 78' ' ' ARG . 5.1 mm-40 -76.53 -33.61 58.57 Favored 'General case' 0 N--CA 1.438 -1.029 0 N-CA-C 108.653 -0.869 . . . . 2.35 108.653 -169.698 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.418 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 9.1 mp -52.77 -54.71 30.07 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.042 0.837 . . . . 3.25 109.786 161.078 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.36 -26.88 66.94 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.889 0.475 . . . . 2.39 111.9 -178.048 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.63 -61.1 1.97 Allowed 'General case' 0 C--O 1.217 -0.628 0 O-C-N 121.579 -0.701 . . . . 3.32 109.628 162.894 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -53.14 -43.61 67.13 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.634 1.574 . . . . 3.51 112.062 -164.977 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 11.7 tt -53.29 -37.12 27.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-O 121.816 0.817 . . . . 2.86 111.366 173.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.08 -63.51 1.27 Allowed 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 126.288 1.835 . . . . 6.41 110.167 -171.294 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 35.6 tttp -77.28 49.1 0.67 Allowed 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.609 1.964 . . . . 5.2 113.585 -162.447 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -68.91 -19.61 64.21 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.095 -1.003 . . . . 8.82 112.127 -176.267 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 37.6 tptt -165.82 -35.07 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.045 0.538 . . . . 10.72 112.218 176.055 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 68.54 -32.47 0.22 Allowed 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 126.63 1.972 . . . . 7.37 113.723 -175.702 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 64.1 tp -64.88 -86.07 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.858 0 C-N-CA 124.918 1.287 . . . . 10.96 110.935 -176.076 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -163.03 75.75 0.41 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.707 0.685 . . . . 17.44 110.128 -167.87 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 10.4 tp -152.35 70.26 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 119.517 1.053 . . . . 10.13 113.295 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . 0.405 6.4 ptm180 173.11 -114.64 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 127.838 2.455 . . . . 13.7 107.54 144.944 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -176.79 138.5 0.27 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 120.637 1.562 . . . . 13.9 108.594 -173.859 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 96.3 mttt . . . . . 0 C--O 1.25 1.082 0 C-N-CA 127.338 2.255 . . . . 15.09 113.427 171.741 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 3.9 mpp? . . . . . 0 N--CA 1.469 0.522 0 CA-C-O 118.258 -0.877 . . . . 7.39 109.69 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -50.56 146.23 5.77 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-O 117.116 -1.421 . . . . 6.14 110.56 171.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.86 98.36 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.778 1 C-N-CA 135.725 5.61 . . . . 6.07 110.163 11.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -144.5 132.48 10.69 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 126.664 1.986 . . . . 5.57 107.019 -173.451 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -78.43 149.48 24.42 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 123.924 3.082 . . . . 5.12 111.212 -176.393 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 13.1 mt -138.62 -112.55 0.16 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.791 1.237 . . . . 4.28 112.714 -160.666 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 4.7 t -110.68 -80.83 0.58 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.619 1.34 . . . . 2.51 114.619 -161.508 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -162.58 -72.23 0.05 OUTLIER 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.935 0.894 . . . . 3.25 108.658 -173.134 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.5 mt -56.41 -50.03 72.79 Favored 'General case' 0 C--N 1.338 0.102 0 N-CA-C 109.215 -0.661 . . . . 2.05 109.215 171.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 3.3 tm-20 -43.66 -62.6 1.04 Allowed 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 124.269 1.028 . . . . 4.72 111.092 167.2 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -48.42 -42.61 32.65 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.262 0.553 . . . . 4.0 109.768 -177.181 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 14.7 m -62.84 -36.92 84.83 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.154 0.981 . . . . 2.19 112.617 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.272 1.9 pp -75.7 -37.39 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 118.913 0.779 . . . . 2.11 111.029 171.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -57.71 -59.09 5.74 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 118.895 0.77 . . . . 2.38 109.602 177.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.4 t -47.32 -44.84 23.9 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.005 0.821 . . . . 2.19 112.097 -174.878 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.1 m -73.03 -43.83 57.84 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 O-C-N 120.987 -1.071 . . . . 1.76 110.843 178.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 37.1 t -53.69 -51.28 45.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 O-C-N 121.405 -0.809 . . . . 2.19 110.617 175.131 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 13.7 t -60.05 -48.91 79.74 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 117.457 -1.258 . . . . 2.31 110.355 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 99.0 m -46.14 -57.67 4.3 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 120.634 1.561 . . . . 2.22 109.671 175.287 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 10.5 m-30 -55.63 -61.28 2.46 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.343 0.497 . . . . 8.55 112.343 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -69.49 -33.95 73.62 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 119.165 0.893 . . . . 5.97 112.025 -169.939 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 64.6 p -61.44 -55.53 30.31 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 108.449 -0.945 . . . . 4.54 108.449 170.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -55.44 -38.11 68.59 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.046 0.839 . . . . 4.18 112.038 -177.836 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.32 -19.7 9.44 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 127.417 2.287 . . . . 2.31 112.323 176.511 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -17.54 10.17 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.609 1.163 . . . . 4.29 112.444 170.589 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . 0.416 ' CB ' ' HG3' ' B' ' 37' ' ' GLU . 0.0 OUTLIER -47.68 -65.62 0.54 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 115.082 1.512 . . . . 2.24 115.082 -173.925 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . 0.342 17.4 mt-10 -82.42 -17.65 44.63 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 118.621 2.823 . . . . 3.22 118.621 -161.574 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.21 -107.16 0.58 Allowed Glycine 0 C--N 1.338 0.655 1 C-N-CA 133.601 5.381 . . . . 5.14 114.093 -4.521 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.26 86.6 0.13 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 107.525 -1.287 . . . . 5.26 107.525 -175.467 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 14.6 pttm -81.95 14.47 2.74 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 115.558 1.688 . . . . 4.79 115.558 -157.881 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 21.5 p-10 -120.11 -49.19 2.3 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 124.131 0.972 . . . . 3.09 109.158 171.898 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 85.1 p -68.63 131.38 45.11 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 123.404 0.682 . . . . 2.01 110.458 -179.524 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.6 mp -94.04 112.34 24.16 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 106.675 -1.602 . . . . 3.96 106.675 164.206 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 42.0 m -81.69 -174.36 4.96 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 128.183 2.593 . . . . 3.33 107.775 178.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 75.5 t -68.15 -95.5 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.432 0 N-CA-C 103.575 -2.75 . . . . 4.05 103.575 -171.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -72.44 70.12 0.87 Allowed 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 120.659 1.572 . . . . 2.88 108.724 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . 0.416 ' HG3' ' CB ' ' B' ' 26' ' ' GLN . 25.8 tt0 -159.0 -56.0 0.06 Allowed 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 131.54 3.936 . . . . 2.53 104.282 178.719 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . 0.405 ' CE2' ' CE2' ' B' ' 76' ' ' TYR . 0.8 OUTLIER -60.19 -51.74 68.31 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.478 -0.934 . . . . 3.68 108.478 166.996 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 50.2 tttt -59.42 -32.64 70.37 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 119.285 -0.966 . . . . 3.71 111.894 -169.9 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -55.3 -34.46 64.15 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.705 -0.622 . . . . 3.31 112.424 174.036 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.4 tt -69.73 -45.17 68.76 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.111 0.869 . . . . 3.05 109.262 -176.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 30.4 m -68.12 -36.9 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 N-CA-C 109.447 -0.575 . . . . 2.13 109.447 -175.613 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 99.4 m -62.51 -60.51 3.43 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 122.639 0.376 . . . . 2.33 111.268 169.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -82.47 -59.11 2.64 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.759 0.824 . . . . 2.46 112.938 -164.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -81.67 -32.75 31.64 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.022 0.929 . . . . 3.52 112.34 -165.546 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 13.6 tp -82.82 -14.61 0.21 Allowed Pre-proline 0 CA--C 1.545 0.753 0 N-CA-C 118.816 2.895 . . . . 2.45 118.816 -164.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -40.14 -62.95 0.32 Allowed 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 125.277 3.985 . . . . 2.77 117.857 -132.846 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 12.4 t-160 -88.8 54.0 2.88 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 119.975 1.261 . . . . 4.64 110.534 -156.338 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 14.2 tp -145.57 -107.24 0.1 Allowed 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 123.727 0.811 . . . . 2.07 109.981 -166.101 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 2.4 mp -69.42 92.95 0.63 Allowed 'General case' 0 CA--C 1.531 0.242 0 O-C-N 120.913 -1.117 . . . . 3.34 110.483 178.649 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.01 149.47 0.04 OUTLIER 'General case' 0 C--O 1.237 0.42 0 C-N-CA 125.443 1.497 . . . . 6.98 113.476 174.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 19.4 t0 54.8 41.65 31.75 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 123.205 1.479 . . . . 5.0 107.335 176.793 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 17.0 m 35.8 45.93 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 C-N-CA 127.739 2.416 . . . . 4.18 113.093 -170.437 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 68.33 8.2 54.47 Favored Glycine 0 CA--C 1.526 0.735 0 C-N-CA 125.414 1.483 . . . . 8.43 114.865 177.742 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . 0.274 0.5 OUTLIER 49.35 66.07 1.22 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 123.493 1.616 . . . . 4.23 110.044 -175.525 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -49.32 -26.49 3.14 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.11 1.764 . . . . 3.18 114.123 -178.295 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -50.03 -74.33 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.983 0.913 . . . . 4.15 112.35 166.285 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -50.28 -45.35 54.34 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 119.211 0.914 . . . . 3.34 109.585 173.89 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.23 -39.21 85.86 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 118.834 -0.603 . . . . 3.57 111.644 -172.612 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 5.0 ttt -55.3 -45.15 76.28 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 119.4 1.0 . . . . 2.87 108.744 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.48 -43.13 98.18 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.112 -0.993 . . . . 5.64 111.121 175.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 2.6 m -58.72 -41.67 86.9 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.859 0.754 . . . . 2.44 112.853 176.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 33.3 mt -82.68 -60.13 2.28 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.886 1.674 . . . . 2.67 111.457 -172.797 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.282 4.3 t0 -64.85 -7.21 10.35 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.662 2.385 . . . . 2.48 116.506 -157.702 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.1 m -36.61 -25.36 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 130.985 3.714 . . . . 2.9 117.841 -154.116 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 35.8 p30 -65.8 -20.69 66.35 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 120.088 1.313 . . . . 4.16 112.332 175.263 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 112.57 -43.72 0.0 OUTLIER 'General case' 0 C--N 1.344 0.354 0 C-N-CA 129.331 3.052 . . . . 5.72 111.169 164.042 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -46.56 117.82 1.76 Allowed 'General case' 0 C--O 1.232 0.183 0 C-N-CA 123.763 0.825 . . . . 3.87 109.441 173.085 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 7.8 t -70.04 63.74 0.22 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.515 1.926 . . . . 3.28 110.637 -176.245 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -161.26 118.9 2.32 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 127.769 2.427 . . . . 3.26 105.251 -171.579 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -87.96 110.77 20.82 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.082 -1.081 . . . . 2.86 108.082 174.755 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -82.33 158.76 23.28 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 107.377 -1.342 . . . . 7.74 107.377 170.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -86.04 56.89 4.18 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.171 -0.956 . . . . 5.37 111.566 169.802 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.7 t-20 -152.82 49.3 0.73 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 119.987 -0.685 . . . . 2.87 109.868 111.554 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -93.28 -61.94 1.47 Allowed 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 127.437 2.295 . . . . 2.53 107.678 134.857 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.405 ' CE2' ' CE2' ' B' ' 38' ' ' PHE . 16.2 t80 -46.23 -40.79 11.97 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 127.584 2.354 . . . . 4.51 111.99 -174.306 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.554 ' CZ2' ' CE2' ' A' ' 77' ' ' TRP . 41.7 t90 -50.91 -35.41 32.93 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 112.668 0.618 . . . . 5.3 112.668 -175.348 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -45.18 -33.79 2.44 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 122.893 0.477 . . . . 5.16 111.943 174.486 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 17.7 tp -60.86 -48.12 83.26 Favored 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 124.645 1.178 . . . . 2.37 108.89 -175.156 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . 0.296 5.2 pt -71.78 -18.01 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.376 0 C-N-CA 117.6 -1.64 . . . . 4.05 108.477 -175.384 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.47 ' HA2' ' CE2' ' A' ' 77' ' ' TRP . . . -67.7 -47.49 61.27 Favored Glycine 0 N--CA 1.443 -0.857 0 C-N-CA 125.108 1.337 . . . . 1.91 110.241 172.841 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -56.66 -63.13 1.3 Allowed 'General case' 0 N--CA 1.44 -0.956 0 CA-C-O 117.089 -1.434 . . . . 3.22 107.756 168.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 8.6 mp -41.76 -56.24 2.74 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 121.0 1.727 . . . . 3.18 113.286 -177.707 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.87 -28.01 63.78 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 125.159 1.383 . . . . 2.17 112.198 -176.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.77 -60.84 2.22 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 118.145 -0.931 . . . . 3.37 109.941 164.556 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -59.3 -24.35 63.22 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.807 0.843 . . . . 2.29 112.465 -158.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 11.4 tt -45.85 -53.09 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 CA-C-N 118.569 0.622 . . . . 2.04 111.249 164.723 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 49.5 ttt85 -85.21 -61.47 1.76 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.407 1.883 . . . . 6.52 113.957 171.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -64.18 139.11 58.73 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.316 1.046 . . . . 5.41 111.749 -166.803 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -83.79 -61.96 1.69 Allowed 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.028 -0.42 . . . . 5.83 110.953 -168.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -175.31 27.43 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.403 1.881 . . . . 7.91 109.616 176.256 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -103.47 41.33 1.28 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 128.336 2.655 . . . . 4.32 108.478 -165.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . 0.43 ' CG ' ' H ' ' B' ' 94' ' ' LYS . 0.3 OUTLIER -99.18 -104.19 0.22 Allowed 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 125.861 1.664 . . . . 5.83 108.189 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . 0.43 ' H ' ' CG ' ' B' ' 93' ' ' LEU . 1.0 OUTLIER 67.12 175.34 0.25 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.029 1.732 . . . . 8.5 110.22 -177.201 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 7.7 tp -164.29 143.72 2.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.148 0 N-CA-C 107.704 -1.221 . . . . 8.69 107.704 176.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.74 148.59 14.19 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 105.84 -1.911 . . . . 7.28 105.84 167.482 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -178.31 139.04 0.19 Allowed 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 104.219 -2.512 . . . . 9.34 104.219 -168.759 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.172 0 N-CA-C 106.118 -1.808 . . . . 9.4 106.118 161.143 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.6 mtp . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 107.48 -1.304 . . . . 8.29 107.48 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.7 174.86 2.63 Favored 'General case' 0 C--O 1.232 0.142 0 O-C-N 123.842 0.714 . . . . 5.24 109.896 165.014 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.44 58.94 0.0 OUTLIER 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 129.386 3.074 . . . . 4.24 109.004 -168.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -62.15 135.65 95.03 Favored Pre-proline 0 N--CA 1.446 -0.64 0 C-N-CA 125.741 1.617 . . . . 4.91 110.777 -173.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.64 110.52 2.91 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 122.888 2.392 . . . . 3.01 110.452 -177.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.2 mt -70.58 159.72 33.82 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.141 0.976 . . . . 2.58 109.614 173.419 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.6 t -72.89 165.74 24.35 Favored 'General case' 0 N--CA 1.464 0.264 0 O-C-N 121.545 -0.722 . . . . 2.11 109.457 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -57.19 -47.12 82.06 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 118.991 0.814 . . . . 4.07 109.657 -177.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mp -57.45 -58.39 8.48 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 117.755 -1.117 . . . . 2.85 111.222 178.597 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -49.25 -56.03 10.72 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.097 1.359 . . . . 2.56 110.419 177.697 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.1 tp10 -52.55 -52.37 55.23 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.922 1.689 . . . . 3.23 110.379 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.2 p -67.05 -45.2 78.14 Favored 'General case' 0 C--O 1.234 0.245 0 O-C-N 121.762 -0.587 . . . . 2.22 111.261 -176.795 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.296 2.9 pp -62.88 -36.55 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 O-C-N 121.421 -0.8 . . . . 1.96 109.432 177.763 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -60.11 -57.83 11.12 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 118.863 0.756 . . . . 2.84 109.94 171.44 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -54.37 -36.33 63.77 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.42 1.009 . . . . 2.14 111.989 -171.75 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.3 m -73.92 -47.4 43.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 O-C-N 121.467 -0.77 . . . . 1.71 110.833 172.498 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.8 t -50.59 -50.21 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-N 119.309 0.959 . . . . 1.68 111.622 177.382 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.4 t -60.03 -44.28 94.73 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.941 0.791 . . . . 2.26 110.479 176.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 63.7 m -52.67 -51.89 58.26 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.641 1.109 . . . . 2.16 109.215 174.722 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -56.6 -55.67 31.03 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 122.995 0.518 . . . . 8.65 110.732 178.559 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -68.06 -44.49 76.25 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 125.298 1.439 . . . . 4.07 110.646 -166.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 66.4 p -56.17 -57.82 10.56 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.389 -0.967 . . . . 4.64 108.389 170.962 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -52.7 -40.91 63.41 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 122.662 0.385 . . . . 4.08 111.959 -178.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.89 -16.83 32.37 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 128.323 2.649 . . . . 2.21 112.802 -178.546 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.5 -28.94 67.49 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 118.24 -0.886 . . . . 4.29 111.625 169.012 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -41.92 -62.89 0.82 Allowed 'General case' 0 C--N 1.344 0.348 0 C-N-CA 124.289 1.035 . . . . 2.49 113.055 -167.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 63.5 mt-10 -124.11 177.49 5.79 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 126.193 1.797 . . . . 2.89 107.502 -177.002 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -15.2 125.28 0.01 OUTLIER Glycine 0 CA--C 1.533 1.176 0 C-N-CA 127.852 2.644 . . . . 1.73 115.187 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? 64.1 105.53 0.03 OUTLIER 'General case' 0 C--O 1.237 0.43 0 C-N-CA 124.482 1.113 . . . . 4.84 112.214 177.97 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -67.15 60.02 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.856 0.862 . . . . 4.82 111.18 166.437 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -164.37 -64.83 0.04 OUTLIER 'General case' 0 N--CA 1.458 -0.066 0 C-N-CA 125.593 1.557 . . . . 3.71 107.322 -177.861 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 p -85.52 159.72 19.84 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 125.157 1.383 . . . . 2.11 110.836 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -100.12 175.66 5.67 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 107.761 -1.2 . . . . 3.24 107.761 172.99 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.9 t -144.33 179.78 7.03 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 126.781 2.033 . . . . 2.66 106.277 177.752 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 67.7 t -47.81 -64.02 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 123.533 0.733 . . . . 3.29 111.467 -175.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -66.57 -50.76 62.05 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 119.163 -0.446 . . . . 2.75 110.267 -176.239 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -39.01 -50.67 1.8 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.169 0.988 . . . . 2.19 113.139 170.293 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -65.27 -51.63 59.52 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.953 0.901 . . . . 4.05 109.169 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 41.6 tttm -56.98 -42.25 79.87 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 120.64 -0.424 . . . . 4.33 110.171 -175.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -50.3 -42.2 52.13 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.49 0.716 . . . . 3.24 111.604 174.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 tp -61.47 -48.15 82.43 Favored 'General case' 0 CA--C 1.527 0.076 0 O-C-N 120.663 -1.273 . . . . 3.82 109.357 -175.995 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.5 m -72.75 -45.71 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 CA-C-O 121.681 0.753 . . . . 2.07 109.43 -172.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 84.2 m -64.71 -45.37 86.85 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.211 1.004 . . . . 2.03 110.035 -177.368 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -81.18 -60.33 2.32 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.109 0.964 . . . . 3.46 110.734 -174.323 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -111.97 57.11 0.64 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.853 0.861 . . . . 5.53 112.478 -175.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 tp -159.1 81.17 2.65 Favored Pre-proline 0 CA--C 1.542 0.647 0 O-C-N 121.057 -1.027 . . . . 2.8 109.428 167.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -75.35 -44.41 0.31 Allowed 'Trans proline' 0 N--CA 1.452 -0.943 0 C-N-CA 123.302 2.668 . . . . 2.14 112.048 -167.385 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 35.8 t-80 -109.79 -74.88 0.64 Allowed 'General case' 0 C--N 1.343 0.319 0 CA-C-N 118.499 0.591 . . . . 4.25 110.523 176.919 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 7.2 tp 8.45 -91.78 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.969 2.508 . . . . 2.08 116.972 -166.265 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.4 mt -79.67 -27.66 40.79 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.382 1.073 . . . . 3.06 111.707 -178.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 42.5 mmtt 53.33 -166.42 0.07 Allowed 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 125.092 1.357 . . . . 9.33 110.073 -156.712 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.4 t0 58.7 52.08 7.11 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-O 125.021 2.343 . . . . 3.85 109.705 172.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.57 -1.17 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 CA-C-N 111.529 -2.578 . . . . 4.09 110.318 163.776 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.87 -66.37 1.45 Allowed Glycine 0 C--N 1.342 0.888 0 C-N-CA 125.527 1.536 . . . . 1.88 110.747 171.29 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 t -78.1 68.22 4.09 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.486 1.143 . . . . 2.44 108.964 -176.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -81.29 -36.08 30.26 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 125.118 1.367 . . . . 2.28 110.98 -172.811 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -53.96 -44.04 70.39 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.693 -0.629 . . . . 3.97 112.014 -175.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -57.53 -42.64 83.3 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.36 -0.838 . . . . 3.88 111.912 174.676 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -61.82 -49.41 76.4 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.217 -0.927 . . . . 4.04 109.043 172.383 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 10.3 ttt -49.66 -45.83 49.07 Favored 'General case' 0 C--O 1.22 -0.453 0 N-CA-C 110.055 -0.35 . . . . 2.68 110.055 178.109 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -62.68 -37.69 87.42 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.251 0.62 . . . . 4.21 111.224 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.8 t -58.15 -40.69 82.01 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 118.667 0.667 . . . . 4.03 110.358 170.737 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.7 mt -73.94 -78.84 0.09 Allowed 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.671 -0.643 . . . . 3.63 111.003 178.011 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -77.77 67.87 3.73 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.803 2.041 . . . . 2.14 110.006 -174.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 15.5 m -57.26 -19.65 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 113.349 0.87 . . . . 4.01 113.349 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -92.54 -9.69 40.33 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.898 1.279 . . . . 3.65 113.259 176.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 48.81 56.6 7.44 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.644 1.111 . . . . 4.21 111.624 -176.929 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 56.8 p-10 -95.36 -9.87 31.68 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.004 0.522 . . . . 2.25 110.265 170.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.2 m 63.61 20.73 12.39 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.595 1.158 . . . . 2.87 111.912 -173.815 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.63 111.49 16.28 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 105.346 -2.094 . . . . 3.25 105.346 171.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -84.84 93.64 8.55 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.025 -1.842 . . . . 2.28 106.025 173.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.22 155.6 4.79 Favored 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 123.565 0.746 . . . . 4.91 109.225 174.087 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -46.27 -55.54 7.05 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 119.099 0.863 . . . . 6.31 112.916 -172.364 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -60.09 -42.34 94.44 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.126 0.965 . . . . 2.31 111.472 176.757 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -59.89 -42.52 93.98 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.025 1.73 . . . . 3.13 110.066 -176.801 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -66.73 -52.59 42.64 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 124.956 1.302 . . . . 3.65 109.63 172.084 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.506 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 1.7 t-105 -42.99 -42.95 3.97 Favored 'General case' 0 C--N 1.344 0.365 0 O-C-N 123.735 0.647 . . . . 5.52 109.819 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 44.0 mtt180 -37.0 -50.3 0.88 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.302 1.041 . . . . 5.22 111.447 -174.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.2 tp -45.36 -48.92 13.32 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 123.611 0.764 . . . . 1.99 110.941 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.0 mp -69.02 -34.2 62.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 C-N-CA 124.91 1.284 . . . . 3.15 109.055 -173.935 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -63.55 -43.97 97.27 Favored Glycine 0 N--CA 1.442 -0.902 0 N-CA-C 110.733 -0.947 . . . . 1.32 110.733 172.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -59.89 -49.32 78.16 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 118.796 -0.621 . . . . 3.02 109.692 173.658 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 29.3 mt -49.25 -48.42 45.75 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.789 1.177 . . . . 3.45 112.448 -179.472 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.18 -25.92 35.69 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.416 0.686 . . . . 1.98 112.217 177.486 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -81.25 -58.26 3.13 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.292 1.837 . . . . 3.53 109.848 168.383 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -49.71 -38.89 35.09 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.662 1.585 . . . . 2.54 113.048 -172.64 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.6 tt -49.42 -37.03 10.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 112.223 0.453 . . . . 2.15 112.223 176.225 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -98.43 -44.85 6.35 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.961 1.304 . . . . 6.89 110.451 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 35.8 tttp -71.57 65.05 0.46 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 126.114 1.766 . . . . 3.61 109.792 178.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.82 -43.67 24.75 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 121.29 -0.881 . . . . 7.81 111.098 -176.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 16.1 tptt -162.36 67.08 0.23 Allowed 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 122.502 1.144 . . . . 8.96 108.74 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -75.64 63.91 1.63 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 126.667 1.987 . . . . 7.51 111.268 -175.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -140.08 -47.7 0.44 Allowed 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 123.915 0.886 . . . . 8.97 109.56 164.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -87.65 -47.28 8.8 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 119.095 -0.478 . . . . 11.39 110.08 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 77.4 mt 68.79 -64.25 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 125.962 1.705 . . . . 13.12 111.529 174.135 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? 78.84 -45.02 0.37 Allowed 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 128.14 2.576 . . . . 13.13 114.755 155.346 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . 2.278 39.4 mttp -178.26 130.36 0.13 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.905 1.682 . . . . 16.48 108.507 -157.025 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.406 ' NZ ' ' C ' ' A' ' 98' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.256 1.401 0 N-CA-C 104.531 -2.396 . . . . 14.37 104.531 163.94 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.41 1.2 ppp? . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 116.199 -1.857 . . . . 6.62 106.627 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 114.23 73.99 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 127.463 2.305 . . . . 6.39 115.633 160.672 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 27.53 100.92 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 117.754 2.501 . . . . 4.44 117.754 137.397 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -91.5 151.86 43.0 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 123.921 0.888 . . . . 9.07 110.717 168.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.57 162.92 37.08 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.868 3.046 . . . . 4.26 110.51 171.963 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 38.9 mt -139.72 150.28 44.65 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.686 0.794 . . . . 3.36 111.717 -159.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 6.5 t -90.9 -66.6 0.91 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.39 2.276 . . . . 2.71 115.07 -173.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -169.9 -75.66 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.92 0.888 . . . . 2.18 108.69 -162.348 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mt -56.83 -45.44 82.35 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 120.828 -1.17 . . . . 2.26 109.774 165.792 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 72.1 mt-10 -50.77 -48.78 59.25 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.932 0.893 . . . . 3.13 110.768 170.751 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -58.18 -45.74 87.0 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.085 -1.009 . . . . 3.64 110.791 176.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -60.24 -47.68 84.96 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 124.255 1.022 . . . . 2.32 110.752 -177.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.285 2.9 pp -61.68 -33.21 56.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 120.322 -0.551 . . . . 2.04 110.319 174.58 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.7 -58.97 5.96 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 118.687 0.676 . . . . 2.64 111.404 172.351 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 t -51.02 -40.1 57.39 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.386 0.994 . . . . 1.84 111.559 -168.483 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.16 -43.58 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 O-C-N 121.366 -0.834 . . . . 1.96 111.802 174.729 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 37.9 t -54.31 -58.37 3.91 Favored 'Isoleucine or valine' 0 C--N 1.341 0.21 0 CA-C-N 118.572 0.624 . . . . 1.9 110.334 174.17 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 13.8 t -56.23 -47.22 78.88 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 118.667 -0.682 . . . . 2.01 110.562 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 98.3 m -58.49 -44.34 89.36 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 119.651 1.114 . . . . 2.14 111.82 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -66.06 -43.82 86.32 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 117.952 -1.499 . . . . 5.56 110.131 175.029 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -57.81 -46.49 84.59 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.119 0.968 . . . . 4.27 111.824 -174.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 31.4 p -62.28 -25.43 67.85 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.392 -0.817 . . . . 2.8 111.654 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -80.52 -46.17 16.26 Favored 'General case' 0 C--O 1.224 -0.254 0 O-C-N 121.978 -0.451 . . . . 4.59 110.491 170.123 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.03 -25.41 58.57 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 127.787 2.435 . . . . 1.95 111.938 -178.064 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -45.09 -37.37 4.22 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.783 1.233 . . . . 5.31 111.021 171.267 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -60.93 -70.02 0.2 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 116.708 2.114 . . . . 3.29 116.708 -142.032 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -92.53 -74.3 0.52 Allowed 'General case' 0 C--N 1.34 0.185 0 C-N-CA 119.089 -1.044 . . . . 3.59 113.463 -166.825 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.38 152.86 22.95 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 126.384 1.945 . . . . 2.37 109.17 164.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 29.9 ttt180 43.37 100.64 0.0 OUTLIER 'General case' 0 C--O 1.241 0.63 0 C-N-CA 125.158 1.383 . . . . 4.66 113.992 146.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 59.9 pttt -61.06 -22.32 64.49 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 114.538 1.31 . . . . 4.18 114.538 -168.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -77.59 -25.52 50.0 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.488 0.551 . . . . 4.09 112.488 177.131 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 96.4 p -83.84 141.78 31.09 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 117.88 -1.057 . . . . 2.8 110.836 -172.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -93.31 115.34 27.92 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 106.124 -1.806 . . . . 3.1 106.124 149.366 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 9.1 t -99.92 177.67 5.04 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.047 0.539 . . . . 2.47 109.671 161.464 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 11.5 p -85.76 50.81 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 O-C-N 120.724 -1.235 . . . . 3.59 111.423 -173.554 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -159.75 53.28 0.36 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 107.38 -1.341 . . . . 2.74 107.38 147.909 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 73.8 mt-10 -160.48 -55.39 0.05 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 130.08 3.352 . . . . 1.83 103.444 -174.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.3 -50.58 73.43 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.401 -1.272 . . . . 3.42 109.643 169.006 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -62.65 -47.59 83.04 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 120.215 -0.594 . . . . 3.8 109.546 -171.235 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -39.91 -48.35 2.32 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.233 0.613 . . . . 4.26 112.078 167.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.8 tp -58.63 -49.27 78.13 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.906 -0.775 . . . . 2.87 108.906 -172.837 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 4.6 m -74.25 -54.56 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-N 115.703 -0.68 . . . . 1.81 109.933 -173.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 63.5 m -53.03 -46.12 68.3 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.599 1.16 . . . . 1.83 110.878 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -80.84 -62.39 1.68 Allowed 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 122.989 0.516 . . . . 2.2 111.156 -173.924 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -84.28 -42.28 16.0 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 115.633 1.716 . . . . 4.51 115.633 -163.208 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -44.31 -46.2 23.15 Favored Pre-proline 0 N--CA 1.474 0.736 0 N-CA-C 115.576 1.695 . . . . 3.18 115.576 -155.282 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -77.74 -29.45 4.48 Favored 'Trans proline' 0 N--CA 1.449 -1.13 0 CA-C-N 120.827 1.331 . . . . 2.89 109.477 -42.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 19.6 t60 -89.02 -49.69 6.62 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 125.224 1.41 . . . . 3.66 110.844 -168.724 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . 0.445 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 6.3 tp -34.24 -60.27 0.41 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.853 2.061 . . . . 2.28 113.852 -171.042 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 54.9 mt -96.16 111.82 23.74 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 108.239 -1.023 . . . . 2.03 108.239 172.244 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -64.49 154.46 35.82 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 120.237 -0.585 . . . . 6.18 109.582 165.599 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 17.0 t0 61.17 82.94 0.16 Allowed 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.425 1.49 . . . . 4.6 109.684 -168.534 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 29.5 m -96.78 21.94 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.786 0 CA-C-N 113.542 -1.663 . . . . 3.22 109.601 166.224 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -110.79 -65.93 0.53 Allowed Glycine 0 C--N 1.343 0.954 0 N-CA-C 109.605 -1.398 . . . . 3.71 109.605 -174.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -81.67 46.3 0.96 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.131 0.972 . . . . 5.18 109.803 -179.01 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -55.09 -42.28 72.67 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.189 0.996 . . . . 3.1 109.519 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -25.78 -51.26 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.348 1.859 . . . . 4.37 113.69 164.963 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -52.88 -56.51 15.32 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.986 0.812 . . . . 3.28 111.448 174.898 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -53.79 51.65 Favored 'General case' 0 C--O 1.224 -0.262 0 N-CA-C 108.236 -1.024 . . . . 5.6 108.236 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -50.67 -53.21 32.98 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 125.386 1.474 . . . . 4.14 111.015 -178.166 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -61.07 -30.8 70.55 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.366 0.666 . . . . 4.69 111.235 -178.543 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.2 t -71.82 -55.22 7.98 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 109.831 -0.433 . . . . 2.84 109.831 173.48 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 33.6 mt -51.9 -44.13 63.64 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.599 1.56 . . . . 2.77 111.446 -179.404 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.271 22.9 t0 -50.23 -8.7 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 118.105 2.631 . . . . 1.88 118.105 -173.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 23.3 m -32.92 -20.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.755 1 C-N-CA 132.074 4.15 . . . . 3.4 119.14 -133.74 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -50.02 -39.81 42.66 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 119.792 1.178 . . . . 3.29 109.544 156.964 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 62.3 63.43 1.05 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.633 1.573 . . . . 4.03 109.021 -171.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -116.93 -8.57 11.27 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.333 2.253 . . . . 2.7 112.754 -175.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 2.1 t 92.19 -7.42 0.2 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.068 2.147 . . . . 3.53 113.239 178.342 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -129.65 119.56 23.75 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 119.207 0.912 . . . . 4.42 110.736 -175.739 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.59 105.72 14.74 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 107.634 -1.247 . . . . 2.36 107.634 176.729 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -84.0 175.06 9.81 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.852 1.661 . . . . 4.31 110.971 -175.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -81.61 56.7 3.08 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.668 0.787 . . . . 5.72 110.643 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -168.83 45.89 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.855 0.836 . . . . 3.12 110.178 110.635 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -90.73 -61.36 1.69 Allowed 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 127.006 2.122 . . . . 2.21 107.779 153.484 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -50.87 -38.17 47.79 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 114.648 -1.16 . . . . 4.31 111.224 -170.101 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.464 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 5.1 t90 -38.86 -48.17 1.51 Allowed 'General case' 0 CA--C 1.541 0.604 0 O-C-N 124.562 1.164 . . . . 5.54 109.906 177.365 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 14.1 mmt-85 -42.02 -39.12 1.82 Allowed 'General case' 0 C--O 1.223 -0.311 0 CA-C-O 118.317 -0.849 . . . . 7.78 112.959 -176.133 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 6.5 tp -55.5 -47.68 75.81 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.091 1.314 . . . . 2.05 111.732 177.431 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 1.4 mt -69.93 -34.88 62.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 O-C-N 120.92 -1.113 . . . . 2.89 108.701 178.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -41.32 -52.31 4.32 Favored Glycine 0 C--N 1.345 1.029 0 C-N-CA 126.075 1.798 . . . . 2.07 110.216 168.596 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -76.67 -60.31 2.4 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 112.031 -2.085 . . . . 2.71 108.842 -175.931 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . 0.445 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 6.5 mp -37.44 -58.46 0.85 Allowed 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 120.767 1.621 . . . . 3.35 112.688 -172.884 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.91 -28.62 69.65 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.347 1.059 . . . . 2.25 112.67 -176.553 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -80.32 -51.79 8.47 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.668 0.787 . . . . 2.72 110.092 172.248 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -51.48 -44.47 62.48 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.292 1.037 . . . . 3.52 112.028 -176.932 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 8.9 tt -52.92 -38.59 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 118.926 0.785 . . . . 1.82 111.722 175.291 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.75 -30.75 26.42 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.827 1.651 . . . . 4.19 113.892 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 53.2 tttp -97.94 147.28 24.63 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.785 1.634 . . . . 5.46 111.936 -163.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -84.69 -60.87 1.93 Allowed 'General case' 0 C--N 1.342 0.26 0 O-C-N 121.538 -0.727 . . . . 5.65 112.388 -176.778 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 53.4 pttt -168.51 4.14 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.349 1.46 . . . . 9.28 111.781 -174.487 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.65 53.32 1.83 Allowed 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.152 1.381 . . . . 4.42 108.248 -146.672 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 42.1 tp -106.22 -71.62 0.74 Allowed 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.303 1.441 . . . . 5.63 109.462 -168.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.3 162.92 8.72 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 118.597 0.635 . . . . 8.19 110.382 179.024 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 7.3 tp -145.73 48.74 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-O 122.945 1.355 . . . . 10.07 107.921 166.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -166.75 152.12 7.91 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.22 -0.9 . . . . 9.66 109.484 177.22 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -177.69 137.28 0.2 Allowed 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 129.093 2.957 . . . . 10.36 104.929 172.742 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.256 1.438 0 N-CA-C 103.947 -2.612 . . . . 10.79 103.947 168.717 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.0 mtt . . . . . 0 N--CA 1.472 0.629 0 N-CA-C 106.012 -1.848 . . . . 6.85 106.012 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -99.28 179.09 4.7 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-N 119.362 0.983 . . . . 3.76 110.38 177.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 80.59 77.75 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 127.397 2.279 . . . . 4.11 110.559 -176.304 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -77.33 122.94 86.87 Favored Pre-proline 0 N--CA 1.442 -0.869 0 C-N-CA 124.427 1.091 . . . . 5.39 109.117 -175.515 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -70.04 140.77 42.43 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 121.96 1.773 . . . . 2.71 108.769 175.014 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.0 mt -99.3 176.03 5.67 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.394 -0.965 . . . . 2.59 108.394 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.5 t -70.47 162.74 28.19 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 120.952 -1.092 . . . . 2.12 109.749 178.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -56.44 -50.19 72.4 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.649 0.738 . . . . 2.02 110.474 -170.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.6 mt -60.74 -46.55 90.0 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 117.251 -1.357 . . . . 2.63 111.945 176.38 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -49.65 -55.13 14.83 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 120.656 1.571 . . . . 2.24 112.171 172.335 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -50.55 -52.53 38.0 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.663 0.744 . . . . 4.04 109.299 176.787 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.4 t -57.6 -50.86 71.75 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.285 -0.87 . . . . 2.52 111.441 -176.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.2 pp -66.37 -39.05 83.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 CA-C-O 118.169 -0.92 . . . . 1.83 111.07 -179.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -58.89 -55.61 32.85 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 119.619 1.1 . . . . 2.98 109.93 178.959 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 15.0 t -54.13 -38.84 65.9 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.625 0.648 . . . . 2.26 112.456 -174.129 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 m -75.03 -40.54 45.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 O-C-N 120.714 -1.241 . . . . 1.94 111.148 175.225 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.2 t -57.83 -49.54 80.65 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 CA-C-N 119.196 0.907 . . . . 1.9 110.461 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.2 t -60.12 -44.94 94.5 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.828 0.74 . . . . 1.66 110.538 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 62.0 m -58.02 -56.47 21.56 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.759 -0.588 . . . . 1.81 110.192 177.096 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -43.63 -56.3 3.81 Favored 'General case' 0 N--CA 1.458 -0.065 0 C-N-CA 125.009 1.324 . . . . 4.48 110.299 172.626 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -58.1 -52.86 63.77 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.076 0.95 . . . . 4.08 110.261 -174.681 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.5 t -65.15 -33.22 75.51 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.195 -0.602 . . . . 2.62 111.538 -177.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -61.47 -50.94 70.72 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.842 0.746 . . . . 3.96 110.473 168.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.01 -19.68 63.11 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.712 1.605 . . . . 1.86 112.26 -175.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.68 -18.96 58.24 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.557 1.543 . . . . 4.72 112.054 176.67 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.71 -69.39 0.13 Allowed 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.953 0.797 . . . . 3.88 112.171 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -111.26 171.25 7.59 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 125.73 1.612 . . . . 2.61 107.082 -172.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -20.75 131.57 0.01 OUTLIER Glycine 0 CA--C 1.53 1.019 0 C-N-CA 127.338 2.399 . . . . 1.9 114.333 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.3 mmm-85 64.92 103.25 0.04 OUTLIER 'General case' 0 C--O 1.237 0.438 0 C-N-CA 124.699 1.2 . . . . 7.78 111.502 178.508 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.9 pttm -73.21 56.2 0.46 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.85 0.86 . . . . 4.31 111.439 173.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -163.38 -54.62 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.309 1.443 . . . . 3.64 108.229 -176.556 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 97.8 p -83.91 150.29 25.79 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-O 121.213 0.53 . . . . 2.32 111.295 175.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -96.51 126.27 41.58 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 107.611 -1.255 . . . . 2.98 107.611 168.594 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 t -83.37 177.42 8.5 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 109.554 -0.536 . . . . 2.86 109.554 164.087 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.7 p -61.42 -49.62 83.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 O-C-N 121.963 -0.46 . . . . 3.02 111.517 -171.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -63.49 -54.2 40.05 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 108.333 -0.988 . . . . 3.64 108.333 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -36.97 -51.83 0.93 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 125.238 1.415 . . . . 1.93 111.53 172.512 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -61.87 -53.97 48.54 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.511 -0.768 . . . . 3.55 110.791 177.53 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.6 ttmm -56.32 -41.8 76.61 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.944 -0.472 . . . . 3.27 110.219 -176.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -55.41 -36.31 66.31 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 122.768 0.427 . . . . 3.3 111.145 178.274 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.1 tt -68.17 -48.26 65.8 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 119.403 1.001 . . . . 3.54 109.737 -178.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.1 m -67.15 -39.94 84.18 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 N-CA-C 109.507 -0.553 . . . . 1.88 109.507 -176.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 95.0 m -63.37 -52.94 59.62 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 124.011 0.924 . . . . 2.13 110.69 176.554 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -78.34 -54.78 5.82 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.505 0.722 . . . . 2.72 111.257 -167.684 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -120.32 43.11 2.8 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.498 0.719 . . . . 3.57 111.045 -163.74 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 tp -153.18 61.07 3.48 Favored Pre-proline 0 CA--C 1.542 0.671 0 O-C-N 121.885 -0.509 . . . . 2.56 111.013 177.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -66.72 -43.82 6.77 Favored 'Trans proline' 0 N--CA 1.453 -0.858 0 C-N-CA 124.169 3.246 . . . . 2.02 115.385 -165.858 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -132.27 26.98 4.49 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 120.008 1.276 . . . . 4.35 112.281 -166.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 11.5 tp -99.93 -75.99 0.56 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 122.566 0.347 . . . . 2.35 110.796 -168.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.0 mp -91.74 -175.94 4.31 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.639 1.175 . . . . 3.01 108.604 166.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -134.74 -160.76 1.08 Allowed 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 106.93 -1.507 . . . . 6.41 106.93 159.904 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 69.15 26.94 5.38 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.639 1.575 . . . . 3.78 111.291 171.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -68.38 -8.97 10.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.939 1.295 . . . . 2.98 112.962 -174.64 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.65 -64.28 4.24 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 108.792 -1.723 . . . . 2.02 108.792 166.924 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.89 53.65 0.12 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 129.191 2.996 . . . . 3.21 111.646 178.384 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -74.31 -26.36 60.12 Favored 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 124.985 1.314 . . . . 1.91 109.33 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -54.14 -46.36 72.22 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.663 1.185 . . . . 4.23 111.224 176.504 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -50.12 -54.85 17.78 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.788 0.804 . . . . 2.87 109.7 174.208 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.02 -47.93 83.44 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.412 -0.813 . . . . 6.02 109.966 -177.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 7.4 tmm? -51.12 -58.42 6.16 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.965 1.306 . . . . 3.22 109.455 176.586 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.9 mttt -52.83 -44.18 66.51 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.422 1.089 . . . . 4.2 110.983 178.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.1 m -65.68 -38.99 90.8 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.173 0.589 . . . . 2.91 111.839 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 34.8 mt -77.9 -47.09 19.53 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.501 1.12 . . . . 2.87 111.708 -175.49 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -72.47 91.46 1.38 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 123.455 0.702 . . . . 2.34 110.194 -170.35 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.2 m -55.38 -37.55 45.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 C-N-CA 122.796 0.438 . . . . 3.25 112.143 -167.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -97.26 -0.88 45.9 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.762 0.653 . . . . 2.84 112.762 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 46.21 48.74 13.02 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.489 1.515 . . . . 5.24 111.806 -178.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.4 p30 -90.84 -12.62 35.76 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.207 1.003 . . . . 1.78 110.685 168.895 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 35.4 p 70.47 7.05 6.07 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 127.52 2.328 . . . . 3.29 114.074 -176.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -95.06 112.82 24.48 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 104.741 -2.318 . . . . 2.93 104.741 160.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -80.74 96.67 7.01 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 103.766 -2.679 . . . . 2.29 103.766 171.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.15 158.32 2.27 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.481 -0.933 . . . . 4.54 108.481 171.837 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.1 p90 -38.94 -52.41 1.78 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.879 1.271 . . . . 7.57 111.915 -179.132 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -70.36 -35.17 73.39 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.181 0.592 . . . . 2.07 112.494 -179.108 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -65.13 -51.73 59.52 Favored 'General case' 0 C--O 1.227 -0.129 0 O-C-N 121.643 -0.661 . . . . 2.15 109.257 176.46 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -56.1 -49.86 72.68 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.788 0.435 . . . . 4.42 110.058 178.018 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 0.7 OUTLIER -40.02 -44.0 1.66 Allowed 'General case' 0 CA--C 1.535 0.402 0 O-C-N 124.164 0.915 . . . . 5.19 110.691 179.169 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -42.58 -40.49 2.7 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 114.176 1.176 . . . . 4.46 114.176 178.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 60.4 tp -46.19 -51.23 14.59 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 119.252 0.933 . . . . 2.0 111.107 175.401 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 78.1 mt -57.38 -28.94 31.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 124.656 1.182 . . . . 2.64 107.824 -175.315 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.503 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -76.99 -48.89 8.03 Favored Glycine 0 N--CA 1.44 -1.071 0 N-CA-C 109.607 -1.397 . . . . 1.26 109.607 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -48.61 -52.61 22.16 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-O 117.752 -1.118 . . . . 4.14 108.291 169.865 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 11.6 mt -49.48 -52.78 26.98 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 120.077 1.308 . . . . 3.68 111.712 178.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.4 -21.32 24.3 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.9 0.88 . . . . 1.85 112.386 176.073 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.62 -61.5 1.95 Allowed 'General case' 0 C--O 1.221 -0.437 0 CA-C-O 117.434 -1.27 . . . . 3.44 112.956 162.349 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . 0.446 ' CD ' ' HZ2' ' A' ' 89' ' ' LYS . 8.8 mm-40 -54.91 -33.83 62.5 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 125.834 1.654 . . . . 2.93 112.119 -166.103 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.7 tp -38.39 -44.3 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 124.808 1.243 . . . . 2.44 111.465 167.247 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 51.4 mtt85 -104.67 -58.47 1.88 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 127.044 2.138 . . . . 8.93 110.665 178.265 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . 0.446 ' HZ2' ' CD ' ' A' ' 86' ' ' GLU . 3.3 ttpm? -72.28 54.79 0.31 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.717 1.607 . . . . 4.23 112.784 -175.075 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -81.02 -19.64 43.47 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 120.741 -1.224 . . . . 8.1 114.053 -172.52 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.0 tptt 177.71 -31.07 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.281 1.832 . . . . 10.9 110.884 170.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 75.83 35.41 0.51 Allowed 'General case' 0 CA--C 1.527 0.081 0 C-N-CA 123.308 0.643 . . . . 5.5 112.184 151.677 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 21.2 tp -149.57 -54.84 0.17 Allowed 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.135 -1.432 . . . . 10.09 107.135 174.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -111.61 -65.44 1.17 Allowed 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 123.405 0.682 . . . . 11.52 110.873 174.529 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 0.259 1.4 pp 50.6 -173.77 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 C-N-CA 125.919 1.688 . . . . 9.28 112.849 -165.986 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.03 126.85 11.81 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 106.09 -1.818 . . . . 14.65 106.09 163.562 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -178.18 -63.4 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 124.723 1.209 . . . . 11.36 107.961 -173.262 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . 2.396 6.7 mtpm? . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.054 -1.451 . . . . 10.96 111.01 -176.623 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.418 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.613 0 N-CA-C 105.487 -2.042 . . . . 7.49 105.487 . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 66.12 -170.97 0.19 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.8 1.182 . . . . 5.79 113.16 169.287 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 57.76 51.48 9.23 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 125.43 1.492 . . . . 5.26 111.59 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -117.59 153.53 50.5 Favored Pre-proline 0 CA--C 1.536 0.408 0 C-N-CA 126.05 1.74 . . . . 7.99 106.693 170.235 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -71.98 150.12 54.22 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.758 2.305 . . . . 3.56 108.981 172.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.0 mt -140.17 137.57 34.48 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.68 -0.859 . . . . 3.45 108.68 -166.345 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 6.4 t -69.15 -65.59 0.69 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.062 0.764 . . . . 2.71 113.062 -174.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 43.9 tt0 -168.82 -75.97 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 108.78 -0.822 . . . . 1.96 108.78 -162.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 mt -57.3 -45.29 84.32 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 120.98 -1.075 . . . . 2.0 109.366 167.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -56.06 -39.11 71.54 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.867 1.267 . . . . 3.46 110.52 174.218 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -50.89 28.05 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 108.852 -0.795 . . . . 4.46 108.852 -176.47 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 5.4 p -61.3 -35.48 77.45 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.445 -0.798 . . . . 2.12 110.747 -172.319 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.332 2.9 pp -62.38 -42.41 95.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-O 118.395 -0.812 . . . . 1.97 111.311 173.901 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -67.2 -42.94 83.29 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-N 120.763 1.62 . . . . 3.75 110.419 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 16.9 m -43.77 -47.68 8.01 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 119.261 0.937 . . . . 3.5 112.304 175.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 35.2 m -74.02 -37.16 46.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 O-C-N 120.777 -1.202 . . . . 2.09 111.431 177.604 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 95.6 t -54.85 -49.68 67.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 119.308 0.958 . . . . 2.57 110.242 173.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -64.24 -39.26 93.59 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.494 -0.754 . . . . 2.17 110.656 179.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 34.6 m -58.9 -38.72 79.54 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.78 0.718 . . . . 2.29 111.076 174.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . 0.406 ' CE1' ' CE2' ' B' ' 76' ' ' TYR . 0.0 OUTLIER -60.28 -52.57 64.7 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.183 -0.948 . . . . 5.47 109.165 169.325 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -55.01 -41.04 70.79 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.499 0.72 . . . . 4.31 112.672 -172.383 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 16.6 p -57.93 -30.26 65.8 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 118.722 -0.656 . . . . 3.43 112.197 177.522 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -82.07 -34.62 29.3 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 119.376 0.989 . . . . 4.12 112.514 167.007 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -51.05 -44.6 61.13 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 124.167 0.987 . . . . 2.07 109.949 -174.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -51.49 -38.55 54.5 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 124.545 1.153 . . . . 3.89 112.96 178.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.47 -69.17 0.14 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 116.89 2.181 . . . . 2.18 116.89 -136.574 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -93.15 -76.91 0.46 Allowed 'General case' 0 C--N 1.341 0.204 0 CA-C-O 122.216 1.008 . . . . 3.73 113.652 -173.718 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.06 153.53 22.37 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 127.593 2.521 . . . . 2.88 109.767 167.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.6 ttt85 45.06 101.63 0.0 OUTLIER 'General case' 0 C--O 1.245 0.824 0 C-N-CA 125.706 1.602 . . . . 5.06 114.028 153.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 58.7 pttt -73.09 59.6 0.53 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.712 1.205 . . . . 4.83 112.113 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -160.98 -61.19 0.06 Allowed 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.173 1.389 . . . . 3.71 108.501 -168.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 55.2 p -97.44 158.71 15.33 Favored 'General case' 0 C--O 1.245 0.842 0 C-N-CA 123.418 0.687 . . . . 2.35 109.648 -173.588 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 62.6 mt -107.91 157.06 18.51 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 124.491 1.12 . . . . 3.6 109.187 164.285 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 7.9 t -152.26 178.62 9.31 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 106.684 -1.599 . . . . 3.92 106.684 167.354 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 3.2 t -83.85 56.84 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 118.743 0.701 . . . . 3.75 112.008 -161.986 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -156.5 56.4 0.56 Allowed 'General case' 0 C--O 1.225 -0.211 0 N-CA-C 106.782 -1.562 . . . . 2.74 106.782 141.317 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -173.87 -52.09 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 125.842 1.657 . . . . 1.74 106.703 -166.191 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -61.6 -53.06 61.34 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.461 -0.79 . . . . 3.52 108.968 168.298 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 38.4 tttt -57.93 -37.06 73.42 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.57 -0.286 . . . . 3.6 111.08 -174.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -47.35 -36.86 10.09 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.806 0.669 . . . . 3.49 112.806 173.092 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 6.6 tt -66.45 -51.28 58.56 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 107.799 -1.185 . . . . 3.52 107.799 -175.579 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 14.3 m -67.4 -46.14 84.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 109.802 -0.444 . . . . 1.88 109.802 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 99.0 m -55.73 -50.73 69.57 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 123.93 0.892 . . . . 2.01 111.517 176.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -76.1 -61.62 1.88 Allowed 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 118.302 0.501 . . . . 3.28 111.111 -174.558 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 40.4 mm-40 -81.36 -46.44 14.66 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 112.833 0.679 . . . . 3.42 112.833 -157.507 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -57.77 -36.71 48.17 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 122.874 0.469 . . . . 3.35 111.893 -162.294 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -45.1 -57.25 2.19 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 119.767 -3.014 . . . . 2.36 108.871 -83.271 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -55.13 -42.74 73.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 125.251 1.42 . . . . 3.55 112.55 -175.907 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 35.7 tp -52.09 -47.4 65.24 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 120.951 0.405 . . . . 1.99 110.69 -169.593 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . 0.4 ' C ' ' H ' ' B' ' 52' ' ' ASP . 92.6 mt -114.96 69.58 0.72 Allowed 'General case' 0 C--O 1.228 -0.067 0 C-N-CA 125.341 1.456 . . . . 2.86 109.067 163.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.94 8.59 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 115.752 1.76 . . . . 5.9 115.752 178.157 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.4 ' H ' ' C ' ' B' ' 50' ' ' LEU . 30.8 t0 -105.05 89.82 3.25 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 104.733 -2.321 . . . . 3.33 104.733 163.669 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 19.7 m -93.52 14.81 2.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 114.991 -1.004 . . . . 2.44 108.944 166.814 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -83.36 -73.49 1.24 Allowed Glycine 0 N--CA 1.443 -0.892 0 N-CA-C 107.345 -2.302 . . . . 2.71 107.345 176.791 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 55.6 m -80.06 54.33 1.9 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.516 1.127 . . . . 3.2 112.076 -169.089 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.09 -40.89 87.01 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 124.811 1.245 . . . . 2.22 109.143 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -29.43 -66.52 0.09 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 127.164 2.186 . . . . 4.25 114.208 165.534 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -47.66 -53.11 15.87 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.854 0.835 . . . . 2.86 110.007 177.024 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -38.28 78.19 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-O 118.427 -0.796 . . . . 5.4 111.12 178.714 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.7 ttp -60.59 -45.64 93.22 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 119.881 1.218 . . . . 4.17 109.843 178.113 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -61.71 -42.81 99.44 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 120.56 -0.456 . . . . 5.23 110.278 174.292 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 11.4 m -62.67 -30.47 71.41 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 122.86 0.464 . . . . 2.18 112.029 176.617 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 8.4 mt -76.45 -59.52 2.73 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.928 1.691 . . . . 2.26 109.627 -178.436 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.344 2.7 t70 -57.18 -14.42 4.11 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 116.571 2.063 . . . . 2.92 116.571 -159.233 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 28.8 m -34.61 -19.92 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 130.635 3.574 . . . . 3.54 118.951 -132.066 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -48.98 -42.78 38.87 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 120.531 1.514 . . . . 4.64 110.092 151.848 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 70.98 55.01 0.23 Allowed 'General case' 0 C--N 1.34 0.189 0 CA-C-O 122.14 0.971 . . . . 4.72 109.23 168.727 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 16.7 p30 -87.15 -133.21 0.07 Allowed 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 104.636 -2.357 . . . . 4.17 104.636 158.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 61.8 m -146.14 29.11 1.09 Allowed 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.123 -1.611 . . . . 3.62 110.945 165.178 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -129.94 110.78 11.95 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 127.49 2.316 . . . . 6.28 105.646 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.24 108.39 7.0 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 104.421 -2.437 . . . . 1.97 104.421 177.919 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.12 175.11 6.9 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.257 1.423 . . . . 4.51 108.947 -178.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 18.9 p90 -86.9 53.05 2.69 Favored 'General case' 0 C--O 1.224 -0.281 0 O-C-N 120.434 -1.417 . . . . 6.7 113.793 -169.169 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.57 51.64 0.45 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 105.325 -2.102 . . . . 2.77 105.325 127.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -89.2 -63.94 1.22 Allowed 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.776 -0.824 . . . . 3.11 108.776 152.624 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . 0.406 ' CE2' ' CE1' ' B' ' 20' ' ' PHE . 0.0 OUTLIER -53.55 -35.79 61.13 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.684 0.394 . . . . 8.75 110.865 -170.32 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 67.3 t-105 -38.62 -51.72 1.64 Allowed 'General case' 0 N--CA 1.439 -1.018 0 O-C-N 124.646 1.216 . . . . 5.71 110.744 173.612 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 11.0 mmm180 -45.99 -48.09 16.64 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.623 -0.673 . . . . 4.93 111.429 177.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 6.7 tp -58.03 -41.28 82.86 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.197 0.599 . . . . 2.05 111.104 -179.652 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 55.9 mt -64.8 -35.46 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.006 0 N-CA-C 105.945 -1.872 . . . . 2.33 105.945 -176.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.575 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -66.09 -48.2 67.11 Favored Glycine 0 CA--C 1.494 -1.224 0 N-CA-C 110.209 -1.156 . . . . 1.69 110.209 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -62.44 -61.48 2.42 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-O 117.89 -1.053 . . . . 2.31 108.213 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . 0.262 3.8 pp -53.98 -36.22 62.68 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.949 1.25 . . . . 2.93 112.573 -178.408 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.41 -61.68 2.37 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 119.183 0.901 . . . . 2.19 110.804 170.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 18.3 ttpp -52.92 -41.16 64.16 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.356 1.863 . . . . 2.7 111.594 -175.894 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -51.08 -33.73 27.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 127.47 2.308 . . . . 3.75 111.463 178.578 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 7.1 tt -52.7 -40.43 34.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 118.607 0.639 . . . . 2.33 110.226 -176.735 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -84.85 -61.09 1.86 Allowed 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 121.431 0.634 . . . . 7.43 110.84 164.721 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 33.5 mttp -82.66 61.2 5.64 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.047 0.939 . . . . 6.42 111.486 -168.643 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.9 -19.39 65.86 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.131 0.419 . . . . 10.63 112.131 -175.252 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -128.4 -35.63 1.96 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 124.661 1.185 . . . . 8.8 110.553 176.116 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -77.9 39.73 0.3 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.659 2.384 . . . . 4.98 111.746 -172.309 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . 0.41 ' CG ' ' H ' ' B' ' 94' ' ' LYS . 0.4 OUTLIER -93.84 -111.18 0.11 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.418 1.087 . . . . 7.36 108.644 179.238 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . 0.41 ' H ' ' CG ' ' B' ' 93' ' ' LEU . 11.8 mptt 63.71 153.18 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.984 2.114 . . . . 9.35 111.99 -175.564 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -161.19 124.42 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 N-CA-C 106.345 -1.724 . . . . 9.61 106.345 178.689 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 33.1 ptt-85 -160.79 138.2 9.25 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 108.813 -0.81 . . . . 9.61 108.813 173.029 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -179.58 138.71 0.13 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.361 1.865 . . . . 7.53 107.641 172.599 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 9.3 tptp . . . . . 0 C--O 1.252 1.214 0 N-CA-C 105.113 -2.18 . . . . 8.22 105.113 155.657 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.3 mtm . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 106.255 -1.757 . . . . 8.1 106.255 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -174.08 174.37 2.96 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 125.321 1.448 . . . . 4.07 107.537 -171.335 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.15 96.04 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 128.532 2.733 . . . . 3.84 110.869 175.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -88.35 128.92 51.41 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 124.194 0.998 . . . . 5.57 108.885 176.735 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -76.49 158.19 36.38 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.746 2.297 . . . . 2.99 110.323 -178.424 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 72.3 mt -128.57 166.72 18.3 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.179 1.391 . . . . 2.82 107.925 179.329 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.3 t -72.95 174.48 7.75 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 118.588 0.631 . . . . 2.53 110.163 -179.747 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -68.18 -43.76 77.42 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 122.535 1.159 . . . . 2.74 109.211 -177.25 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.8 mp -61.1 -41.57 96.91 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.361 -0.836 . . . . 3.48 109.962 178.571 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 78.1 mt-10 -62.53 -49.12 76.58 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.475 1.11 . . . . 2.52 111.299 175.241 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.72 -52.83 63.82 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 108.359 -0.978 . . . . 5.31 108.359 -179.816 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.4 p -61.68 -40.62 95.6 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.575 -0.284 . . . . 1.99 110.913 -170.317 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.28 2.8 pp -67.1 -39.66 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 O-C-N 121.78 -0.575 . . . . 1.8 110.209 177.974 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -60.89 -51.65 68.4 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.867 0.758 . . . . 3.69 110.018 174.513 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.5 m -44.09 -47.4 8.89 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.697 1.999 . . . . 3.05 112.354 175.625 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 30.4 m -76.33 -35.03 26.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 O-C-N 120.348 -1.47 . . . . 1.78 111.568 177.695 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.6 t -59.97 -42.79 90.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 119.484 1.038 . . . . 1.85 111.148 174.562 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.2 t -61.64 -49.07 78.02 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 120.812 -1.18 . . . . 1.8 109.532 175.201 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.1 m -52.51 -43.4 65.07 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 118.473 0.578 . . . . 1.74 110.613 176.269 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.458 ' HA ' ' CZ ' ' A' ' 23' ' ' PHE . 41.5 t80 -48.43 -57.08 6.61 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 123.683 0.793 . . . . 4.55 110.548 174.767 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -59.56 -41.78 90.93 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 119.724 -0.79 . . . . 4.82 111.388 177.468 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.9 m -53.33 -43.86 67.97 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.576 0.584 . . . . 3.49 112.576 177.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . 0.458 ' CZ ' ' HA ' ' A' ' 20' ' ' PHE . 22.8 p90 -81.58 -43.49 18.59 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 119.324 0.965 . . . . 8.35 113.201 176.158 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.16 -20.73 65.66 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 125.806 1.642 . . . . 1.78 112.16 -169.617 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -17.86 64.45 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 117.571 -1.205 . . . . 5.65 113.622 172.571 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -50.99 -58.18 6.71 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.925 1.239 . . . . 3.37 112.512 -172.308 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -121.6 171.12 9.06 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.286 1.834 . . . . 2.54 107.285 -179.371 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -1.59 106.57 0.01 OUTLIER Glycine 0 CA--C 1.53 0.995 0 C-N-CA 127.443 2.449 . . . . 2.01 114.268 170.973 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . 0.278 30.5 mtt85 66.11 109.45 0.04 OUTLIER 'General case' 0 C--O 1.239 0.544 0 N-CA-C 114.732 1.382 . . . . 5.87 114.732 167.244 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -62.22 59.95 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.936 0.894 . . . . 6.49 112.051 163.28 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -165.38 -57.82 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 127.048 2.139 . . . . 3.26 106.725 -171.587 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.8 p -84.92 122.75 29.64 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 125.079 1.352 . . . . 3.37 109.382 177.137 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -90.83 156.59 17.92 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 107.715 -1.217 . . . . 3.34 107.715 160.312 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.7 t -152.42 177.91 10.1 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.912 0.885 . . . . 4.26 108.784 172.021 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -39.93 -64.74 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 125.487 1.515 . . . . 3.82 112.955 -168.474 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -60.49 -60.19 4.2 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.195 0.452 . . . . 2.17 110.416 -175.767 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -38.77 -52.28 1.71 Allowed 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.601 1.56 . . . . 1.84 112.296 175.472 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -63.99 -51.74 62.86 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 114.803 -1.09 . . . . 3.97 108.726 -179.416 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -52.56 -44.95 66.2 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.898 0.479 . . . . 4.75 111.185 178.017 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -54.26 -41.44 68.79 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.626 0.648 . . . . 2.23 111.448 175.416 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 45.4 tp -64.67 -49.73 69.8 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.632 -0.877 . . . . 3.65 108.632 -176.445 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.8 m -65.8 -52.88 44.61 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 108.528 -0.915 . . . . 2.04 108.528 -174.661 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 96.5 m -52.18 -53.18 46.34 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.936 1.294 . . . . 2.9 111.511 178.669 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -75.62 -53.37 8.69 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.42 0.288 . . . . 2.7 110.285 -171.545 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -85.4 -33.66 21.91 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 117.717 -1.135 . . . . 5.88 112.446 -169.789 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.0 mt -103.17 98.3 11.63 Favored Pre-proline 0 CA--C 1.538 0.494 0 CA-C-N 120.368 1.44 . . . . 3.96 111.633 -171.914 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -71.38 -39.15 3.97 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 121.911 1.741 . . . . 1.81 111.918 -178.025 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -141.81 -12.29 0.87 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.477 1.288 . . . . 6.28 114.477 -170.8 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 28.0 tp -66.32 -68.79 0.34 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 119.032 0.833 . . . . 2.69 110.728 -171.353 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 36.9 mt -93.01 100.39 12.83 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 106.252 -1.759 . . . . 2.46 106.252 163.63 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 62.4 mttt -69.12 174.99 4.08 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 120.213 -0.595 . . . . 6.44 109.962 165.405 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 25.4 t0 59.49 50.48 7.46 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 124.593 2.14 . . . . 4.13 108.963 177.913 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.7 m -58.47 -35.69 55.57 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 CA-C-N 112.338 -2.21 . . . . 2.98 108.414 161.551 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -40.75 -61.69 1.84 Allowed Glycine 0 C--N 1.342 0.91 0 C-N-CA 125.937 1.732 . . . . 1.6 111.783 174.519 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 52.5 m -103.76 43.49 1.08 Allowed 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.755 0.822 . . . . 3.32 111.602 177.397 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -41.05 -43.74 2.25 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 124.252 1.021 . . . . 2.61 109.608 162.611 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -39.41 -41.49 0.96 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 127.88 2.472 . . . . 3.72 112.231 179.083 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -62.09 -54.36 42.43 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 121.686 -0.633 . . . . 5.06 110.561 175.955 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.95 -50.33 66.72 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 108.304 -0.999 . . . . 3.55 108.304 176.54 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -47.29 -58.16 4.43 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.064 1.745 . . . . 3.44 110.188 -176.766 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.53 -35.16 69.93 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.514 -0.312 . . . . 5.86 111.58 -179.49 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.4 t -73.17 -46.81 48.64 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.864 0.866 . . . . 3.48 111.468 -178.528 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.5 mp -59.26 -48.37 81.87 Favored 'General case' 0 C--O 1.232 0.173 0 O-C-N 121.843 -0.536 . . . . 3.18 109.629 176.584 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -71.21 83.41 0.74 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 120.802 0.334 . . . . 1.86 110.786 -171.549 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.3 m -45.97 -41.32 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 C-N-CA 125.761 1.624 . . . . 3.9 113.941 -173.547 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -96.19 -9.06 31.41 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.26 1.024 . . . . 3.33 111.845 -179.869 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 53.02 35.34 19.2 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.356 1.462 . . . . 4.59 111.67 177.206 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 57.6 p30 -65.96 -16.64 64.05 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.277 1.031 . . . . 2.06 110.765 170.903 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m 83.73 11.3 0.43 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.616 2.366 . . . . 3.3 112.472 -179.064 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -111.06 132.34 54.32 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 106.884 -1.524 . . . . 3.05 106.884 164.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -95.68 102.46 14.26 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 104.563 -2.384 . . . . 2.37 104.563 163.042 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -100.12 171.36 7.86 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 118.96 0.8 . . . . 4.14 109.88 170.929 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -38.68 -60.33 0.84 Allowed 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.267 1.581 . . . . 6.19 115.267 -155.033 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -70.01 -26.95 64.31 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.567 0.621 . . . . 2.37 112.09 -174.876 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -73.14 -57.53 3.96 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 107.746 -1.205 . . . . 2.26 107.746 176.24 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -50.88 -42.52 59.15 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 124.18 0.992 . . . . 4.72 110.827 177.423 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.433 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 3.1 t90 -40.03 -44.79 1.81 Allowed 'General case' 0 CA--C 1.538 0.509 0 O-C-N 124.131 0.894 . . . . 6.21 109.815 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.4 mtt-85 -43.58 -33.96 1.29 Allowed 'General case' 0 C--O 1.226 -0.169 0 N-CA-C 113.227 0.825 . . . . 5.3 113.227 -178.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.3 tp -51.92 -49.62 62.71 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-O 117.616 -1.183 . . . . 2.16 111.388 174.767 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.4 mt -71.31 -36.5 61.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 C-N-CA 124.96 1.304 . . . . 3.01 108.826 179.059 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -39.22 -56.78 2.24 Favored Glycine 0 C--N 1.344 1.02 0 C-N-CA 126.01 1.767 . . . . 1.92 111.214 170.057 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -74.17 -52.86 11.19 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-N 110.723 -2.738 . . . . 2.72 109.344 179.386 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 2.6 tp -39.25 -56.12 1.57 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.024 1.729 . . . . 4.03 112.517 -172.934 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.65 -33.24 71.28 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.129 0.571 . . . . 2.35 112.504 179.003 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.572 ' CE ' ' HB2' ' B' ' 74' ' ' ASN . 0.7 OUTLIER -73.36 -44.86 57.87 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.868 1.267 . . . . 3.19 110.451 173.782 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -67.42 -16.16 64.08 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 125.173 1.389 . . . . 3.28 113.089 -174.021 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 5.3 tt -58.94 -36.73 63.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 O-C-N 121.435 -0.79 . . . . 2.69 111.076 165.73 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.97 -52.68 3.36 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 126.72 2.008 . . . . 5.15 109.678 -170.404 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.9 tttm -69.58 62.49 0.17 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.908 1.683 . . . . 4.62 106.962 163.541 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -40.57 90.37 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 121.493 -0.755 . . . . 7.72 110.748 -167.701 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.9 tptp -170.57 -38.01 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 127.686 2.394 . . . . 9.35 107.622 166.07 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.0 t70 37.75 83.9 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.624 2.37 . . . . 6.64 113.548 -176.568 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.1 tp -172.18 -57.55 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 103.792 -2.67 . . . . 9.88 103.792 173.579 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -86.08 -169.33 2.59 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 108.06 -1.089 . . . . 11.84 108.06 160.502 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.7 pp -71.93 -170.69 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 C-N-CA 125.327 1.451 . . . . 10.5 112.478 -175.61 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 4.8 mmm180 67.44 104.75 0.05 OUTLIER 'General case' 0 C--N 1.342 0.282 0 C-N-CA 126.494 1.918 . . . . 14.93 107.913 -154.542 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.1 mttm -176.83 90.46 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 130.045 3.338 . . . . 12.48 104.686 -161.898 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.255 1.354 0 N-CA-C 100.996 -3.705 . . . . 10.48 100.996 -115.565 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 114.888 -2.482 . . . . 6.43 106.28 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 136.02 163.13 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 127.67 2.388 . . . . 5.95 110.918 -177.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 90.06 90.83 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 126.264 1.826 . . . . 5.35 114.404 153.417 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -128.45 146.77 61.2 Favored Pre-proline 0 CA--C 1.537 0.456 0 N-CA-C 104.116 -2.55 . . . . 6.13 104.116 149.636 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -82.21 142.57 12.17 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 C-N-CA 123.821 3.014 . . . . 4.24 108.414 167.084 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 25.6 mt -144.5 -123.63 0.08 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.597 0.759 . . . . 4.84 111.234 -158.884 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 9.3 t -95.78 163.75 13.04 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 125.173 1.389 . . . . 2.3 110.457 -176.016 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -48.07 -55.73 9.49 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.568 1.147 . . . . 2.16 112.471 -171.701 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 11.4 mt -58.53 -38.23 77.32 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.419 -0.355 . . . . 1.96 111.358 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -59.92 -60.18 4.24 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 119.056 -0.497 . . . . 5.71 110.474 169.169 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -45.23 -42.16 9.11 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 119.752 1.16 . . . . 4.26 110.645 -176.75 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 22.3 p -64.01 -31.64 72.89 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.12 1.526 . . . . 2.25 115.12 177.082 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 12.6 pt -76.04 -41.28 38.2 Favored 'Isoleucine or valine' 0 C--N 1.344 0.366 0 CA-C-N 121.95 2.159 . . . . 2.57 109.955 164.107 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -47.11 -56.11 7.16 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 121.045 1.748 . . . . 2.88 109.981 -174.004 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 15.3 t -48.22 -43.37 32.06 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.485 1.136 . . . . 1.88 111.733 178.234 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . 0.412 HG13 ' CE2' ' B' ' 20' ' ' PHE . 0.5 OUTLIER -72.99 -38.31 55.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 C-N-CA 124.271 1.028 . . . . 3.03 110.126 -177.923 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 69.2 t -61.92 -50.61 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 123.831 0.852 . . . . 2.37 109.303 175.455 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.1 t -61.59 -43.67 98.43 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.839 0.745 . . . . 2.5 110.665 178.486 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 98.7 m -47.95 -58.16 4.77 Favored 'General case' 0 C--N 1.346 0.449 0 CA-C-N 118.595 0.634 . . . . 1.99 109.482 170.354 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . 0.412 ' CE2' HG13 ' B' ' 16' ' ' VAL . 16.8 m-30 -55.02 -44.64 74.79 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 112.786 0.662 . . . . 8.04 112.786 178.514 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -60.26 -53.54 56.4 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 119.716 1.144 . . . . 6.03 110.12 -176.815 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 6.7 t -65.87 -40.74 91.92 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 119.52 -0.872 . . . . 4.13 110.08 -179.439 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -62.8 -61.73 2.21 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 121.517 -0.74 . . . . 6.72 111.55 -179.754 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.14 -19.72 65.48 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 125.808 1.643 . . . . 2.29 111.951 -172.409 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.07 -26.86 11.99 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 118.431 -0.795 . . . . 5.06 111.167 169.192 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -39.28 -69.05 0.14 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 115.994 1.85 . . . . 2.22 115.994 -156.742 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -92.14 -77.7 0.43 Allowed 'General case' 0 C--N 1.341 0.206 0 C-N-CA 118.889 -1.125 . . . . 2.85 112.688 -171.289 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.04 161.16 25.39 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 127.929 2.68 . . . . 2.32 110.614 152.959 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.0 ttm180 55.96 102.34 0.01 OUTLIER 'General case' 0 C--O 1.24 0.601 0 N-CA-C 115.116 1.525 . . . . 4.98 115.116 135.719 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.47 6.6 5.49 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 115.135 1.531 . . . . 7.45 115.135 -174.256 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -123.77 11.44 9.07 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.231 0.923 . . . . 4.08 110.961 178.957 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 29.0 p -142.57 142.4 32.17 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 109.321 -0.622 . . . . 1.8 109.321 172.87 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -101.29 154.18 19.0 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.303 -0.999 . . . . 3.24 108.303 167.361 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 68.6 m -136.46 168.72 18.93 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 107.003 -1.48 . . . . 2.81 107.003 173.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 10.8 p -84.04 53.9 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 121.725 0.774 . . . . 3.37 111.202 -172.454 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 38.2 t30 -157.21 51.08 0.47 Allowed 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 105.881 -1.896 . . . . 3.53 105.881 150.038 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -168.41 -62.41 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 104.583 -2.377 . . . . 2.08 104.583 -166.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -48.61 -49.19 38.0 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.689 0.796 . . . . 4.08 111.036 178.32 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 31.3 tttt -57.44 -29.27 64.05 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.081 0.552 . . . . 3.42 111.586 -177.992 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -70.17 -25.6 63.52 Favored 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 121.535 -0.728 . . . . 4.59 110.587 -174.696 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 14.8 tp -70.16 -43.2 71.34 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 119.015 0.825 . . . . 2.9 109.716 178.016 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 6.0 m -69.89 -41.27 79.57 Favored 'Isoleucine or valine' 0 C--N 1.339 0.147 0 N-CA-C 109.099 -0.704 . . . . 1.78 109.099 -178.501 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 87.6 m -67.42 -60.78 2.3 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 116.029 -0.532 . . . . 1.97 111.071 -178.782 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -82.82 -62.81 1.5 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.839 0.456 . . . . 2.11 111.897 -170.821 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -70.61 -48.2 56.32 Favored 'General case' 0 CA--C 1.528 0.096 0 O-C-N 122.16 -0.338 . . . . 4.88 111.782 -169.651 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 tp -71.58 -19.89 0.44 Allowed Pre-proline 0 CA--C 1.536 0.429 0 N-CA-C 114.666 1.358 . . . . 2.94 114.666 -161.627 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -34.42 -65.92 0.11 Allowed 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 121.895 1.73 . . . . 2.4 114.806 -110.593 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -73.65 -59.6 2.64 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 113.358 0.873 . . . . 3.45 113.358 -158.544 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 29.5 tp 0.53 -85.04 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 127.949 2.499 . . . . 1.98 115.613 176.238 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -125.88 64.52 1.21 Allowed 'General case' 0 CA--C 1.522 -0.122 0 N-CA-C 108.05 -1.092 . . . . 3.87 108.05 166.82 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.28 123.31 7.22 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.573 -0.899 . . . . 7.43 108.573 166.995 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -165.96 51.43 0.09 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 105.999 -1.852 . . . . 5.13 105.999 -169.02 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 34.4 m -88.5 -12.25 10.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 113.698 -1.592 . . . . 2.96 111.102 -173.679 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -71.42 -77.19 0.53 Allowed Glycine 0 C--N 1.338 0.669 0 N-CA-C 107.416 -2.274 . . . . 3.29 107.416 165.654 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.1 43.72 0.37 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.863 1.665 . . . . 3.88 112.65 -177.765 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -67.82 -28.48 67.61 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 108.549 -0.908 . . . . 2.43 108.549 169.18 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.9 -53.17 61.42 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.097 0.862 . . . . 4.48 110.044 173.521 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -47.22 -56.06 7.41 Favored 'General case' 0 C--N 1.342 0.259 0 C-N-CA 124.003 0.921 . . . . 2.48 109.508 173.002 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -56.61 -61.46 2.4 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 120.812 -0.355 . . . . 5.58 110.193 -176.999 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -45.03 -55.25 5.74 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 125.242 1.417 . . . . 2.4 110.271 179.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -60.98 -41.1 95.79 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 125.168 1.387 . . . . 4.55 110.528 -177.178 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 50.5 m -64.96 -31.7 73.07 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.017 0.527 . . . . 2.57 111.82 175.43 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 mp -74.42 -52.83 10.94 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.809 0.731 . . . . 2.89 111.133 173.357 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.256 19.8 t0 -57.88 -8.62 1.02 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.969 2.907 . . . . 1.66 117.635 -164.451 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 8.8 m -33.6 -18.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.472 1 C-N-CA 132.776 4.431 . . . . 2.52 119.344 -139.8 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.6 -37.75 58.74 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 120.145 1.339 . . . . 3.48 109.616 158.114 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 67.44 68.12 0.38 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 126.744 2.018 . . . . 3.93 108.95 -171.87 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 28.4 p30 -128.03 -10.47 5.38 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.373 1.869 . . . . 1.97 113.494 -172.652 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 17.9 m 72.14 4.04 4.88 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.311 1.444 . . . . 2.53 114.589 -178.578 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . 0.419 ' OE1' ' NZ ' ' B' ' 72' ' ' LYS . 1.8 mt-10 -99.12 103.35 15.25 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 106.321 -1.733 . . . . 3.79 106.321 156.245 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.26 94.43 1.19 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 104.331 -2.47 . . . . 2.37 104.331 158.975 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . 0.419 ' NZ ' ' OE1' ' B' ' 70' ' ' GLU . 20.6 ttmm -81.78 172.48 13.31 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.973 0.909 . . . . 4.04 110.429 -170.272 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -87.83 56.06 3.73 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.0 -1.063 . . . . 5.87 111.257 177.178 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . 0.572 ' HB2' ' CE ' ' A' ' 85' ' ' LYS . 0.5 OUTLIER -161.35 55.72 0.28 Allowed 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 107.32 -1.363 . . . . 3.08 107.32 100.263 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -90.9 -60.97 1.77 Allowed 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 124.741 1.216 . . . . 2.09 108.808 139.562 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -56.77 -37.05 70.55 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 124.09 0.956 . . . . 6.39 112.177 -161.95 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.566 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 1.6 t-105 -45.46 -39.74 7.52 Favored 'General case' 0 C--O 1.219 -0.512 0 O-C-N 123.565 0.541 . . . . 6.43 109.987 175.727 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -39.62 -48.46 2.1 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 120.965 -1.084 . . . . 5.19 112.038 -169.105 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 13.1 tp -49.53 -46.71 48.88 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.421 0.688 . . . . 2.15 111.244 177.445 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 8.5 mm -58.37 -42.25 83.5 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.103 0 C-N-CA 127.284 2.233 . . . . 4.04 108.169 -178.824 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -64.5 -51.18 54.5 Favored Glycine 0 N--CA 1.441 -1.019 0 N-CA-C 109.971 -1.252 . . . . 1.8 109.971 178.166 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -50.89 -47.47 60.59 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 118.235 -0.888 . . . . 2.17 110.712 178.166 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 22.1 mt -39.14 -54.5 1.75 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.598 1.09 . . . . 2.91 113.214 -178.25 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.78 -26.25 68.62 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.917 1.287 . . . . 2.32 112.143 -176.55 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -80.72 -53.42 6.53 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.131 0.973 . . . . 2.82 109.526 171.648 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 4.2 mm-40 -57.6 -40.42 79.03 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.993 0.917 . . . . 2.55 111.718 -171.113 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 10.8 tt -50.01 -36.68 12.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 118.568 0.622 . . . . 1.9 111.885 174.758 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -49.11 11.23 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.518 0.727 . . . . 6.16 109.726 174.774 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 32.2 mttm -106.38 116.35 31.77 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.886 1.674 . . . . 5.96 112.144 -166.16 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -38.39 -13.37 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 130.291 3.436 . . . . 7.18 119.157 174.14 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 7.4 tppt? 114.16 26.99 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.67 1 C-N-CA 132.064 4.145 . . . . 9.94 107.514 -158.226 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -82.05 64.15 6.6 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.644 1.578 . . . . 3.95 109.598 -176.672 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -137.48 -116.75 0.16 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.956 0.902 . . . . 5.52 110.939 -179.969 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt 59.48 -164.95 0.2 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.952 1.301 . . . . 8.67 110.261 -168.494 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . 0.254 0.2 OUTLIER 36.93 90.59 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 127.734 2.414 . . . . 8.88 115.04 -179.929 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.8 107.96 3.75 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 120.946 -1.097 . . . . 11.95 109.471 166.381 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 56.7 tttp -175.71 137.26 0.34 Allowed 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 104.794 -2.298 . . . . 7.29 104.794 -169.375 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.232 0 N-CA-C 105.97 -1.863 . . . . 11.22 105.97 -155.18 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.2 mtt . . . . . 0 N--CA 1.472 0.64 0 N-CA-C 105.854 -1.906 . . . . 7.33 105.854 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.06 176.49 1.25 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-N 118.9 0.773 . . . . 3.71 110.174 162.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.84 98.73 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 128.963 2.905 . . . . 3.91 109.171 -171.849 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -96.04 115.57 65.65 Favored Pre-proline 0 N--CA 1.451 -0.391 0 C-N-CA 124.996 1.318 . . . . 4.82 109.093 -174.234 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -70.54 146.94 56.72 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 121.859 1.706 . . . . 3.28 108.385 175.373 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 51.9 mt -101.15 173.14 6.6 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.256 -1.016 . . . . 2.73 108.256 -176.178 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.9 t -71.14 161.47 31.05 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 120.573 -1.329 . . . . 3.29 110.001 178.548 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -48.34 -43.77 33.72 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 124.072 0.949 . . . . 2.73 111.382 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.6 mp -63.29 -54.46 36.84 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 109.308 -0.627 . . . . 3.23 109.308 -177.265 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -49.64 -57.71 6.67 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.586 1.554 . . . . 2.7 110.898 174.975 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -49.93 -51.13 43.36 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.889 0.876 . . . . 3.59 109.94 177.966 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.8 p -64.3 -47.86 77.86 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.543 -0.723 . . . . 2.12 112.21 -178.124 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.276 2.6 pp -63.13 -31.57 53.15 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 O-C-N 121.131 -0.981 . . . . 1.79 110.283 -179.577 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -65.73 -57.07 8.89 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 120.026 -0.669 . . . . 3.14 109.404 169.281 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -48.38 -43.52 33.92 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.983 0.81 . . . . 2.65 111.616 -171.764 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.4 m -69.75 -39.39 77.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 121.402 -0.811 . . . . 1.95 111.568 177.413 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.8 t -63.73 -48.17 87.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.729 0.812 . . . . 2.02 110.572 177.614 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.7 t -60.89 -44.04 97.66 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 120.981 -1.075 . . . . 1.95 110.741 174.398 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 61.1 m -57.34 -45.08 84.68 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.327 0.967 . . . . 1.93 110.264 176.433 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -53.33 -60.07 3.76 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.178 0.591 . . . . 4.49 110.235 172.4 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -58.76 -48.0 82.74 Favored 'General case' 0 C--O 1.232 0.169 0 O-C-N 121.693 -0.63 . . . . 5.43 112.185 -174.125 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -63.47 -23.11 67.26 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 118.639 -0.696 . . . . 2.65 111.243 -178.186 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -80.05 -42.03 24.54 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 118.462 0.574 . . . . 4.27 111.185 167.78 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.93 -32.19 65.72 Favored 'General case' 0 C--O 1.238 0.474 0 O-C-N 120.68 -1.263 . . . . 2.39 112.579 -175.539 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.255 0.0 OUTLIER -77.14 -15.17 59.64 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.804 1.641 . . . . 4.28 113.971 179.546 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.04 -65.08 0.4 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.457 1.026 . . . . 2.42 112.03 177.248 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -141.21 -175.31 4.29 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 125.72 1.608 . . . . 5.46 109.226 -170.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 25.12 92.76 0.01 OUTLIER Glycine 0 C--N 1.341 0.858 0 C-N-CA 127.197 2.332 . . . . 2.92 113.179 157.841 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 62.44 102.01 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.55 1.14 . . . . 6.07 110.35 178.854 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.9 pttt -79.03 50.99 1.09 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.115 1.366 . . . . 7.46 112.074 -166.404 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -172.01 -55.15 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 107.815 -1.18 . . . . 5.6 107.815 -156.839 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.7 p -84.74 153.81 22.81 Favored 'General case' 0 C--O 1.244 0.799 0 C-N-CA 124.058 0.943 . . . . 2.85 110.886 170.486 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -94.67 119.08 32.74 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.094 -1.076 . . . . 3.11 108.094 172.843 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.4 m -82.41 166.28 19.54 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.345 -0.983 . . . . 3.26 108.345 171.778 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.0 t -60.99 -57.96 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 O-C-N 121.139 -0.976 . . . . 3.49 111.275 -171.558 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -61.33 -43.25 99.19 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.096 0.474 . . . . 4.69 110.888 -179.665 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -50.83 -50.6 56.22 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.668 1.187 . . . . 2.8 110.324 176.188 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -62.94 -44.11 96.97 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.829 -0.544 . . . . 4.91 110.933 173.71 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -49.22 -38.81 27.58 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.641 -0.695 . . . . 4.71 111.234 -178.292 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -46.06 -48.76 16.9 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 118.807 0.731 . . . . 2.87 112.085 172.754 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -59.32 -51.37 70.23 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 108.949 -0.76 . . . . 3.38 108.949 -173.167 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.99 -33.66 48.18 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 CA-C-N 115.87 -0.605 . . . . 2.56 110.012 -173.769 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 91.1 m -69.33 -32.77 72.09 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.896 0.878 . . . . 2.07 111.124 174.012 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -81.16 -58.84 2.88 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 125.002 1.321 . . . . 3.33 109.878 -174.392 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -99.95 -135.26 0.29 Allowed 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 108.898 -0.779 . . . . 3.85 108.898 176.322 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.8 mm? 29.98 51.75 0.46 Allowed Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 127.309 2.244 . . . . 3.24 113.949 -170.688 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -66.95 -40.08 12.74 Favored 'Trans proline' 0 N--CA 1.448 -1.201 0 C-N-CA 121.97 1.78 . . . . 1.73 111.175 178.424 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 20.6 t-160 -116.71 -28.05 6.48 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-O 119.216 -0.421 . . . . 5.24 111.636 -165.166 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 tp -64.53 -74.75 0.1 Allowed 'General case' 0 C--O 1.232 0.174 0 CA-C-N 119.481 1.037 . . . . 2.29 110.832 179.903 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 85.2 mt -119.54 83.63 2.07 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.338 1.455 . . . . 2.87 107.362 -174.406 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -178.34 0.31 Allowed 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 114.976 -1.011 . . . . 6.39 109.433 167.626 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 80.97 44.2 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 125.192 1.397 . . . . 4.0 110.053 -179.8 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -59.99 -21.5 22.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 C-N-CA 124.833 1.253 . . . . 4.42 111.188 175.873 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -56.18 -53.97 38.92 Favored Glycine 0 CA--C 1.528 0.899 0 N-CA-C 110.736 -0.945 . . . . 1.78 110.736 169.439 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 56.0 p -80.14 40.71 0.49 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.062 0.931 . . . . 3.68 111.726 -172.132 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -57.21 -36.92 71.46 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 120.811 -1.181 . . . . 2.57 110.501 -172.373 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.09 -34.95 58.9 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.689 0.996 . . . . 4.57 113.689 177.459 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -57.99 -51.97 67.45 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.571 0.701 . . . . 3.15 109.219 174.313 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.75 -51.07 70.89 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.574 -1.269 . . . . 4.66 107.574 -178.694 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -46.35 -60.88 2.06 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 123.922 0.889 . . . . 2.36 109.988 176.93 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -67.32 -28.34 67.91 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.055 0.843 . . . . 4.97 112.396 -176.645 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 49.5 m -61.74 -32.04 72.26 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.647 0.658 . . . . 3.02 111.804 169.543 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 12.1 mt -91.24 -64.38 1.13 Allowed 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 124.714 1.206 . . . . 2.45 111.305 -175.52 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -74.48 71.61 1.83 Allowed 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.242 1.417 . . . . 2.15 109.96 -173.803 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -33.1 8.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 124.934 1.294 . . . . 4.58 112.766 -177.507 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -85.14 -10.2 57.0 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.214 1.006 . . . . 2.54 113.095 -179.203 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.86 39.85 26.67 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.862 1.265 . . . . 6.42 110.693 179.372 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 31.0 p30 -88.62 -14.53 37.27 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.006 0.922 . . . . 2.16 109.92 174.993 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.2 m 69.34 15.75 8.43 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.942 1.297 . . . . 1.96 112.974 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -121.66 105.61 10.58 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.609 1.563 . . . . 3.96 107.474 167.24 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.14 109.32 16.34 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 105.976 -1.861 . . . . 2.07 105.976 -175.154 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -85.06 148.54 26.1 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.435 1.094 . . . . 4.27 108.149 177.048 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -39.69 -56.37 1.72 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.012 1.325 . . . . 6.56 114.159 -173.44 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -68.06 -29.08 67.96 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.451 -0.781 . . . . 2.63 112.173 -178.609 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -66.13 -51.36 58.69 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 107.975 -1.12 . . . . 2.19 107.975 173.104 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.98 -44.44 64.02 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.315 1.046 . . . . 6.83 110.395 177.948 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.679 ' CZ2' ' CE2' ' B' ' 77' ' ' TRP . 23.5 t90 -40.63 -38.71 0.92 Allowed 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 117.705 -1.14 . . . . 6.32 113.061 -171.615 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 15.3 ttt180 -39.24 -49.49 1.9 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.61 1.096 . . . . 7.18 111.012 175.805 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 9.6 tp -46.97 -46.47 21.6 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 123.368 0.667 . . . . 1.91 110.27 -177.751 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 53.2 mt -66.31 -33.0 60.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 121.829 0.823 . . . . 2.84 109.319 -174.066 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.551 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -63.6 -48.87 73.65 Favored Glycine 0 CA--C 1.492 -1.373 0 C-N-CA 126.888 2.185 . . . . 1.66 110.073 176.728 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -69.89 -53.07 19.67 Favored 'General case' 0 N--CA 1.433 -1.298 0 N-CA-C 106.002 -1.851 . . . . 2.42 106.002 -173.976 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mt -40.13 -59.39 1.26 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.913 1.285 . . . . 3.61 111.375 168.835 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.72 -41.35 77.3 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.43 0.692 . . . . 2.23 110.943 -179.485 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.92 -52.19 66.79 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 121.896 -0.503 . . . . 3.22 110.184 174.091 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -52.42 -46.31 66.3 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.409 1.883 . . . . 2.31 110.288 -168.143 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.8 tt -53.77 -29.99 18.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 N-CA-C 112.52 0.563 . . . . 2.03 112.52 178.246 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -88.68 -45.48 9.79 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.109 0.964 . . . . 7.18 111.25 174.15 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.3 tttt -80.98 -32.38 34.36 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 128.233 2.613 . . . . 4.39 114.299 -165.124 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 27.2 mttm -31.86 -62.69 0.2 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 120.425 1.466 . . . . 7.87 114.699 -117.086 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.4 ttmt -146.66 60.94 1.21 Allowed 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.525 -1.287 . . . . 9.5 107.525 175.634 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.61 95.41 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.373 1.469 . . . . 6.65 109.595 172.954 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.0 tp -173.47 -58.29 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 104.919 -2.252 . . . . 8.93 104.919 -168.346 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -73.01 171.77 12.24 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 108.773 -0.825 . . . . 11.03 108.773 161.95 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.6 tt -57.26 143.93 10.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 122.964 0.506 . . . . 12.22 110.454 179.495 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -78.02 151.69 33.42 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.044 0.537 . . . . 15.15 109.558 -174.084 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -177.57 -27.01 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.296 1.438 . . . . 11.14 111.08 -170.924 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.446 ' NZ ' ' OE2' ' B' ' 4' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.954 0 C-N-CA 126.754 2.022 . . . . 10.21 110.531 -176.787 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 52.7 mmm . . . . . 0 N--CA 1.477 0.908 0 CA-C-O 118.511 -0.757 . . . . 7.89 111.51 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -176.58 166.2 2.66 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-N 119.576 1.08 . . . . 8.04 108.831 176.579 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 65.92 89.54 0.1 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.043 1.737 . . . . 7.28 115.593 155.476 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . 0.446 ' OE2' ' NZ ' ' A' ' 98' ' ' LYS . 54.0 mt-10 -138.43 151.18 68.7 Favored Pre-proline 0 CA--C 1.537 0.464 0 N-CA-C 105.432 -2.062 . . . . 5.29 105.432 148.568 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -76.91 147.08 26.7 Favored 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 123.452 2.768 . . . . 4.18 110.709 -179.655 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.3 mt -144.47 -159.12 0.95 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.346 1.858 . . . . 4.06 109.821 -166.227 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 4.0 t -69.13 -70.56 0.27 Allowed 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 115.221 1.563 . . . . 2.36 115.221 -165.766 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -171.93 -73.45 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.411 1.484 . . . . 2.39 108.334 -168.094 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 17.4 mt -56.47 -41.24 76.23 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.574 -1.328 . . . . 1.99 110.064 167.798 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 78.4 mt-10 -54.59 -41.8 70.33 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.52 0.728 . . . . 3.51 111.319 171.964 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -63.42 -43.54 97.2 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 120.891 -1.131 . . . . 4.31 110.43 173.974 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.2 t -59.58 -45.42 91.92 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.305 0.642 . . . . 3.09 110.624 -178.259 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.8 pp -66.46 -38.0 80.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 118.151 0.432 . . . . 2.11 110.4 172.869 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -56.09 -60.34 3.63 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-O 117.894 -1.051 . . . . 2.73 109.764 178.929 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.1 t -56.93 -28.82 62.51 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 120.182 1.355 . . . . 2.17 113.455 -170.516 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 27.2 m -81.05 -44.66 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 O-C-N 121.426 -0.797 . . . . 1.85 109.626 -178.669 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 85.9 t -54.38 -35.46 30.95 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.407 0 N-CA-C 108.405 -0.961 . . . . 2.14 108.405 165.748 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . 2.238 1.5 t -54.59 -63.76 1.05 Allowed 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 126.543 1.937 . . . . 4.4 110.834 -178.72 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 49.8 m -51.32 -59.66 3.98 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 110.805 -2.907 . . . . 2.08 110.166 176.598 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -58.91 -54.55 45.81 Favored 'General case' 0 C--O 1.223 -0.331 0 O-C-N 122.108 -0.37 . . . . 8.48 110.815 -178.946 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -57.72 -45.76 85.32 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.895 1.278 . . . . 4.34 111.768 -176.52 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 2.7 t -65.72 -52.9 47.54 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.082 -0.71 . . . . 4.1 109.082 177.158 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -55.5 -38.95 69.84 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.696 0.76 . . . . 4.96 111.046 -179.031 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.93 -24.2 36.43 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.153 2.181 . . . . 1.72 110.6 -179.42 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -19.24 34.67 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 117.844 -1.074 . . . . 4.92 111.841 175.783 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -50.57 -67.52 0.25 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.881 1.067 . . . . 2.61 113.881 -160.96 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 68.4 mt-10 -90.14 -44.48 9.75 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 125.931 1.692 . . . . 3.72 111.977 -179.091 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.5 -143.48 1.12 Allowed Glycine 0 CA--C 1.536 1.36 0 CA-C-N 115.269 -0.878 . . . . 3.75 113.546 -166.052 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 16.2 mtt-85 50.35 99.45 0.01 OUTLIER 'General case' 0 C--O 1.237 0.404 1 C-N-CA 131.755 4.022 . . . . 4.3 112.464 27.349 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 10.4 ptpp? -66.42 -177.72 0.59 Allowed 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 119.092 -1.043 . . . . 4.96 109.195 148.946 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 9.1 t70 78.31 -59.83 0.42 Allowed 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 127.593 2.357 . . . . 4.15 109.846 179.809 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 25.8 p -88.12 134.66 33.71 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.471 0.653 . . . . 1.98 110.201 175.857 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.14 141.89 32.71 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 106.84 -1.541 . . . . 3.09 106.84 167.056 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 4.5 t -92.79 -172.32 2.99 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 125.086 1.354 . . . . 2.44 109.998 165.771 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . 0.453 ' C ' ' H ' ' B' ' 37' ' ' GLU . 70.9 t -67.53 -112.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.431 2 N-CA-C 99.47 -4.27 . . . . 4.69 99.47 -179.354 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.75 53.78 0.75 Allowed 'General case' 0 CA--C 1.556 1.202 0 CA-C-N 123.505 2.866 . . . . 2.9 112.136 -172.171 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . 0.453 ' H ' ' C ' ' B' ' 35' ' ' VAL . 3.3 tt0 -105.4 -58.0 1.96 Allowed 'General case' 0 N--CA 1.448 -0.552 1 C-N-CA 132.292 4.237 . . . . 1.67 104.099 150.38 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -57.68 -40.16 78.8 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.716 0.806 . . . . 3.36 110.161 -178.767 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.7 ttpm? -58.02 -37.06 73.6 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 119.126 -1.03 . . . . 5.4 109.981 179.647 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -73.83 -25.58 60.16 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 116.413 -0.358 . . . . 4.9 110.687 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 tt -67.57 -48.76 65.98 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.484 -0.932 . . . . 3.62 108.484 172.558 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 2.1 m -65.24 -51.09 69.51 Favored 'Isoleucine or valine' 0 C--N 1.34 0.166 0 N-CA-C 109.344 -0.613 . . . . 2.16 109.344 -177.858 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 94.6 m -51.31 -56.6 12.18 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.722 0.809 . . . . 2.05 111.576 176.557 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -80.87 -54.37 5.65 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.757 0.28 . . . . 2.13 111.757 -169.612 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 26.5 mm100 -80.11 -40.23 27.92 Favored 'General case' 0 C--O 1.227 -0.131 0 N-CA-C 113.573 0.953 . . . . 3.58 113.573 -164.64 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.62 -41.89 92.01 Favored Pre-proline 0 N--CA 1.467 0.393 0 CA-C-N 118.937 0.79 . . . . 2.86 112.47 -168.237 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -70.61 -54.4 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.926 0 N-CA-C 107.631 -1.719 . . . . 3.41 107.631 -41.91 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 50.7 t60 -66.44 -43.62 85.11 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.786 1.234 . . . . 4.65 112.046 -175.311 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 27.0 tp -33.85 -62.96 0.28 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.123 1.769 . . . . 1.98 113.257 -168.635 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 35.2 mt -81.34 97.59 7.77 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 107.76 -1.2 . . . . 2.34 107.76 167.152 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -49.44 145.07 5.02 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.081 -0.711 . . . . 6.89 109.081 171.065 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 40.7 t0 63.38 60.19 1.17 Allowed 'General case' 0 C--N 1.339 0.134 0 CA-C-O 123.987 1.851 . . . . 4.31 109.191 171.29 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 33.7 m -56.07 -21.27 11.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 112.36 -2.2 . . . . 3.36 111.245 164.142 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -64.34 -60.52 7.0 Favored Glycine 0 C--N 1.341 0.82 0 C-N-CA 124.455 1.026 . . . . 3.42 111.378 178.367 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.2 t -77.21 66.68 3.04 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 122.396 1.094 . . . . 3.18 109.675 -175.846 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.09 -34.88 71.56 Favored 'General case' 0 N--CA 1.44 -0.926 0 C-N-CA 125.274 1.43 . . . . 2.29 109.917 -174.162 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -18.08 -70.35 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 127.128 2.171 . . . . 4.19 115.508 167.194 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -38.77 78.67 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.705 1.139 . . . . 3.63 111.635 -175.676 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.98 -60.08 4.35 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.203 -1.036 . . . . 4.6 108.203 172.734 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -46.16 -51.43 14.11 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-N 118.962 0.801 . . . . 3.15 110.982 -178.36 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -63.0 -42.21 99.79 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.74 -0.6 . . . . 4.38 111.954 178.827 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 24.8 t -61.16 -39.67 90.97 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.7 0.682 . . . . 3.16 111.828 174.763 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 34.4 mt -80.83 -61.19 2.04 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.478 1.111 . . . . 2.59 110.669 -171.822 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -71.11 -10.12 59.22 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 128.888 2.875 . . . . 2.94 115.101 -162.636 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -37.72 -19.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 C-N-CA 131.143 3.777 . . . . 5.41 117.441 -160.698 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -61.12 -19.42 61.48 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 120.192 1.36 . . . . 3.51 111.747 171.845 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 101.16 -25.3 0.02 OUTLIER 'General case' 0 C--N 1.343 0.309 0 C-N-CA 127.605 2.362 . . . . 4.52 111.32 166.982 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -61.62 139.32 58.29 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 118.457 -1.297 . . . . 2.99 107.546 164.848 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 1.7 p -78.33 12.9 1.71 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 127.929 2.492 . . . . 3.73 112.987 -179.576 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -87.63 116.76 25.98 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 104.389 -2.449 . . . . 3.26 104.389 162.839 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.05 90.59 0.09 Allowed 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 104.924 -2.25 . . . . 2.82 104.924 157.463 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 36.6 tptt -80.02 168.45 19.17 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.331 -0.989 . . . . 5.85 108.331 -165.564 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -91.61 61.02 4.17 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.22 -0.659 . . . . 6.16 109.22 175.627 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -154.89 50.94 0.6 Allowed 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 119.096 -1.042 . . . . 4.2 112.661 87.203 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -86.42 -55.92 3.67 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.691 1.597 . . . . 2.2 108.288 153.798 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -50.62 -39.95 51.59 Favored 'General case' 0 C--N 1.344 0.354 0 C-N-CA 123.021 0.528 . . . . 6.91 110.427 -174.377 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.679 ' CE2' ' CZ2' ' A' ' 77' ' ' TRP . 27.8 t90 -47.44 -38.49 13.62 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 123.651 0.781 . . . . 5.37 111.206 -179.808 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 54.5 mtp85 -43.05 -38.79 2.45 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.681 1.193 . . . . 5.09 111.716 177.079 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 13.7 tp -51.62 -47.45 63.66 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 117.915 0.325 . . . . 1.83 111.05 177.686 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 65.3 mt -65.74 -26.04 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 109.133 -0.691 . . . . 2.92 109.133 -176.252 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.574 ' N ' ' CZ2' ' A' ' 77' ' ' TRP . . . -67.15 -51.64 37.43 Favored Glycine 0 CA--C 1.501 -0.829 0 C-N-CA 126.907 2.194 . . . . 2.03 108.112 176.104 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -51.99 -60.95 2.59 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.168 -1.049 . . . . 4.39 108.168 169.411 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.4 mt -48.09 -51.96 22.33 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 120.526 1.512 . . . . 3.71 113.121 -175.701 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.0 -33.93 62.99 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.26 1.024 . . . . 2.91 110.548 178.647 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.89 -56.39 5.8 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 117.284 -1.341 . . . . 3.21 111.423 165.538 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -52.73 -36.15 57.17 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 120.295 1.407 . . . . 2.54 112.894 -164.092 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 3.0 tt -55.61 -38.2 49.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 O-C-N 121.598 -0.689 . . . . 2.25 111.446 175.222 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -84.06 -61.66 1.76 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.248 1.419 . . . . 7.93 113.463 169.949 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 10.8 pttp -83.09 147.97 27.79 Favored 'General case' 0 C--O 1.223 -0.302 0 O-C-N 120.804 -1.185 . . . . 7.21 111.83 -169.555 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 47.9 tttt -81.12 -60.28 2.35 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 109.225 -0.657 . . . . 6.44 109.225 164.874 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 37.6 tptt -144.24 21.07 1.73 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.143 0.977 . . . . 8.65 109.718 166.627 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 18.2 t70 33.85 -122.49 0.09 Allowed 'General case' 0 C--N 1.346 0.43 0 C-N-CA 126.223 1.809 . . . . 4.89 109.329 -167.783 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 33.2 tp -110.11 134.86 51.75 Favored 'General case' 0 N--CA 1.434 -1.237 0 N-CA-C 105.189 -2.152 . . . . 10.18 105.189 154.314 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -31.52 131.66 0.11 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.733 1.213 . . . . 8.1 112.382 163.445 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 42.5 pt -103.05 150.13 6.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 C-N-CA 124.227 1.011 . . . . 8.38 109.77 -179.83 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.41 -179.01 3.76 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 125.992 1.717 . . . . 6.8 106.958 170.008 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 6.8 ttmt -175.9 137.25 0.33 Allowed 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 106.29 -1.745 . . . . 8.32 106.29 178.381 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.333 0 N-CA-C 104.903 -2.258 . . . . 7.6 104.903 165.962 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.2 mtt . . . . . 0 N--CA 1.475 0.819 0 N-CA-C 104.905 -2.258 . . . . 7.27 104.905 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -63.66 178.04 0.64 Allowed 'General case' 0 C--O 1.238 0.481 0 N-CA-C 108.566 -0.902 . . . . 3.61 108.566 135.048 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 73.15 87.77 0.1 Allowed 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.932 1.693 . . . . 4.28 109.429 -170.867 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -74.61 123.16 88.88 Favored Pre-proline 0 N--CA 1.444 -0.728 0 C-N-CA 125.425 1.49 . . . . 4.44 108.82 -176.523 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -67.53 141.98 57.49 Favored 'Trans proline' 0 N--CA 1.45 -1.079 0 N-CA-C 107.522 -1.761 . . . . 2.67 107.522 171.028 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.6 mt -96.84 173.9 7.07 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 107.4 -1.333 . . . . 2.48 107.4 179.324 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.9 t -72.47 166.63 22.23 Favored 'General case' 0 CA--C 1.529 0.173 0 O-C-N 120.804 -1.185 . . . . 2.11 110.534 -177.824 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -52.8 -57.42 10.23 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.961 0.886 . . . . 2.19 111.39 -169.019 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 mt -66.63 -31.2 71.74 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 117.436 -1.269 . . . . 2.76 112.08 178.679 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 77.6 mt-10 -55.67 -55.97 25.95 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.84 1.654 . . . . 1.95 110.92 168.482 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -48.56 -51.44 27.7 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 122.028 0.918 . . . . 3.39 109.18 174.748 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.2 t -60.01 -53.58 56.15 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.279 -0.873 . . . . 2.76 112.42 -173.787 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.356 0.1 OUTLIER -71.29 -33.24 49.8 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 119.404 1.002 . . . . 2.89 110.415 -178.584 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -53.44 -53.3 53.25 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.081 0.855 . . . . 2.67 109.693 173.293 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.5 t -59.22 -25.38 63.96 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.953 1.094 . . . . 2.6 113.953 -173.686 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.7 m -81.24 -42.22 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 120.286 1.403 . . . . 1.79 110.776 169.498 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.1 t -56.05 -46.05 80.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 123.89 0.876 . . . . 2.2 111.018 179.62 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.3 t -60.65 -47.08 87.82 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.174 0.897 . . . . 1.82 110.632 177.309 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.3 m -58.26 -47.12 84.59 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.358 -0.839 . . . . 2.15 110.073 179.275 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 7.6 t80 -52.34 -56.98 11.27 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.566 1.146 . . . . 4.19 110.696 171.171 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -68.62 -39.56 80.77 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 123.91 0.884 . . . . 3.85 110.928 -166.506 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.3 p -57.92 -60.35 3.85 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.621 -0.881 . . . . 3.47 108.621 169.762 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -49.04 -41.39 34.8 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 118.874 0.761 . . . . 4.41 113.044 -179.75 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.68 -25.75 19.57 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 127.037 2.135 . . . . 2.48 111.711 -174.774 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -34.1 70.73 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.999 1.32 . . . . 4.96 112.367 176.575 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -52.85 -52.03 58.73 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-O 121.642 0.734 . . . . 2.37 112.53 -157.323 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -119.34 165.3 14.48 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 127.839 2.456 . . . . 2.7 105.923 176.033 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 9.19 106.98 0.0 OUTLIER Glycine 0 CA--C 1.536 1.372 0 C-N-CA 126.798 2.142 . . . . 1.79 115.768 165.593 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? 66.38 105.41 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.848 1.259 . . . . 6.71 113.904 165.552 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.3 pttp -65.29 63.99 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.499 0.72 . . . . 4.12 111.245 164.529 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -171.67 -53.59 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 126.9 2.08 . . . . 3.68 106.965 -175.987 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 m -84.4 128.0 34.33 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 124.345 1.058 . . . . 2.91 109.803 174.283 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -82.56 145.88 29.49 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 107.378 -1.342 . . . . 3.42 107.378 172.499 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.3 m -121.02 164.47 16.71 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 125.179 1.392 . . . . 4.29 107.815 -169.183 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.7 p -68.94 -36.16 72.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 O-C-N 120.707 -1.245 . . . . 3.94 112.193 -167.819 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -69.26 -48.84 60.65 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 107.551 -1.277 . . . . 2.31 107.551 179.648 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -44.74 -54.66 6.04 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.911 0.884 . . . . 2.06 111.021 171.396 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -51.22 -57.03 9.89 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.67 -0.695 . . . . 4.08 110.498 177.637 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.0 ttmt -59.52 -42.02 91.28 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.249 0.477 . . . . 4.87 111.874 179.785 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -56.83 -39.7 74.69 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.277 -0.89 . . . . 2.48 110.452 176.946 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -63.41 -47.33 82.41 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 108.024 -1.102 . . . . 3.05 108.024 -174.846 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.53 -54.24 27.76 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 N-CA-C 109.995 -0.372 . . . . 1.92 109.995 -179.103 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 92.3 m -50.0 -48.31 52.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.745 1.218 . . . . 1.97 110.877 -179.717 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -76.74 -45.41 29.31 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.35 0.66 . . . . 3.11 110.862 -174.643 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -135.01 10.67 3.58 Favored 'General case' 0 C--N 1.343 0.311 0 N-CA-C 116.527 2.047 . . . . 3.51 116.527 -161.214 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -120.47 69.89 16.25 Favored Pre-proline 0 N--CA 1.469 0.517 0 CA-C-N 121.133 1.788 . . . . 2.86 109.567 164.1 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.28 -39.86 9.39 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 123.242 2.628 . . . . 1.8 111.391 -178.171 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -97.95 -50.38 4.43 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 118.476 0.58 . . . . 4.89 109.749 -177.442 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . 0.448 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 0.9 OUTLIER -55.47 -64.56 0.81 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 121.361 0.601 . . . . 2.05 111.673 -167.914 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.405 ' C ' ' H ' ' A' ' 52' ' ' ASP . 84.6 mt -116.99 56.52 0.81 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.861 1.265 . . . . 2.97 108.375 -171.326 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.3 31.94 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.262 1.425 . . . . 5.99 112.776 171.394 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . 0.425 ' OD2' ' NZ ' ' A' ' 59' ' ' LYS . 33.5 t70 -110.88 29.45 7.75 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 127.899 2.48 . . . . 4.87 108.174 -175.376 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 27.7 m -56.93 -30.02 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 123.588 0.755 . . . . 3.96 111.758 -173.215 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -56.91 -38.29 83.62 Favored Glycine 0 CA--C 1.532 1.154 0 N-CA-C 111.277 -0.729 . . . . 2.39 111.277 174.058 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.8 m -110.86 46.69 1.04 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.299 1.839 . . . . 2.78 109.054 178.759 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -77.39 -50.54 12.53 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.561 1.144 . . . . 1.98 110.127 171.809 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -64.6 -37.15 86.58 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.426 -0.796 . . . . 5.01 110.694 -162.999 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.59 -40.74 84.04 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.749 0.82 . . . . 4.42 111.664 167.705 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.425 ' NZ ' ' OD2' ' A' ' 52' ' ' ASP . 0.0 OUTLIER -58.97 -49.66 77.02 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 107.524 -1.287 . . . . 3.71 107.524 173.789 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.57 -52.19 31.76 Favored 'General case' 0 C--O 1.226 -0.18 0 N-CA-C 109.183 -0.673 . . . . 2.7 109.183 177.996 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -55.0 -45.37 75.05 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 122.395 0.278 . . . . 4.65 110.651 177.178 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.8 t -60.57 -41.76 95.27 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 122.081 -0.387 . . . . 3.59 111.776 179.717 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.5 mp -70.43 -53.15 17.59 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 118.515 0.598 . . . . 2.88 110.042 177.959 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -73.44 75.5 1.42 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.71 0.804 . . . . 2.0 109.342 179.079 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 25.8 m -50.34 -27.67 4.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 124.211 1.004 . . . . 3.03 112.591 179.322 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -77.42 -30.74 53.6 Favored 'General case' 0 CA--C 1.529 0.16 0 O-C-N 121.933 -0.48 . . . . 3.49 111.505 179.106 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 58.39 52.86 6.79 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.868 1.267 . . . . 5.38 109.534 -163.382 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.6 p30 -108.98 -13.25 14.76 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.676 1.991 . . . . 2.57 112.617 -179.362 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.6 m 74.71 2.99 4.17 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.486 1.914 . . . . 2.79 114.161 -176.136 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -86.0 115.95 23.92 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 105.936 -1.876 . . . . 4.13 105.936 152.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.27 84.28 7.15 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 102.576 -3.12 . . . . 2.31 102.576 154.26 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.36 155.0 15.52 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 107.774 -1.195 . . . . 6.42 107.774 177.727 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -39.83 -54.69 2.09 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.009 0.924 . . . . 6.65 112.337 -175.685 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -65.08 -31.95 73.41 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.692 0.797 . . . . 3.0 113.041 -179.833 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -70.03 -60.95 1.98 Allowed 'General case' 0 C--O 1.233 0.191 0 N-CA-C 108.377 -0.972 . . . . 2.01 108.377 174.712 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -49.64 -44.09 47.32 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 124.864 1.266 . . . . 4.37 111.065 -178.588 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.408 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.6 OUTLIER -40.02 -40.79 1.11 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 116.235 -1.841 . . . . 6.2 110.125 178.977 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.76 -44.33 3.2 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 121.758 2.072 . . . . 7.79 111.85 -178.267 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 12.4 tp -53.3 -49.38 67.11 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.502 1.046 . . . . 2.08 111.371 179.663 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 60.7 mt -73.65 -37.4 49.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 125.536 1.534 . . . . 2.52 108.1 -174.925 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -42.98 -58.32 3.76 Favored Glycine 0 N--CA 1.44 -1.036 0 N-CA-C 109.66 -1.376 . . . . 1.78 109.66 165.165 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 46.3 mm-40 -79.91 -36.05 37.0 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 127.607 2.363 . . . . 2.42 110.153 -160.928 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . 0.448 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 4.9 mp -39.19 -54.93 1.73 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.938 0.895 . . . . 3.36 110.252 170.014 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.13 -24.85 66.58 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.341 1.056 . . . . 1.78 113.449 -178.518 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' A' ' 82' ' ' GLU . 16.7 ttpp -82.76 -50.59 8.52 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.731 1.213 . . . . 2.58 110.737 173.14 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -56.4 -40.18 74.23 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 125.666 1.586 . . . . 2.76 111.852 -174.542 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 10.3 tt -44.68 -29.07 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 N-CA-C 113.291 0.849 . . . . 2.19 113.291 175.376 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -101.76 -63.01 1.19 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.546 0.739 . . . . 5.22 109.785 166.995 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -56.64 -29.84 62.67 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.892 1.071 . . . . 4.2 113.892 -164.356 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.4 tppm? -52.5 -31.73 36.67 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.013 0.824 . . . . 9.6 112.586 -172.004 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.9 mmtt -137.69 -38.52 0.58 Allowed 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 113.436 0.902 . . . . 8.97 113.436 173.096 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 17.4 68.16 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.791 2.036 . . . . 5.88 116.359 -172.277 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -137.58 -46.76 0.55 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.703 0.801 . . . . 9.86 110.613 169.391 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 17.4 mmtp -39.65 -58.76 1.25 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.176 1.391 . . . . 14.82 111.436 178.569 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 5.0 pt -113.36 55.75 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.484 0 CA-C-O 123.592 1.663 . . . . 13.68 108.042 175.229 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . 2.287 0.0 OUTLIER -70.26 57.67 0.17 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 129.716 3.206 . . . . 17.07 114.195 174.777 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -173.24 -50.8 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 114.669 1.359 . . . . 15.42 114.669 -173.295 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.7 mmtp . . . . . 0 C--O 1.253 1.242 0 N-CA-C 114.149 1.166 . . . . 16.02 114.149 -166.03 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.416 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.733 0 N-CA-C 109.391 -0.596 . . . . 8.5 109.391 . . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.434 . . 101.4 -178.49 0.0 OUTLIER 'General case' 0 C--N 1.341 0.233 0 C-N-CA 124.724 1.209 . . . . 5.39 112.194 160.211 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 88.49 95.08 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.75 2.42 . . . . 5.56 111.685 -177.394 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -132.58 148.19 68.58 Favored Pre-proline 0 CA--C 1.547 0.834 0 N-CA-C 104.871 -2.27 . . . . 6.82 104.871 165.269 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -61.39 156.98 43.16 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 123.799 2.999 . . . . 3.1 113.578 -168.165 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -168.56 172.58 8.03 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 118.72 -0.657 . . . . 3.69 111.519 -149.029 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 5.2 t -90.54 -174.97 4.29 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.336 1.054 . . . . 2.42 113.581 -173.65 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -46.77 -73.9 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.287 2.235 . . . . 3.22 112.67 -172.872 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 25.9 mt -55.42 -37.67 67.97 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 121.236 -0.915 . . . . 2.38 111.297 179.359 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -59.76 -36.22 76.22 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 122.779 0.432 . . . . 3.69 111.013 173.572 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -66.13 -46.99 75.58 Favored 'General case' 0 C--N 1.344 0.351 0 O-C-N 120.135 -1.603 . . . . 3.99 109.155 172.077 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -56.27 -42.8 78.03 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.099 0.559 . . . . 2.32 110.287 -175.778 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.263 2.5 pp -70.6 -42.7 78.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 O-C-N 121.622 -0.674 . . . . 2.0 111.033 171.721 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -54.71 -42.41 71.47 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.607 1.094 . . . . 4.34 112.07 179.127 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.1 t -63.18 -31.6 72.79 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.109 -0.994 . . . . 2.32 112.096 -177.919 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 m -80.15 -36.76 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 O-C-N 120.899 -1.125 . . . . 2.11 109.916 173.866 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 58.8 t -57.77 -45.0 87.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 C-N-CA 122.937 0.495 . . . . 2.36 110.343 176.235 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 14.1 t -67.85 -40.42 83.67 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.699 0.682 . . . . 2.06 110.729 177.988 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 51.5 m -55.64 -52.29 64.3 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-N 119.038 0.835 . . . . 1.77 108.891 174.076 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -48.41 -55.63 10.31 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.229 1.411 . . . . 5.79 111.318 171.887 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -56.33 -56.65 18.48 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.05 0.94 . . . . 4.36 109.554 -175.262 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 36.7 p -61.61 -44.79 96.35 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.256 0.622 . . . . 3.28 110.705 -177.576 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -57.64 -61.38 2.55 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.533 1.133 . . . . 6.98 111.008 177.376 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.8 -19.6 51.65 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.668 1.987 . . . . 2.06 111.678 176.656 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . 2.318 0.0 OUTLIER -46.68 -19.1 0.08 Allowed 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 127.956 2.502 . . . . 6.23 113.481 162.368 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -52.07 -64.06 0.94 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 114.101 1.149 . . . . 3.26 114.101 -175.838 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -73.68 -31.6 63.52 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 116.512 2.041 . . . . 5.35 116.512 -154.63 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.22 -111.35 0.43 Allowed Glycine 0 CA--C 1.53 1.013 1 C-N-CA 132.384 4.802 . . . . 5.53 116.075 9.579 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 49.5 ttt85 53.75 98.49 0.01 OUTLIER 'General case' 0 C--O 1.237 0.4 0 C-N-CA 126.512 1.925 . . . . 5.1 112.25 -175.9 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.32 -39.24 93.51 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 121.061 0.458 . . . . 5.97 111.109 177.329 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -75.06 2.33 10.9 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 113.109 0.781 . . . . 3.93 113.109 -171.02 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 1.6 m -154.93 144.21 21.15 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 118.956 0.798 . . . . 3.53 110.657 -177.309 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.8 mp -131.64 141.31 49.59 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.164 0.985 . . . . 3.86 108.932 178.645 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 8.2 t -108.67 177.24 4.84 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.662 0.744 . . . . 3.27 109.773 168.628 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 10.3 p -84.44 53.77 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.118 0 CA-C-O 122.283 1.039 . . . . 3.6 109.878 177.044 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -155.99 54.33 0.58 Allowed 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 104.825 -2.287 . . . . 3.15 104.825 149.387 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -163.56 -60.42 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 102.403 -3.184 . . . . 2.33 102.403 175.882 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -41.26 -58.08 1.93 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.53 1.132 . . . . 4.35 113.602 -179.129 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 11.9 ttmm -54.78 -30.55 57.1 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.456 0.702 . . . . 3.39 112.42 -179.277 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -65.0 -25.5 67.89 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 121.083 -1.011 . . . . 3.04 110.898 -173.707 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.69 -49.54 62.23 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.27 0.941 . . . . 3.76 108.92 179.272 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 15.3 m -66.67 -38.16 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 115.337 -0.847 . . . . 1.72 109.142 -175.704 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 72.5 m -63.53 -54.37 37.31 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.767 0.827 . . . . 2.03 111.323 175.503 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -80.79 -62.33 1.7 Allowed 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 112.199 0.444 . . . . 3.32 112.199 -164.424 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -80.94 -43.72 19.32 Favored 'General case' 0 C--O 1.226 -0.148 0 O-C-N 122.144 -0.348 . . . . 3.03 110.687 -170.677 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 6.6 mp -81.71 -18.89 0.27 Allowed Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 119.171 3.026 . . . . 3.23 119.171 -161.523 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -52.05 89.56 0.03 OUTLIER 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.396 2.731 . . . . 3.12 114.104 -145.787 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 154.36 -65.06 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 129.656 3.182 . . . . 5.23 106.579 -175.098 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 52.7 tp -49.13 -73.37 0.04 OUTLIER 'General case' 0 C--O 1.235 0.304 0 C-N-CA 123.649 0.78 . . . . 2.06 109.445 -164.801 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.3 mt -74.01 131.85 41.78 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.002 -1.851 . . . . 2.21 106.002 147.029 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.49 168.46 12.55 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 104.333 -2.469 . . . . 7.71 104.333 167.864 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . 0.408 ' OD2' ' NZ ' ' B' ' 59' ' ' LYS . 8.8 t0 61.3 84.21 0.14 Allowed 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 124.493 1.12 . . . . 3.56 108.349 -152.599 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 27.3 m -89.13 4.15 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 CA-C-N 114.061 -1.427 . . . . 2.43 109.712 165.649 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.79 -71.48 1.27 Allowed Glycine 0 C--N 1.341 0.854 0 N-CA-C 108.215 -1.954 . . . . 2.73 108.215 -173.55 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 1.5 t -77.01 64.17 2.44 Favored 'General case' 0 CA--C 1.528 0.096 0 C-N-CA 125.518 1.527 . . . . 3.14 107.671 177.583 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -75.25 -27.74 59.59 Favored 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 126.35 1.86 . . . . 1.88 108.845 178.235 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -42.24 -48.84 4.98 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.256 1.822 . . . . 4.33 112.143 170.336 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -45.87 -54.4 8.2 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.369 1.468 . . . . 3.26 110.723 174.872 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . 0.408 ' NZ ' ' OD2' ' B' ' 52' ' ' ASP . 1.6 mppt? -67.93 -55.51 12.48 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 107.363 -1.347 . . . . 4.93 107.363 -177.912 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -40.87 -56.17 2.29 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 125.207 1.403 . . . . 2.56 110.966 -179.973 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -61.27 -42.04 97.96 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 117.8 0.273 . . . . 3.53 111.404 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 21.4 m -59.44 -32.1 69.9 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.065 0.394 . . . . 2.32 112.065 176.871 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 mp -76.65 -57.2 3.99 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.463 0.574 . . . . 3.31 111.076 172.134 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -59.63 -16.19 24.32 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.348 1.859 . . . . 1.74 113.557 -162.397 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.7 m -32.01 -26.33 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 129.848 3.259 . . . . 2.51 119.007 -132.885 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -54.3 -31.32 53.77 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 120.497 1.499 . . . . 3.03 111.314 159.025 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 70.57 68.89 0.2 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.814 1.246 . . . . 3.49 111.077 166.44 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 41.5 p30 -121.14 -7.23 9.4 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.845 1.258 . . . . 1.93 112.497 -177.816 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 18.8 m 72.13 15.48 5.46 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.239 1.415 . . . . 2.69 112.789 -176.567 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -115.76 106.19 13.57 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 127.152 2.181 . . . . 3.94 107.386 164.778 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -83.49 90.12 7.17 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 106.505 -1.665 . . . . 2.09 106.505 167.004 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 31.3 pttt -84.75 174.2 10.08 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.049 0.94 . . . . 5.01 111.37 179.078 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 23.3 p90 -84.67 49.35 1.69 Allowed 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.75 1.019 . . . . 6.88 113.75 -168.424 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -172.03 58.36 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.529 1.531 . . . . 2.95 108.866 116.96 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -87.11 -59.13 2.34 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 106.758 -1.571 . . . . 2.05 106.758 124.182 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 53.7 t80 -42.27 -50.94 4.92 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 125.51 1.524 . . . . 4.26 115.044 -168.333 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.444 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 0.0 OUTLIER -45.88 -35.39 4.5 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-O 117.918 -1.039 . . . . 5.67 109.621 -177.835 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 8.0 mmt180 -35.77 -55.26 0.72 Allowed 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 117.66 -1.162 . . . . 4.62 111.087 -178.159 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.4 tp -48.31 -46.98 36.94 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 120.276 1.398 . . . . 1.74 112.203 -177.369 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 64.3 mt -72.87 -39.75 59.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 C-N-CA 125.154 1.382 . . . . 3.01 107.965 -176.965 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -45.93 -53.19 9.08 Favored Glycine 0 N--CA 1.446 -0.638 0 CA-C-O 122.908 1.282 . . . . 2.59 110.864 170.254 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . 0.428 ' OE1' ' NZ ' ' B' ' 85' ' ' LYS . 9.5 mm-40 -75.3 -47.77 26.28 Favored 'General case' 0 N--CA 1.438 -1.029 0 C-N-CA 126.734 2.014 . . . . 3.47 107.199 -166.847 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mp -38.85 -47.15 1.38 Allowed 'General case' 0 C--N 1.34 0.171 0 C-N-CA 125.305 1.442 . . . . 3.29 111.138 172.929 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -45.61 -46.16 14.22 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.448 -0.787 . . . . 2.42 111.379 178.548 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . 0.428 ' NZ ' ' OE1' ' B' ' 82' ' ' GLU 0.453 0.0 OUTLIER -83.74 -34.72 24.8 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 116.285 1.957 . . . . 3.34 116.285 166.033 . . . . . . . . 4 4 . 1 . 023 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -59.45 -18.92 43.59 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 121.215 1.825 . . . . 3.85 113.052 -176.593 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 6.9 tp -41.51 -51.54 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 O-C-N 121.894 -0.504 . . . . 2.58 110.732 163.468 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -86.22 -48.69 8.33 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.681 1.593 . . . . 5.46 113.441 171.137 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 46.2 tttp -79.94 138.41 37.09 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.476 1.11 . . . . 5.03 111.991 -163.853 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -85.03 -60.65 1.98 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.298 0.639 . . . . 7.55 111.669 176.512 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 31.6 ttmt -172.94 32.68 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.169 1.788 . . . . 9.38 109.242 -177.345 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -92.8 47.0 1.26 Allowed 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 121.024 -1.047 . . . . 5.1 108.801 -160.111 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . 0.463 ' CG ' ' H ' ' B' ' 94' ' ' LYS . 0.3 OUTLIER -106.22 -96.24 0.35 Allowed 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 125.65 1.58 . . . . 6.08 109.19 -173.873 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . 0.463 ' H ' ' CG ' ' B' ' 93' ' ' LEU . 1.9 mptp? 61.35 -147.35 0.42 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.143 1.377 . . . . 8.13 108.617 -176.76 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 14.1 mt 49.2 68.21 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 C-N-CA 124.773 1.229 . . . . 8.59 111.207 174.591 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 6.0 ppt_? -125.55 132.56 52.55 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 123.806 0.843 . . . . 9.59 108.96 177.725 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . 0.43 ' HZ1' ' C ' ' B' ' 98' ' ' LYS . 48.0 tttp -178.88 138.92 0.16 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 126.033 1.733 . . . . 8.8 107.133 -178.058 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . 0.43 ' C ' ' HZ1' ' B' ' 97' ' ' LYS . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.22 0 N-CA-C 103.649 -2.723 . . . . 7.19 103.649 147.362 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptt? . . . . . 0 N--CA 1.475 0.797 0 N-CA-C 110.364 -0.236 . . . . 9.39 110.364 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -178.15 170.64 1.78 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 127.695 2.398 . . . . 4.89 105.204 179.665 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.47 69.32 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 128.844 2.858 . . . . 7.51 110.192 179.633 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -114.32 71.64 2.27 Favored Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 126.733 2.013 . . . . 5.73 108.116 178.08 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -72.71 88.34 0.91 Allowed 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 122.814 2.343 . . . . 4.16 110.066 -175.908 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 87.6 mt -64.3 137.02 57.7 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 107.36 -1.348 . . . . 2.6 107.36 170.912 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.9 t -65.47 169.07 6.42 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.403 -0.591 . . . . 2.26 109.403 176.72 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.1 tt0 -59.23 -48.28 82.22 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 121.586 0.708 . . . . 3.7 109.561 -175.896 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.4 mp -57.98 -45.7 86.32 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 118.245 -0.883 . . . . 2.8 110.267 -179.307 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -57.81 -53.33 59.48 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.09 0.956 . . . . 2.12 111.34 174.824 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.84 -49.35 75.69 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 108.827 -0.805 . . . . 5.19 108.827 -176.1 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 70.7 p -68.81 -44.42 73.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.097 -0.501 . . . . 1.88 110.994 -175.141 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.257 2.5 pp -63.59 -36.94 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 C-N-CA 118.441 -1.304 . . . . 2.06 109.809 176.797 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -59.04 -50.37 74.35 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.462 1.028 . . . . 3.22 110.187 173.031 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.73 -38.34 78.16 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.366 0.603 . . . . 1.97 111.921 -175.143 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 10.8 m -78.27 -36.98 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 O-C-N 120.54 -1.35 . . . . 1.59 111.012 174.302 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 t -59.01 -41.89 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-N 119.427 1.012 . . . . 2.07 110.481 177.359 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.6 t -65.22 -41.88 93.97 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.015 0.825 . . . . 2.01 110.466 176.604 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 22.4 m -61.98 -47.83 83.05 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.659 0.663 . . . . 1.89 109.907 177.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -48.45 -56.77 7.36 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 124.449 1.1 . . . . 4.47 109.883 169.075 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -62.72 -45.44 92.75 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.338 0.655 . . . . 5.32 111.737 -171.467 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.24 -25.88 68.06 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 122.269 -0.269 . . . . 3.31 110.775 179.823 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -80.2 -39.64 28.79 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 118.354 0.524 . . . . 3.84 112.262 164.798 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.94 -37.67 64.1 Favored 'General case' 0 C--O 1.24 0.553 0 O-C-N 120.122 -1.611 . . . . 1.93 110.497 -174.747 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -21.07 66.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.25 1.42 . . . . 5.56 113.302 -179.841 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.0 -66.07 0.45 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 119.849 1.204 . . . . 3.88 111.561 -168.713 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -123.39 151.82 42.19 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 127.148 2.179 . . . . 3.25 109.858 -168.333 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 41.63 62.54 1.89 Allowed Glycine 0 CA--C 1.523 0.589 0 C-N-CA 124.207 0.908 . . . . 2.36 112.941 153.772 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . 0.457 10.7 mpt_? 85.54 112.1 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.558 1.318 . . . . 7.06 114.558 175.757 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -67.14 49.87 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 128.605 2.762 . . . . 4.62 114.522 -177.796 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.86 -54.46 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 108.626 -0.879 . . . . 4.36 108.626 -165.294 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -82.71 131.19 35.21 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 127.403 2.281 . . . . 2.88 107.72 175.907 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -97.97 129.64 44.86 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.297 0.639 . . . . 3.49 109.606 -175.807 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.9 t -82.58 161.86 22.13 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 125.663 1.585 . . . . 3.8 109.603 177.64 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.4 p -57.46 -39.71 70.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 116.212 -0.449 . . . . 3.62 109.927 167.919 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -69.91 -57.14 5.39 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-O 117.823 -1.084 . . . . 2.2 108.977 -178.186 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 63.9 mt-10 -39.0 -49.61 1.72 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 119.07 0.85 . . . . 1.77 112.12 169.91 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -57.71 -52.15 66.63 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 122.011 -0.43 . . . . 4.04 110.723 175.006 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 48.1 tttt -57.23 -38.13 73.3 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.715 -0.616 . . . . 3.29 111.261 -179.959 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -55.43 -34.91 64.86 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.278 0.49 . . . . 2.96 111.376 177.193 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -65.07 -53.78 40.24 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.294 -1.002 . . . . 3.41 108.294 -178.096 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.2 m -66.86 -40.91 86.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-N 115.318 -0.856 . . . . 1.96 109.71 -173.458 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.3 m -60.9 -53.74 53.59 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.288 1.035 . . . . 2.43 110.533 176.001 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -71.11 -48.0 54.79 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 119.188 -0.434 . . . . 3.36 111.282 -170.128 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -154.21 85.85 1.15 Allowed 'General case' 0 C--N 1.34 0.166 0 CA-C-N 118.644 0.656 . . . . 4.97 111.492 177.776 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 tp -157.62 59.02 1.59 Allowed Pre-proline 0 CA--C 1.543 0.696 0 CA-C-N 117.988 0.358 . . . . 2.84 111.602 161.454 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -65.85 -54.61 0.52 Allowed 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 124.103 3.202 . . . . 2.33 113.865 -166.394 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -107.66 41.31 1.54 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 119.295 0.952 . . . . 4.97 110.066 -169.671 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 mp -126.31 -98.78 0.4 Allowed 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 106.727 -1.583 . . . . 2.05 106.727 -178.416 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 87.6 mt -90.06 55.99 3.29 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.119 -0.988 . . . . 2.6 109.365 -168.183 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 157.57 14.49 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.658 -0.701 . . . . 5.45 110.925 -179.528 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 84.25 41.57 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 128.045 2.538 . . . . 4.56 110.193 -170.01 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.3 m -72.4 26.29 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 124.389 1.076 . . . . 3.37 113.556 -177.425 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -74.02 -76.85 0.67 Allowed Glycine 0 CA--C 1.522 0.478 0 N-CA-C 105.86 -2.896 . . . . 1.7 105.86 166.475 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 10.7 m -71.19 54.57 0.19 Allowed 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 127.276 2.23 . . . . 3.7 112.114 176.955 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -57.04 -28.54 62.63 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 125.302 1.441 . . . . 2.27 109.866 175.554 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -46.6 -33.43 4.16 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 125.121 1.368 . . . . 4.21 112.565 170.032 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -50.19 -60.88 2.53 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.035 -1.098 . . . . 4.04 108.035 172.884 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.7 -38.81 73.69 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.059 -0.973 . . . . 4.82 109.47 -172.969 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -49.64 -56.79 8.77 Favored 'General case' 0 CA--C 1.528 0.126 0 N-CA-C 109.389 -0.597 . . . . 2.54 109.389 175.04 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -63.42 -36.53 84.05 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 111.549 0.203 . . . . 4.26 111.549 178.945 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.1 m -59.36 -32.53 70.2 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.821 -0.549 . . . . 2.58 112.45 174.063 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 17.7 mt -87.47 -51.67 5.79 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 125.307 1.443 . . . . 2.68 111.679 -175.709 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -75.22 69.42 2.07 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.616 1.167 . . . . 1.52 109.83 -173.695 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 16.4 m -51.36 -42.71 28.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 124.47 1.108 . . . . 2.73 113.711 -168.992 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -84.22 -6.62 59.42 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.273 0.488 . . . . 2.61 112.245 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . 0.306 0.0 OUTLIER 51.25 59.95 4.23 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.646 1.979 . . . . 5.69 113.448 179.365 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.0 p30 -101.6 -9.39 21.0 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.259 1.423 . . . . 1.83 111.44 175.91 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . 0.295 15.7 p 80.9 -0.54 1.8 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 127.751 2.42 . . . . 3.16 114.234 -174.831 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -110.33 124.68 52.11 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.204 1.002 . . . . 3.05 108.345 173.064 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -84.7 97.77 9.84 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 106.071 -1.825 . . . . 1.98 106.071 168.084 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.3 pttt -69.65 162.8 26.95 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.542 1.065 . . . . 7.35 109.32 173.095 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -38.46 -52.61 1.57 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.695 1.198 . . . . 6.6 113.429 -173.051 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.08 -45.49 85.04 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.858 0.463 . . . . 2.09 111.174 -179.212 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -60.0 -45.43 92.77 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.673 -0.492 . . . . 1.89 109.673 178.915 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -66.01 -45.15 82.57 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 118.558 -0.734 . . . . 4.12 110.458 177.581 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.53 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -42.8 -47.13 5.44 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-O 117.133 -1.413 . . . . 6.46 107.239 173.499 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . 0.406 ' C ' ' O ' ' A' ' 77' ' ' TRP . 13.4 mtp-105 -39.16 -45.76 1.36 Allowed 'General case' 0 C--O 1.213 -0.829 0 CA-C-O 117.368 -1.301 . . . . 4.48 111.364 -177.422 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.5 tp -45.12 -56.94 4.25 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 120.226 1.375 . . . . 2.0 112.319 174.526 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.7 mp -61.81 -40.69 87.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 C-N-CA 126.949 2.1 . . . . 2.62 107.761 179.636 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -44.98 -54.89 6.66 Favored Glycine 0 CA--C 1.528 0.858 0 N-CA-C 109.761 -1.336 . . . . 2.28 109.761 170.707 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -74.27 -38.9 63.3 Favored 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 127.266 2.226 . . . . 2.7 107.727 -169.193 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 11.3 mt -52.85 -43.17 65.86 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 119.365 0.984 . . . . 3.39 110.912 178.869 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.49 -25.0 59.09 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.833 0.679 . . . . 2.39 112.833 176.829 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -83.78 -57.15 3.33 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.908 1.683 . . . . 2.57 111.498 168.716 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -57.33 -26.34 60.79 Favored 'General case' 0 N--CA 1.465 0.306 0 O-C-N 120.826 -1.171 . . . . 3.86 112.841 -175.604 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.0 tp -42.5 -33.24 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 C-N-CA 124.626 1.17 . . . . 2.96 112.284 168.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.1 -5.7 5.53 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.122 0.969 . . . . 7.27 112.785 174.39 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 26.8 tttp -101.74 7.7 41.78 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.666 1.121 . . . . 4.43 113.424 176.233 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -35.01 -44.3 0.22 Allowed 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 127.167 2.187 . . . . 7.74 116.029 -157.604 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.7 mttt -158.61 57.13 0.44 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.148 0.886 . . . . 11.78 109.02 155.726 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -24.66 -68.79 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 128.089 2.556 . . . . 5.83 111.971 -178.601 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.4 pt? -53.48 -25.01 14.61 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.382 1.473 . . . . 11.18 114.192 -170.019 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -108.23 -59.71 1.82 Allowed 'General case' 0 C--O 1.234 0.278 0 CA-C-N 118.739 0.7 . . . . 12.92 109.776 172.87 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.0 mt -116.62 89.35 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 124.173 0.989 . . . . 10.81 109.604 -166.728 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.33 88.01 1.16 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 108.86 -0.793 . . . . 13.35 108.86 166.959 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -176.42 136.83 0.27 Allowed 'General case' 0 C--O 1.234 0.281 0 C-N-CA 127.67 2.388 . . . . 9.8 104.629 176.58 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . 0.442 ' C ' ' H3 ' ' B' ' 1' ' ' MET . 13.3 ttmm . . . . . 0 C--O 1.253 1.28 0 CA-C-O 117.762 -1.114 . . . . 13.32 108.287 -131.02 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 1' ' ' MET . . . . . 0.442 ' H3 ' ' C ' ' A' ' 98' ' ' LYS . 92.5 mmm . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 112.899 0.703 . . . . 6.49 112.899 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -161.63 -145.15 0.1 Allowed 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 124.802 1.241 . . . . 5.77 107.811 -168.582 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 83.48 108.49 0.06 Allowed 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 116.522 2.045 . . . . 5.46 116.522 127.302 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 111.58 132.81 0.0 OUTLIER Pre-proline 0 N--CA 1.471 0.596 0 C-N-CA 125.042 1.337 . . . . 6.56 111.482 147.6 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -66.69 170.31 12.82 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 124.104 3.202 . . . . 2.91 111.27 -178.752 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -170.34 169.09 7.76 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 118.886 -0.578 . . . . 3.87 110.338 -152.619 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 3.2 t -86.77 -171.88 3.73 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.334 1.054 . . . . 2.0 113.149 -170.397 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -55.16 -67.04 0.31 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.786 1.634 . . . . 2.33 112.837 -170.97 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 20.5 mt -53.13 -42.21 65.82 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.265 -0.897 . . . . 2.27 111.32 176.234 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -57.45 -42.4 82.42 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 119.454 -0.308 . . . . 3.17 110.443 177.415 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.7 -49.58 75.9 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 124.536 1.134 . . . . 4.03 110.148 175.066 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 76.0 p -67.33 -25.88 66.22 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 118.895 -0.574 . . . . 2.45 112.151 -174.58 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.287 2.7 pp -80.32 -32.56 13.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 119.219 0.918 . . . . 2.31 111.268 165.844 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -58.46 -53.42 58.47 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 119.553 1.069 . . . . 2.97 110.808 175.406 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 8.2 t -48.47 -45.13 36.31 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 119.59 1.086 . . . . 1.87 111.557 -174.013 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 33.3 m -69.96 -34.25 59.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 O-C-N 121.113 -0.992 . . . . 2.06 111.577 177.917 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 59.1 t -63.14 -52.32 60.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 118.883 0.765 . . . . 2.05 110.224 173.353 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 8.9 t -60.72 -43.01 98.37 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.547 1.067 . . . . 1.84 110.557 179.009 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 54.9 m -57.72 -49.23 77.22 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.388 -0.82 . . . . 1.85 110.768 174.251 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -48.68 -53.51 18.47 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 121.512 -0.742 . . . . 5.15 110.191 170.209 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -59.32 -47.83 83.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.442 1.097 . . . . 3.7 110.969 -173.331 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -61.55 -47.43 85.58 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 119.876 -0.73 . . . . 3.64 109.909 178.38 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -59.2 -35.16 73.12 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 120.849 -1.157 . . . . 4.1 111.828 173.584 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.11 -34.77 79.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 120.926 -1.109 . . . . 1.9 109.601 -179.875 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -18.53 64.79 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 117.566 -1.207 . . . . 4.8 113.159 -177.86 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -49.17 -66.73 0.35 Allowed 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 114.113 1.153 . . . . 2.56 114.113 -155.921 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -92.54 -79.69 0.39 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.361 0.875 . . . . 3.3 113.361 -172.762 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.79 170.61 30.89 Favored Glycine 0 C--N 1.34 0.764 0 C-N-CA 128.792 3.091 . . . . 2.41 111.611 160.527 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.9 mmt85 46.69 96.85 0.01 OUTLIER 'General case' 0 C--O 1.241 0.621 0 C-N-CA 124.843 1.257 . . . . 4.32 113.724 146.781 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -76.69 52.88 0.85 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.937 0.895 . . . . 4.19 111.198 173.239 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -147.59 -64.78 0.27 Allowed 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 105.256 -2.128 . . . . 4.09 105.256 179.182 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 26.0 p -78.34 139.38 38.82 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.942 -1.026 . . . . 2.15 109.855 -178.533 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.82 128.42 36.16 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 106.883 -1.525 . . . . 3.69 106.883 159.156 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 6.5 t -82.46 -170.13 2.79 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.37 1.468 . . . . 2.92 108.496 163.707 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 85.1 t -67.03 -98.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 130.183 3.393 . . . . 3.41 101.969 -174.113 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -71.7 77.92 0.84 Allowed 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 121.364 1.893 . . . . 2.68 108.313 178.546 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 1.8 tt0 -163.3 -56.84 0.04 OUTLIER 'General case' 0 N--CA 1.444 -0.755 1 C-N-CA 132.155 4.182 . . . . 1.96 102.752 177.849 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -63.36 -52.78 60.29 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.061 -0.972 . . . . 3.29 109.01 170.359 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 9.8 ttmm -55.95 -37.1 68.56 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 119.677 -0.809 . . . . 3.63 110.333 -176.217 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -56.2 -38.03 70.44 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.839 0.681 . . . . 2.76 112.839 175.528 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -62.97 -51.66 65.99 Favored 'General case' 0 C--O 1.231 0.106 0 N-CA-C 108.083 -1.08 . . . . 3.6 108.083 -178.784 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 12.6 m -68.85 -48.66 69.52 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-N 115.861 -0.608 . . . . 1.93 109.726 -172.913 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 47.1 m -53.64 -54.95 30.48 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.991 0.916 . . . . 1.8 110.931 175.662 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -77.18 -56.4 4.6 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 122.362 -0.211 . . . . 1.9 110.745 -168.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -80.91 -50.75 9.37 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.552 0.945 . . . . 3.05 113.552 -164.97 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.23 -21.28 0.74 Allowed Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 115.022 1.49 . . . . 3.49 115.022 -157.014 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -62.98 -11.56 25.27 Favored 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 121.59 -2.254 . . . . 2.55 111.467 -74.407 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -107.39 -37.01 6.34 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 125.512 1.525 . . . . 3.6 110.993 -174.884 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 28.5 tp -47.39 -46.3 25.96 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 124.313 1.045 . . . . 1.9 111.765 -172.432 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.2 mt -108.27 131.05 55.1 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 105.696 -1.965 . . . . 2.12 105.696 153.641 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -105.37 -175.09 2.69 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 125.609 1.564 . . . . 6.85 109.15 -178.403 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.25 3.7 p30 44.5 47.25 8.32 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 125.227 1.411 . . . . 4.63 110.917 178.731 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -52.85 -14.84 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 C-N-CA 128.082 2.553 . . . . 4.02 113.589 -178.587 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -48.61 -59.58 6.51 Favored Glycine 0 CA--C 1.531 1.063 0 N-CA-C 110.197 -1.161 . . . . 2.77 110.197 162.835 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 23.2 t -73.97 39.49 0.11 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 128.212 2.605 . . . . 3.01 113.15 -169.244 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -67.77 -31.66 71.7 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 125.786 1.634 . . . . 1.89 110.131 -178.393 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -43.75 -52.64 6.45 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.604 1.562 . . . . 4.33 112.602 177.795 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -40.43 87.3 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.625 1.102 . . . . 4.11 111.17 -176.308 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -62.05 -58.99 5.75 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.866 -0.791 . . . . 5.65 108.866 172.12 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -44.48 -50.74 9.29 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 119.112 0.869 . . . . 2.37 111.4 -179.118 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 10.9 tptp -55.3 -46.03 76.24 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.284 1.033 . . . . 4.89 111.333 177.052 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 20.0 m -71.79 -29.06 64.05 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.54 0.736 . . . . 2.14 112.356 179.783 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 65.6 mt -81.3 -57.91 3.28 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.857 1.263 . . . . 2.34 111.212 -175.935 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -57.68 -10.96 1.8 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.797 2.039 . . . . 1.84 115.773 -166.047 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 30.2 m -35.9 -25.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 130.618 3.567 . . . . 2.91 119.173 -130.92 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 21.6 p-10 -61.71 -24.62 66.91 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 120.846 1.657 . . . . 3.97 110.645 169.051 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 65.7 65.07 0.55 Allowed 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.711 2.005 . . . . 5.7 112.047 176.067 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 35.7 p30 -109.48 -8.57 15.0 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.664 1.986 . . . . 2.4 110.542 176.798 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.5 m 63.66 16.24 9.55 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.304 1.041 . . . . 2.15 113.402 -170.384 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -108.62 101.08 10.26 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 105.861 -1.903 . . . . 3.15 105.861 158.377 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.82 94.97 0.34 Allowed 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 105.026 -2.213 . . . . 2.55 105.026 166.482 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 46.5 tptt -83.14 162.42 21.3 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.999 0.519 . . . . 6.33 111.007 -155.009 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -83.11 64.4 7.65 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 109.044 -0.725 . . . . 5.44 109.044 162.413 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -163.97 51.67 0.14 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 115.66 -2.416 . . . . 5.21 113.303 82.397 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 -85.85 -53.06 5.34 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 126.855 2.062 . . . . 2.24 108.213 153.035 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -40.9 -43.2 2.02 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 127.571 2.348 . . . . 4.58 113.077 -169.523 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.512 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 0.0 OUTLIER -39.09 -48.51 1.69 Allowed 'General case' 0 C--N 1.343 0.29 0 O-C-N 124.124 0.89 . . . . 5.6 109.078 178.031 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -38.8 -46.39 1.26 Allowed 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 124.127 0.971 . . . . 5.67 112.948 -168.477 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 5.4 tp -57.59 -46.24 84.27 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.943 1.247 . . . . 1.91 112.966 178.534 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 15.7 mt -66.04 -41.42 89.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 106.95 -1.5 . . . . 3.21 106.95 177.596 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -43.64 -56.6 4.89 Favored Glycine 0 N--CA 1.44 -1.064 0 N-CA-C 108.739 -1.744 . . . . 2.16 108.739 171.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -69.32 -61.66 1.7 Allowed 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 125.567 1.547 . . . . 2.2 108.803 -171.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 4.5 pp -53.18 -29.92 34.54 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 111.802 0.297 . . . . 3.08 111.802 -171.79 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -51.12 -48.22 61.8 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.988 1.107 . . . . 2.28 113.988 169.148 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.27 0.0 OUTLIER -77.18 -39.8 47.59 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 119.781 1.173 . . . . 3.26 111.743 172.286 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -55.84 -34.01 65.02 Favored 'General case' 0 C--N 1.339 0.117 0 CA-C-O 118.36 -0.829 . . . . 2.94 112.715 -166.37 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 10.0 tt -42.65 -45.75 1.16 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 118.749 0.704 . . . . 1.89 111.363 173.381 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 63.8 ttt-85 -83.67 -43.78 15.21 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.097 0.959 . . . . 4.73 111.684 172.464 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 45.2 tttt -133.09 71.55 1.47 Allowed 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.682 1.364 . . . . 7.2 114.682 -144.032 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -46.63 -31.15 2.68 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.518 1.673 . . . . 6.85 115.518 179.702 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -87.41 -41.69 13.38 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.79 -1.193 . . . . 10.91 114.174 -161.405 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -84.28 74.78 10.28 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.504 -0.747 . . . . 8.28 110.989 -159.97 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.33 -50.77 1.01 Allowed 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.314 0.857 . . . . 6.35 113.314 176.704 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 43.2 mttp -80.26 77.84 6.98 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.213 -0.929 . . . . 8.7 110.969 -170.055 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 7.8 tp -116.88 141.94 32.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 125.324 1.45 . . . . 9.71 109.879 173.93 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 31.0 ttp-105 -162.48 136.45 6.38 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 107.293 -1.373 . . . . 8.88 107.293 168.68 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -177.3 137.08 0.21 Allowed 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 125.388 1.475 . . . . 9.13 107.199 176.8 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? . . . . . 0 C--O 1.252 1.218 0 CA-C-O 114.958 -2.448 . . . . 10.51 104.789 -165.398 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.9 mtt . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 106.789 -1.56 . . . . 8.7 106.789 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.68 52.67 2.16 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.931 1.241 . . . . 7.37 112.227 -173.684 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 28.1 -40.82 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.576 1 C-N-CA 134.626 5.171 . . . . 5.51 120.688 -175.003 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 166.88 81.01 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.618 0 C-N-CA 125.878 1.671 . . . . 5.47 109.719 -170.919 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.87 142.33 62.37 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.392 1.395 . . . . 2.7 108.662 171.335 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.7 mt -111.6 -173.86 2.34 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.562 0.745 . . . . 2.75 110.086 -169.158 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.2 t -91.09 151.34 21.04 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.331 0.652 . . . . 2.33 110.202 -178.542 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -37.2 -54.52 1.02 Allowed 'General case' 0 C--N 1.339 0.134 0 C-N-CA 125.998 1.719 . . . . 2.31 113.456 -177.353 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.1 mt -63.7 -47.32 81.65 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 117.739 -1.125 . . . . 3.0 110.392 -175.857 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.21 -61.15 2.14 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.713 1.205 . . . . 4.97 110.392 170.044 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -48.7 -51.23 29.7 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.195 0.998 . . . . 3.77 109.318 -178.359 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 81.3 p -62.5 -48.42 79.63 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.626 0.602 . . . . 2.27 112.626 179.783 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.309 2.7 pp -60.42 -41.66 88.27 Favored 'Isoleucine or valine' 0 C--N 1.344 0.362 0 CA-C-N 119.459 1.027 . . . . 2.13 110.537 179.685 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -60.41 -53.05 62.24 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 119.261 -0.976 . . . . 2.87 109.234 173.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -53.62 -36.78 62.38 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.81 0.67 . . . . 1.89 112.81 -174.849 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.3 m -78.52 -45.2 26.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-N 119.311 0.96 . . . . 1.95 111.156 172.8 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 45.5 t -57.47 -40.75 76.39 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.333 0 CA-C-O 118.553 -0.737 . . . . 2.07 110.834 -176.891 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.0 t -59.61 -48.05 83.2 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 119.729 1.15 . . . . 2.02 110.335 176.027 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.7 m -53.19 -59.23 4.81 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 109.005 -0.739 . . . . 1.96 109.005 175.147 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -59.11 -43.52 91.91 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 112.052 0.39 . . . . 9.71 112.052 -176.127 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -61.18 -53.97 50.25 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 125.515 1.526 . . . . 5.1 110.409 -178.605 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 40.0 p -57.3 -50.51 72.69 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.074 -0.713 . . . . 3.53 109.074 177.07 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.89 -47.04 64.75 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-O 121.637 0.732 . . . . 4.54 111.63 176.806 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.65 -17.16 45.71 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 126.55 1.94 . . . . 1.64 111.973 -178.041 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -24.12 67.59 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 117.657 -1.163 . . . . 6.12 111.351 171.598 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -42.61 -62.45 0.98 Allowed 'General case' 0 C--N 1.346 0.431 0 C-N-CA 124.378 1.071 . . . . 3.21 112.082 -174.056 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -122.44 173.17 7.83 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 127.816 2.446 . . . . 2.59 107.606 -177.271 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -22.36 133.33 0.01 OUTLIER Glycine 0 CA--C 1.533 1.201 0 C-N-CA 127.458 2.456 . . . . 1.74 115.348 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.1 mtt85 64.47 103.49 0.03 OUTLIER 'General case' 0 C--O 1.239 0.503 0 C-N-CA 125.319 1.448 . . . . 6.36 111.907 179.509 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.38 58.25 0.39 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.194 1.398 . . . . 5.89 112.015 173.424 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 57.4 p-10 -170.94 -45.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 126.109 1.764 . . . . 4.24 108.61 170.391 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.5 m -84.16 139.87 32.13 Favored 'General case' 0 N--CA 1.444 -0.741 0 C-N-CA 125.152 1.381 . . . . 4.26 109.639 -179.379 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -89.8 175.11 7.36 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.44 1.096 . . . . 3.05 108.563 -178.447 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 35.2 m -153.56 170.13 21.55 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 105.845 -1.909 . . . . 3.66 105.845 179.365 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.3 p -51.63 -57.75 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 119.873 1.215 . . . . 3.39 113.443 -167.001 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -67.03 -47.26 71.97 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.907 -0.405 . . . . 2.28 109.907 -176.419 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -38.62 -51.54 1.64 Allowed 'General case' 0 C--O 1.231 0.12 0 C-N-CA 125.83 1.652 . . . . 1.83 110.863 167.839 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.56 -58.05 10.27 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.431 -0.804 . . . . 4.68 109.665 176.916 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.9 tttm -53.13 -47.45 68.67 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 118.849 -0.596 . . . . 3.82 111.555 -175.106 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -51.36 -41.58 60.72 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.378 0.535 . . . . 2.28 110.986 175.795 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 14.9 tp -64.96 -49.92 68.42 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 119.204 0.911 . . . . 3.79 109.028 -174.876 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 2.3 m -70.31 -46.52 71.09 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 CA-C-O 121.519 0.676 . . . . 2.0 109.215 -173.696 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.4 m -59.6 -49.29 78.33 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.79 0.836 . . . . 2.62 109.941 179.877 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -81.11 -56.13 4.29 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 118.914 -0.565 . . . . 4.16 112.13 -171.527 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.01 39.43 2.55 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.223 0.92 . . . . 5.43 113.44 -173.753 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 tp -150.19 70.83 9.26 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-N 119.273 0.942 . . . . 2.86 110.231 173.062 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.08 -49.38 1.39 Allowed 'Trans proline' 0 N--CA 1.451 -1.017 0 C-N-CA 123.221 2.614 . . . . 1.85 113.084 -165.067 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -120.24 -29.41 4.85 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 118.373 0.533 . . . . 3.84 112.082 -167.27 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 13.6 tp -45.43 -62.98 1.05 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.241 1.017 . . . . 1.85 113.242 -170.065 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.3 mt -84.87 -64.13 1.21 Allowed 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 108.186 -1.042 . . . . 3.48 108.186 174.132 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.5 tptm 68.59 157.65 0.14 Allowed 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 124.656 1.182 . . . . 7.46 111.665 -170.284 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 59.6 t0 50.13 68.69 0.71 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 123.626 1.679 . . . . 4.56 109.145 -147.739 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.7 m -82.64 29.91 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 112.999 -1.91 . . . . 3.13 109.893 160.484 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -101.85 -58.43 0.8 Allowed Glycine 0 C--N 1.341 0.823 0 N-CA-C 108.278 -1.929 . . . . 1.74 108.278 172.834 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.1 t -74.1 57.14 0.63 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.386 1.474 . . . . 2.45 110.682 179.851 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -69.33 -42.53 75.19 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 124.035 0.934 . . . . 2.29 109.528 -175.889 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -39.46 -50.31 2.12 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 126.065 1.746 . . . . 4.25 112.961 -179.096 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -52.88 -52.47 57.36 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.596 0.712 . . . . 3.07 110.291 176.618 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.59 -38.01 83.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.213 0.605 . . . . 4.44 109.549 -177.346 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -55.34 -49.84 71.2 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.506 -0.553 . . . . 2.48 109.506 174.095 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -64.52 -39.01 92.98 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 117.933 0.333 . . . . 3.85 111.353 177.04 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.8 m -58.06 -41.82 84.16 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.768 -0.583 . . . . 3.16 111.072 174.978 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 36.7 mt -70.0 -68.44 0.42 Allowed 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.881 0.872 . . . . 2.77 109.067 178.363 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -77.46 75.83 4.0 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.801 1.24 . . . . 1.79 110.069 -171.775 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.7 m -46.24 -35.96 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 124.718 1.207 . . . . 2.72 113.625 -177.824 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -84.95 -14.62 47.02 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.707 1.203 . . . . 2.46 112.879 -178.214 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 51.89 46.64 26.25 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.028 1.331 . . . . 5.04 110.805 -176.535 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 35.1 p30 -86.38 -18.5 31.68 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.666 0.787 . . . . 1.93 109.909 168.168 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.0 t 71.45 16.06 6.05 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.872 1.669 . . . . 3.97 112.743 -178.886 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -120.84 104.92 10.23 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 105.76 -1.941 . . . . 3.83 105.76 172.397 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -88.07 92.91 9.32 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.221 -1.399 . . . . 2.33 107.221 -174.012 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . 0.41 ' NZ ' ' OD1' ' B' ' 92' ' ' ASP . 33.5 tttt -55.13 160.03 2.27 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 108.878 -0.786 . . . . 7.05 108.878 172.385 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -39.77 -57.62 1.51 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.422 1.089 . . . . 6.63 112.777 -178.75 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -60.46 -38.25 83.58 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.087 0.555 . . . . 2.52 112.01 179.08 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -66.77 -50.55 62.34 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.822 -0.436 . . . . 2.14 109.822 -178.024 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -58.88 -43.98 91.03 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 119.818 -0.753 . . . . 8.03 109.628 175.778 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' TRP . . . . . 0.611 ' CZ2' ' CE2' ' B' ' 77' ' ' TRP . 3.8 t-105 -48.5 -34.04 10.53 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 117.714 -1.136 . . . . 4.82 112.019 -177.142 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.7 mtp85 -39.25 -47.49 1.68 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.726 1.148 . . . . 4.79 111.549 174.072 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.1 tp -45.66 -47.45 15.0 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.408 0.683 . . . . 1.88 111.164 179.208 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.8 mp -64.08 -21.37 28.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-O 120.874 0.368 . . . . 3.05 110.265 -169.57 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' GLY . . . . . 0.541 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -76.67 -44.69 14.88 Favored Glycine 0 CA--C 1.496 -1.106 0 N-CA-C 109.012 -1.635 . . . . 1.62 109.012 179.452 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -63.98 -43.23 96.36 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 105.802 -1.925 . . . . 2.64 105.802 -179.53 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.5 mt -54.62 -60.28 3.56 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 121.447 -0.783 . . . . 3.86 111.71 171.094 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.7 -27.74 63.2 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.281 1.032 . . . . 2.37 112.46 -176.908 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -80.53 -48.77 12.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.5 1.52 . . . . 3.03 110.054 177.202 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -55.46 -45.67 76.88 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 126.038 1.735 . . . . 2.37 110.694 -179.967 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.0 tt -63.69 0.3 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 N-CA-C 113.271 0.841 . . . . 2.24 113.271 175.661 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.71 -59.54 1.82 Allowed 'General case' 0 C--O 1.236 0.367 0 O-C-N 120.552 -1.343 . . . . 8.71 109.821 162.975 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.71 -44.15 64.66 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 114.339 1.237 . . . . 4.23 114.339 -168.812 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 12.2 ttpt -68.01 -18.29 64.67 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 118.597 0.635 . . . . 8.67 112.368 -159.689 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? -72.34 -74.44 0.16 Allowed 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 126.907 2.083 . . . . 12.42 111.544 -172.024 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -82.93 65.98 8.33 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.568 0.747 . . . . 8.35 110.876 -157.321 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -139.06 -48.3 0.49 Allowed 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.806 0.843 . . . . 8.45 110.8 168.436 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.39 45.1 0.37 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.464 0.65 . . . . 11.24 111.885 176.076 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -154.7 155.97 5.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 104.697 -2.335 . . . . 11.51 104.697 166.144 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -44.06 -72.67 0.05 Allowed 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 113.504 0.927 . . . . 16.79 113.504 -160.847 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 174.91 53.49 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 126.434 1.894 . . . . 10.41 108.942 -177.015 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 95.9 mttt . . . . . 0 C--O 1.251 1.183 0 C-N-CA 127.899 2.48 . . . . 13.2 105.852 -142.927 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 27.6 mmm . . . . . 0 C--O 1.236 0.383 0 CA-C-O 117.825 -1.083 . . . . 9.02 109.767 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.329 . . -142.18 -174.82 4.21 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 130.944 3.698 . . . . 6.2 108.918 -171.387 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 88.73 87.12 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 127.419 2.288 . . . . 7.34 114.785 165.783 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -179.76 161.68 0.9 Allowed Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 129.061 2.944 . . . . 6.64 108.521 152.608 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -87.9 173.5 5.04 Favored 'Trans proline' 0 CA--C 1.535 0.525 0 C-N-CA 123.98 3.12 . . . . 3.4 111.391 -173.805 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -169.14 176.58 5.2 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.24 1.416 . . . . 3.21 109.088 -176.007 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 13.7 t -79.57 -176.62 5.4 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.875 0.87 . . . . 2.37 111.828 -166.706 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -62.98 -67.58 0.41 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.491 0.716 . . . . 3.27 112.26 -165.278 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 18.6 mt -50.07 -45.46 52.49 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.03 -1.044 . . . . 2.32 111.244 176.139 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -56.93 -37.46 71.52 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.252 1.021 . . . . 3.69 111.686 177.123 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.72 -44.21 51.09 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.195 0.998 . . . . 4.19 109.241 179.521 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 25.7 t -57.39 -46.95 82.89 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.272 0.629 . . . . 2.29 110.07 -179.031 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.275 2.7 pp -65.98 -18.93 24.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 O-C-N 121.172 -0.955 . . . . 2.34 112.282 174.505 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.38 -56.17 5.16 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.751 1.16 . . . . 3.17 110.639 167.496 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.1 t -47.48 -43.91 24.83 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.051 1.296 . . . . 2.19 111.422 -169.836 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 15.4 m -69.36 -37.93 76.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 O-C-N 121.562 -0.711 . . . . 2.09 112.128 178.032 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.65 -42.36 95.76 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.133 0.973 . . . . 2.26 109.585 175.011 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 18' ' ' THR . . . . . . . . . . . . 0.269 9.8 t -68.26 -36.9 80.14 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 120.774 -1.204 . . . . 2.32 111.358 174.69 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.0 m -53.59 -57.52 10.45 Favored 'General case' 0 C--N 1.345 0.382 0 CA-C-N 120.705 1.593 . . . . 1.88 109.248 169.632 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -41.59 -55.54 2.87 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.269 1.028 . . . . 5.45 110.539 172.503 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -58.28 -53.21 60.81 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.251 1.02 . . . . 3.51 111.1 -174.624 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 40.3 p -56.1 -52.9 62.63 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.729 0.411 . . . . 3.03 110.893 -178.955 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -61.47 -47.8 84.01 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 118.042 0.383 . . . . 4.17 110.632 177.699 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.19 -29.55 61.04 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 126.221 1.809 . . . . 2.08 111.271 -176.176 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.16 -15.67 47.7 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 117.951 -1.023 . . . . 3.95 113.038 176.524 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 tp-100 -58.13 -65.13 0.69 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 116.131 1.9 . . . . 2.06 116.131 -166.801 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -88.02 -77.88 0.34 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.371 0.532 . . . . 2.98 112.205 -163.199 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.39 164.9 25.94 Favored Glycine 0 C--N 1.339 0.728 0 C-N-CA 128.048 2.737 . . . . 2.48 110.609 150.805 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 17.9 mmt85 53.47 98.96 0.01 OUTLIER 'General case' 0 C--O 1.24 0.591 0 N-CA-C 115.326 1.602 . . . . 4.43 115.326 135.565 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -72.82 60.68 0.52 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.018 1.727 . . . . 3.95 112.261 178.615 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -164.25 -61.24 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 106.716 -1.587 . . . . 4.02 106.716 -171.406 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 87.6 p -58.88 138.94 57.09 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 118.008 -0.996 . . . . 2.65 109.938 168.774 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 6.5 mp -102.08 101.45 11.81 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.248 -1.019 . . . . 3.47 108.248 152.353 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 1.4 p -84.25 176.11 8.96 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.684 1.194 . . . . 3.48 108.521 168.841 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 7.8 p -91.6 50.94 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 O-C-N 120.516 -1.365 . . . . 3.5 111.492 -170.523 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -156.37 52.78 0.54 Allowed 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 106.376 -1.712 . . . . 3.66 106.376 149.254 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 91.8 mt-10 -158.68 -54.83 0.07 Allowed 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 130.915 3.686 . . . . 1.72 104.046 -178.099 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -62.63 -57.64 10.34 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.801 -1.09 . . . . 3.37 109.105 173.683 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -59.13 -41.52 88.42 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 110.061 -0.348 . . . . 3.5 110.061 -175.334 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -47.88 -41.94 25.55 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.621 0.6 . . . . 3.54 112.621 170.549 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 tp -63.24 -52.4 62.29 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 119.115 0.871 . . . . 2.79 108.807 -175.018 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -68.51 -48.52 71.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.436 -0.802 . . . . 1.7 109.242 -173.307 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 68.2 m -56.67 -54.87 41.09 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 123.909 0.884 . . . . 1.96 111.178 177.34 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -80.68 -59.38 2.7 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 117.792 0.269 . . . . 2.48 111.627 -170.375 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -81.3 -48.51 11.9 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 112.404 0.52 . . . . 3.12 112.404 -160.075 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mp -64.77 -24.43 1.21 Allowed Pre-proline 0 CA--C 1.534 0.361 0 N-CA-C 113.727 1.01 . . . . 3.57 113.727 -164.178 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.79 -10.72 18.0 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.027 -2.072 . . . . 2.08 112.365 -82.837 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 70.1 t60 -95.98 -34.95 11.59 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.02 1.328 . . . . 3.74 111.15 179.761 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 33.5 tp -55.08 -66.6 0.38 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-N 119.014 0.824 . . . . 1.79 110.313 -169.078 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 80.3 mt -92.14 156.33 17.42 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 105.984 -1.858 . . . . 2.08 105.984 152.186 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.45 -166.19 2.35 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 106.42 -1.696 . . . . 6.87 106.42 -170.945 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 57.53 33.38 23.19 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 122.651 1.215 . . . . 4.7 109.456 -177.356 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 21.1 m -56.71 -29.98 31.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 125.756 1.622 . . . . 3.15 111.328 -166.564 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -41.78 -46.38 4.87 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 123.688 0.661 . . . . 3.36 111.737 172.869 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 2.4 t -93.7 19.72 8.35 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.626 0.77 . . . . 2.81 112.48 -174.389 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -42.65 -41.65 3.18 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 124.313 1.045 . . . . 1.98 111.201 178.693 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -34.58 -44.54 0.21 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.05 2.14 . . . . 4.22 113.722 173.569 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -65.11 -43.16 92.91 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.001 -1.062 . . . . 3.67 110.844 178.074 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? -65.67 -44.94 84.75 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 118.539 -0.743 . . . . 5.37 109.283 177.431 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -47.15 -53.55 12.71 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 119.196 0.907 . . . . 2.77 109.651 170.628 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -61.38 -39.26 90.0 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 122.182 -0.324 . . . . 4.57 111.568 -178.531 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 32.4 t -61.52 -41.96 98.1 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.846 0.859 . . . . 2.3 111.754 173.852 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 33.9 mt -77.94 -53.52 7.36 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 124.305 1.042 . . . . 2.55 110.254 -171.606 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.256 17.9 t0 -59.41 -8.88 1.98 Allowed 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 127.011 2.124 . . . . 1.42 116.535 -164.09 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.0 m -33.76 -19.26 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 C-N-CA 131.111 3.764 . . . . 2.51 119.414 -131.66 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -58.39 -28.2 64.96 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 120.962 1.71 . . . . 3.69 111.321 158.083 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 59.42 62.34 1.8 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.427 1.491 . . . . 4.97 110.991 175.401 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -103.18 -15.34 16.05 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.202 1.801 . . . . 1.96 111.591 175.21 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 11.8 m 73.79 21.92 2.62 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.783 1.633 . . . . 2.38 113.464 -175.254 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -129.52 109.7 11.25 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 125.36 1.464 . . . . 3.5 107.592 162.135 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -77.77 106.38 9.56 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.847 -1.168 . . . . 2.16 107.847 176.931 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 12.0 ptmt -85.54 -178.46 6.68 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 126.551 1.94 . . . . 4.89 112.115 -174.803 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -75.65 82.55 2.65 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 124.591 1.156 . . . . 5.01 108.284 -172.539 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 96.53 47.79 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.314 1 C-N-CA 133.554 4.742 . . . . 2.51 108.295 178.088 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -89.63 -60.93 1.81 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 107.934 -1.136 . . . . 1.94 107.934 120.467 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -38.71 -53.67 1.63 Allowed 'General case' 0 C--N 1.344 0.358 0 C-N-CA 127.049 2.14 . . . . 4.18 111.529 -174.172 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 77' ' ' TRP . . . . . 0.611 ' CE2' ' CZ2' ' A' ' 77' ' ' TRP . 43.0 t90 -43.4 -38.42 2.75 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 125.989 1.716 . . . . 5.45 112.42 -171.292 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -38.85 -48.66 1.57 Allowed 'General case' 0 C--N 1.342 0.25 0 C-N-CA 123.866 0.866 . . . . 6.39 111.746 174.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 6.0 tp -52.12 -48.05 65.01 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.033 0.533 . . . . 1.85 111.504 -177.271 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 64.5 mt -62.16 -30.68 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 N-CA-C 107.529 -1.285 . . . . 2.45 107.529 -178.255 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 81' ' ' GLY . . . . . 0.577 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -69.33 -52.94 19.75 Favored Glycine 0 CA--C 1.496 -1.154 0 C-N-CA 124.894 1.235 . . . . 1.53 111.392 179.965 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -50.54 -63.22 1.19 Allowed 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 107.192 -1.41 . . . . 3.37 107.192 174.047 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . 0.289 4.5 pp -58.98 -34.05 71.38 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.941 0.719 . . . . 3.24 112.941 -173.645 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.91 -38.62 73.1 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 118.265 -0.874 . . . . 2.21 111.966 174.939 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.315 0.0 OUTLIER -80.39 -41.12 25.2 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-O 116.101 -1.904 . . . . 4.53 112.189 166.451 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -45.62 -36.05 4.5 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 121.331 1.878 . . . . 2.62 112.914 -169.862 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 10.5 tt -44.05 -50.85 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 CA-C-N 118.316 0.507 . . . . 2.02 111.969 171.914 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.44 -50.18 8.0 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.861 2.464 . . . . 5.47 112.613 175.133 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 10.5 tttm -63.49 131.21 47.41 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.04 1.736 . . . . 6.76 112.313 -168.68 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -81.68 -60.93 2.08 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 109.979 -0.378 . . . . 5.57 109.979 161.0 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -152.8 36.62 0.5 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.147 0.795 . . . . 7.58 113.147 178.459 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 92' ' ' ASP . . . . . 0.41 ' OD1' ' NZ ' ' A' ' 72' ' ' LYS . 36.2 t70 -66.79 77.08 0.12 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.973 0.909 . . . . 6.95 111.705 172.036 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 20.6 tp -150.38 -81.08 0.11 Allowed 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 106.927 -1.508 . . . . 5.74 106.927 168.008 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 154.77 174.64 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 130.317 3.447 . . . . 8.13 106.552 -177.536 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 5.5 tp -151.87 68.86 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 121.656 0.741 . . . . 9.6 109.631 -179.565 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 5.0 ttt-85 -170.09 174.76 5.31 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.316 0.646 . . . . 10.47 110.207 173.978 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -178.21 140.82 0.23 Allowed 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 129.614 3.166 . . . . 10.49 105.078 177.893 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt . . . . . 0 C--O 1.254 1.296 0 N-CA-C 103.955 -2.609 . . . . 11.36 103.955 151.907 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 N--CA 1.444 -0.756 0 CA-C-O 119.593 -0.242 . . . . 4.3 110.457 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -71.62 106.99 2.08 Favored 'Trans proline' 0 N--CA 1.453 -0.902 0 C-N-CA 122.829 2.353 . . . . 2.21 110.757 -174.324 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.5 mt -66.27 162.75 19.43 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.584 1.154 . . . . 1.24 110.089 172.473 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 t -76.31 170.1 16.98 Favored 'General case' 0 C--O 1.226 -0.135 0 O-C-N 121.554 -0.717 . . . . 1.72 109.89 -178.959 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -59.56 -50.21 74.79 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.477 0.711 . . . . 2.0 109.635 -174.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.451 HD12 ' HG2' ' B' ' 45' ' ' GLN . 3.7 mt -62.09 -53.39 56.18 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.55 -1.214 . . . . 1.56 111.696 176.156 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -47.33 -55.66 8.34 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.163 1.385 . . . . 2.28 110.785 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -49.71 -60.16 3.15 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.435 1.494 . . . . 3.94 109.616 173.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.4 p -57.05 -40.5 76.91 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.403 -0.811 . . . . 1.66 112.239 -175.548 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.295 2.8 pp -69.59 -42.2 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 O-C-N 121.819 -0.55 . . . . 0.58 110.248 177.986 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -58.66 -47.65 83.73 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 118.997 0.817 . . . . 3.47 109.804 177.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.9 m -46.03 -45.77 16.18 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.582 1.553 . . . . 1.84 112.745 174.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 32.6 m -79.89 -35.78 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 O-C-N 120.376 -1.453 . . . . 0.73 110.993 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 49.2 t -58.47 -44.23 88.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 118.779 0.718 . . . . 0.57 110.415 176.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.8 t -63.05 -46.53 87.1 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.02 0.827 . . . . 0.62 110.058 177.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 16.2 m -59.33 -49.48 77.65 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.293 0.497 . . . . 0.67 109.774 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -46.73 -52.07 14.77 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 124.146 0.978 . . . . 3.52 110.043 168.219 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -57.75 -50.18 74.08 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 118.566 0.621 . . . . 3.39 110.21 -174.085 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -55.79 -58.53 7.46 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 122.14 -0.35 . . . . 2.49 110.798 174.562 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -62.98 -23.23 67.33 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 112.377 0.51 . . . . 2.66 112.377 -177.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.46 -26.58 38.23 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 120.996 -1.065 . . . . 0.81 110.338 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 71.4 ttp85 -80.43 -25.73 38.8 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.888 0.875 . . . . 4.37 112.317 -177.505 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -39.06 -60.59 0.85 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.12 1.368 . . . . 2.3 112.974 -178.633 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -118.84 167.5 11.64 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 127.447 2.299 . . . . 2.37 106.354 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 0.74 108.73 0.01 OUTLIER Glycine 0 CA--C 1.536 1.383 0 C-N-CA 127.021 2.248 . . . . 1.31 115.636 171.463 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 66.13 103.25 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.928 1.455 . . . . 4.65 114.928 165.317 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.5 pttt -62.92 64.71 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.816 2.047 . . . . 4.01 110.973 166.212 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -177.2 -30.08 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.066 2.146 . . . . 3.61 110.599 -158.655 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 34.1 t -134.83 148.69 50.23 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 121.307 -0.871 . . . . 3.08 111.964 166.792 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -83.99 120.04 25.64 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 125.501 1.521 . . . . 1.94 107.473 165.078 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.4 m -84.48 169.6 14.34 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.599 1.56 . . . . 3.04 108.176 166.396 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.21 -43.64 91.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 O-C-N 120.854 -1.154 . . . . 2.01 112.215 -170.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -64.63 -51.45 62.54 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 108.989 -0.745 . . . . 2.2 108.989 -178.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -37.97 -54.31 1.31 Allowed 'General case' 0 C--O 1.232 0.136 0 C-N-CA 124.965 1.306 . . . . 1.85 112.139 166.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.21 -51.96 67.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 122.009 -0.432 . . . . 3.05 109.849 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt -55.46 -39.55 70.49 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 122.069 -0.394 . . . . 3.71 110.927 -179.121 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -55.42 -40.14 71.1 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.609 0.64 . . . . 2.56 111.851 173.474 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -62.88 -51.17 68.03 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 119.52 1.055 . . . . 2.6 108.664 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -69.01 -38.75 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 CA-C-N 115.991 -0.55 . . . . 1.06 110.169 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 78.0 m -63.15 -42.76 99.51 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.666 0.786 . . . . 1.34 111.224 175.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -79.84 -53.81 6.42 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 119.283 -0.389 . . . . 2.14 110.308 -168.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -98.0 -127.64 0.16 Allowed 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 109.858 -0.423 . . . . 3.67 109.858 171.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.487 HD22 ' H ' ' A' ' 46' ' ' LEU . 3.2 mm? 29.7 59.56 0.84 Allowed Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 127.268 2.227 . . . . 2.17 114.374 -173.52 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.31 -42.54 3.77 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 122.488 2.125 . . . . 1.74 111.864 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -122.96 -20.6 5.75 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 113.618 0.97 . . . . 3.1 113.618 -170.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.971 HD23 ' HG ' ' A' ' 83' ' ' LEU . 2.0 mp -64.84 -97.2 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 118.898 0.772 . . . . 1.42 111.212 172.7 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 75.5 mt -88.74 71.66 8.71 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 120.87 -1.144 . . . . 2.27 109.31 -163.693 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.5 ttmm -56.06 156.03 5.84 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.155 -0.93 . . . . 6.01 110.845 170.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.0 t0 57.0 66.06 1.25 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 123.496 1.617 . . . . 4.82 109.987 -157.877 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.4 m -68.19 -3.3 2.36 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 112.851 -1.977 . . . . 2.0 111.616 162.244 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -75.4 -55.93 4.89 Favored Glycine 0 C--N 1.343 0.948 0 N-CA-C 108.136 -1.986 . . . . 1.75 108.136 176.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.5 t -74.08 52.06 0.43 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.158 1.383 . . . . 2.1 110.61 173.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -72.09 -45.57 60.14 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 125.015 1.326 . . . . 1.2 108.339 170.08 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.79 -38.14 74.95 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.561 1.144 . . . . 4.72 110.248 -164.411 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -54.07 -55.06 31.06 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.415 1.086 . . . . 3.16 111.669 167.778 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -51.36 68.57 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 107.653 -1.24 . . . . 2.92 107.653 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -46.94 -53.74 11.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.441 0.696 . . . . 1.49 110.698 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -59.56 -26.26 65.23 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.91 0.707 . . . . 3.23 112.91 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.2 m -79.76 -48.59 13.35 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.951 0.9 . . . . 2.3 111.466 178.089 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.4 mp -62.19 -48.82 78.33 Favored 'General case' 0 C--N 1.341 0.209 0 N-CA-C 109.381 -0.6 . . . . 1.6 109.381 177.379 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -74.33 73.07 1.83 Allowed 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 107.84 -1.17 . . . . 1.9 107.84 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 20.9 m -49.47 -30.34 4.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.484 1.113 . . . . 1.79 113.09 -173.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -87.33 -21.21 25.85 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.837 1.655 . . . . 2.54 112.645 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 55.16 50.88 14.24 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.509 1.124 . . . . 3.92 109.338 -176.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 34.1 p30 -94.09 -18.05 22.2 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.953 1.701 . . . . 1.94 110.612 172.552 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.9 m 70.4 17.21 6.98 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.371 1.468 . . . . 1.79 113.453 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -107.21 107.75 18.85 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 104.094 -2.558 . . . . 3.79 104.094 155.441 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.57 96.74 8.17 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 103.455 -2.794 . . . . 1.03 103.455 171.202 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.59 162.18 16.07 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.909 -1.145 . . . . 5.17 107.909 176.224 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -39.58 -52.49 2.19 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 123.578 0.751 . . . . 6.64 111.628 176.129 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -66.81 -27.58 67.67 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 113.496 0.924 . . . . 2.62 113.496 -176.132 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -79.73 -56.44 4.28 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.628 -1.249 . . . . 2.02 107.628 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -45.5 -50.48 12.74 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.42 1.088 . . . . 3.26 111.209 173.003 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.595 ' CH2' ' CH2' ' B' ' 77' ' ' TRP . 2.5 t-105 -39.78 -41.1 1.06 Allowed 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.426 1.89 . . . . 4.13 111.77 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 21.7 mmt180 -39.86 -48.12 2.25 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 123.651 0.781 . . . . 4.43 111.599 176.563 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.2 tp -48.64 -46.18 39.61 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.681 0.793 . . . . 0.88 110.405 -178.13 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 66.8 mt -63.46 -29.36 47.05 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 107.913 -1.143 . . . . 1.62 107.913 -172.467 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.488 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -69.98 -45.37 57.34 Favored Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 109.743 -1.343 . . . . 1.54 109.743 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -68.42 -48.19 65.27 Favored 'General case' 0 N--CA 1.437 -1.096 0 N-CA-C 106.667 -1.605 . . . . 2.5 106.667 -175.896 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.971 ' HG ' HD23 ' A' ' 49' ' ' LEU . 4.3 mp -42.04 -58.92 1.92 Allowed 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 118.613 0.642 . . . . 2.37 110.945 166.564 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.99 -19.73 53.96 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 113.133 0.79 . . . . 1.2 113.133 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -80.45 -52.74 7.29 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.757 1.623 . . . . 1.61 109.761 174.695 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -58.43 -29.15 65.9 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 127.305 2.242 . . . . 2.63 110.962 -171.317 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.0 tp -40.59 -38.2 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 124.534 1.134 . . . . 1.62 111.766 168.491 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.23 -43.73 3.05 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.462 1.105 . . . . 5.16 111.371 177.304 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 49.0 tttp . . . . . 0 C--O 1.223 -0.341 0 C-N-CA 123.765 0.826 . . . . 3.53 110.414 177.828 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.526 ' HB3' ' HB3' ' B' ' 10' ' ' GLU . 1.7 mt . . . . . 0 CA--C 1.55 0.952 0 N-CA-C 113.884 1.068 . . . . 2.19 113.884 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 4.2 t -89.05 -163.72 1.03 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.316 1.446 . . . . 1.63 113.464 173.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -65.14 -67.29 0.45 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.98 2.112 . . . . 2.1 113.057 -172.467 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 16.3 mt -57.16 -41.46 79.25 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 120.622 -1.299 . . . . 1.05 109.976 178.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 10' ' ' GLU . . . . . 0.62 ' HG2' HD22 ' A' ' 49' ' ' LEU . 99.2 mt-10 -49.77 -42.97 47.8 Favored 'General case' 0 CA--C 1.563 1.473 0 C-N-CA 123.794 0.838 . . . . 3.15 112.512 167.864 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -61.05 -46.98 88.5 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 119.677 -1.889 . . . . 3.88 110.124 172.061 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 54.1 p -61.23 -36.96 81.36 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.613 -0.68 . . . . 1.9 111.121 -175.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.283 2.9 pp -68.63 -43.05 83.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 O-C-N 121.587 -0.696 . . . . 1.04 110.476 171.588 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.07 -43.55 82.23 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.263 0.938 . . . . 4.3 110.845 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.38 -28.77 68.89 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.1 0.56 . . . . 1.42 111.735 -174.694 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 34.3 m -81.35 -36.84 15.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 O-C-N 120.888 -1.132 . . . . 0.93 111.276 168.594 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 39.5 t -56.89 -43.92 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 118.731 0.696 . . . . 1.3 110.688 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.6 t -59.49 -50.53 73.58 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.59 0.632 . . . . 1.65 110.268 176.672 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.9 m -53.83 -55.03 30.31 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.395 -0.816 . . . . 1.05 110.351 177.056 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -42.84 -56.7 3.12 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 123.929 0.891 . . . . 4.42 110.3 171.856 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -57.01 -52.15 66.42 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.791 0.436 . . . . 3.62 110.996 -177.256 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 75.7 p -56.64 -32.9 65.79 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.334 0.494 . . . . 2.62 112.334 -177.341 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -81.1 -47.2 13.84 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 118.844 0.747 . . . . 2.71 111.534 171.827 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.32 -40.89 68.41 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 120.769 -1.207 . . . . 1.02 109.854 -175.352 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -17.19 64.57 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 117.234 -1.365 . . . . 4.75 113.097 -175.379 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -47.75 -60.87 2.26 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.987 1.267 . . . . 2.22 114.262 -168.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -79.54 -35.38 39.98 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 118.65 2.833 . . . . 3.28 118.65 -158.442 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -81.6 -92.94 0.52 Allowed Glycine 0 C--N 1.34 0.766 1 C-N-CA 131.448 4.356 . . . . 3.13 114.308 7.57 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.1 mmt-85 49.15 73.12 0.25 Allowed 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.876 -1.157 . . . . 5.51 107.876 -153.43 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -78.89 49.78 0.95 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.962 1.705 . . . . 3.71 110.949 -175.035 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -161.03 -48.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 126.73 2.012 . . . . 4.23 107.448 -168.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 29.8 m -116.35 140.21 49.58 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 124.676 1.19 . . . . 3.05 110.956 -174.853 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 6.3 mp -93.59 120.68 34.17 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.711 1.204 . . . . 2.36 109.249 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 7.1 m -83.38 171.55 13.38 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.399 -0.963 . . . . 2.41 108.399 173.475 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 7.1 p -85.37 51.5 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 120.098 -1.626 . . . . 2.67 110.507 177.428 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -158.53 57.25 0.45 Allowed 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 106.124 -1.806 . . . . 2.06 106.124 157.584 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -176.29 -57.6 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 102.024 -3.324 . . . . 1.58 102.024 -167.451 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -62.91 -60.73 3.07 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.914 -1.039 . . . . 2.18 110.479 171.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -58.78 -39.17 80.28 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.984 -0.376 . . . . 3.51 109.984 -176.889 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -54.39 -34.3 60.96 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.862 -0.59 . . . . 2.56 112.428 175.337 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 30.8 tp -67.44 -45.77 75.05 Favored 'General case' 0 C--N 1.338 0.092 0 CA-C-N 119.754 1.161 . . . . 1.92 109.045 -177.419 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 42' ' ' VAL . . . . . 0.557 ' HA ' HD23 ' B' ' 46' ' ' LEU . 5.6 m -68.67 -45.49 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 N-CA-C 110.009 -0.367 . . . . 0.99 110.009 -177.391 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 97.7 m -55.56 -51.15 68.03 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.431 0.692 . . . . 1.09 111.111 174.682 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -80.04 -57.49 3.61 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.094 0.558 . . . . 2.13 111.641 -168.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 45' ' ' GLN . . . . . 0.451 ' HG2' HD12 ' A' ' 9' ' ' LEU . 34.9 tp60 -80.23 -54.21 5.95 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 112.817 0.673 . . . . 3.84 112.817 -158.512 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 46' ' ' LEU . . . . . 0.557 HD23 ' HA ' ' B' ' 42' ' ' VAL 0.269 1.0 OUTLIER -39.37 -49.57 4.81 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 116.053 1.872 . . . . 2.45 116.053 -136.425 . . . . . . . . 4 4 . 1 . 001 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -84.34 -28.17 1.21 Allowed 'Trans proline' 0 N--CA 1.448 -1.19 0 CA-C-N 120.672 1.276 . . . . 2.71 108.871 -36.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -100.82 -37.4 8.71 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 125.291 1.437 . . . . 2.56 110.047 -171.335 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.438 HD23 ' HB2' ' B' ' 83' ' ' LEU . 43.9 tp -35.31 -58.95 0.55 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.99 1.716 . . . . 2.04 115.235 -171.762 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.89 -175.24 3.12 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.408 -0.96 . . . . 2.71 108.408 168.396 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.57 169.88 20.47 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 124.97 1.308 . . . . 5.74 108.04 -163.39 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 11.7 t0 58.9 67.1 0.96 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 123.443 1.592 . . . . 4.24 109.11 -171.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 16.1 m -83.54 -12.1 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 112.213 -2.267 . . . . 1.79 109.897 164.681 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -64.96 -61.86 5.46 Favored Glycine 0 C--N 1.34 0.803 0 N-CA-C 108.884 -1.686 . . . . 2.42 108.884 176.083 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 35.5 t -78.3 57.28 1.86 Allowed 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.943 -1.132 . . . . 2.82 107.943 173.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.419 HD23 HG21 ' B' ' 42' ' ' VAL . 2.8 tm? -60.93 -44.29 97.43 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 119.67 -1.894 . . . . 1.08 108.116 173.862 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -65.03 -24.02 67.37 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.256 1.022 . . . . 4.32 112.25 -166.637 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -50.95 -60.12 3.42 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.647 1.179 . . . . 2.35 109.585 161.592 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.47 -51.59 68.82 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.106 -1.072 . . . . 4.01 108.106 177.631 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.42 -60.47 1.93 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.303 0.956 . . . . 1.67 110.618 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -61.66 -36.38 80.65 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 122.377 -0.202 . . . . 3.16 110.935 -175.328 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 18.5 m -66.24 -32.48 73.92 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.4 0.518 . . . . 2.28 112.4 175.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 22.0 mt -80.65 -43.8 19.86 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.789 1.236 . . . . 1.54 111.158 -177.42 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -66.45 -7.15 17.63 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 129.905 3.282 . . . . 1.59 116.787 -166.52 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 17.1 m -36.95 -19.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 128.629 2.771 . . . . 1.99 117.844 -160.459 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -69.12 -1.3 7.4 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 120.689 1.586 . . . . 4.01 112.043 170.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 82.43 -29.56 0.1 Allowed 'General case' 0 C--N 1.342 0.241 0 C-N-CA 127.613 2.365 . . . . 4.6 113.284 161.385 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -50.8 109.16 0.29 Allowed 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.421 -0.955 . . . . 3.31 108.421 160.489 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 41.0 p -66.85 66.93 0.06 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.31 1.844 . . . . 2.75 111.469 -179.386 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -167.03 120.28 0.98 Allowed 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 128.472 2.709 . . . . 3.0 104.828 -167.727 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -87.55 97.9 11.1 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 107.514 -1.291 . . . . 1.13 107.514 -175.381 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 4.0 tttt -80.25 167.74 19.92 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 122.949 0.5 . . . . 4.1 109.691 -165.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -83.15 54.6 2.83 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.536 -0.727 . . . . 4.8 110.065 175.535 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -167.37 50.73 0.06 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.879 1.271 . . . . 2.2 107.713 111.911 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -93.21 -60.69 1.73 Allowed 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.286 -2.133 . . . . 1.85 108.34 140.705 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.467 ' CZ ' HD11 ' B' ' 80' ' ' ILE . 1.3 t80 -41.37 -50.45 3.79 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 126.135 1.774 . . . . 3.44 111.53 -173.621 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.595 ' CH2' ' CH2' ' A' ' 77' ' ' TRP . 25.8 t-105 -39.02 -45.99 1.3 Allowed 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 125.787 1.635 . . . . 4.81 111.78 178.852 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 40.9 mtt-85 -39.42 -52.4 2.08 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.374 1.07 . . . . 5.58 111.681 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 11.9 tp -52.17 -42.29 63.3 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.399 0.679 . . . . 1.09 111.384 -177.476 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.467 HD11 ' CZ ' ' B' ' 76' ' ' TYR . 4.1 mp -62.82 -33.47 60.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 N-CA-C 107.063 -1.458 . . . . 2.91 107.063 -175.652 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.485 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -67.41 -44.03 85.6 Favored Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 110.151 -1.18 . . . . 1.33 110.151 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -68.38 -54.75 15.12 Favored 'General case' 0 N--CA 1.437 -1.077 0 N-CA-C 108.185 -1.043 . . . . 2.34 108.185 -176.895 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.438 ' HB2' HD23 ' B' ' 49' ' ' LEU . 4.6 pp -57.52 -38.1 74.11 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.608 1.095 . . . . 1.94 111.924 177.094 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.28 -58.57 7.39 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 118.859 0.754 . . . . 1.66 109.912 173.071 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -51.79 -39.33 58.46 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.66 1.584 . . . . 1.49 111.802 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -60.22 -24.15 64.62 Favored 'General case' 0 C--N 1.338 0.072 0 C-N-CA 125.063 1.345 . . . . 3.09 111.431 -176.788 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 5.0 tt -52.05 -39.45 26.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 118.897 0.771 . . . . 0.93 109.865 171.14 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 18.4 tpt180 -84.94 -54.46 4.64 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.747 1.219 . . . . 4.77 112.916 169.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 72.9 tttt . . . . . 0 CA--C 1.535 0.376 0 C-N-CA 123.938 0.895 . . . . 5.0 112.397 -159.166 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 . . . . . 0 CA--C 1.538 0.487 0 N-CA-C 108.357 -0.979 . . . . 5.99 108.357 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -71.96 154.98 58.04 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.306 2.004 . . . . 2.66 109.718 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.7 mt -118.06 176.83 5.03 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.856 1.262 . . . . 1.42 109.414 -169.874 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.482 HG22 ' CG ' ' A' ' 10' ' ' GLU . 1.0 OUTLIER -74.09 159.03 33.19 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.107 -0.996 . . . . 1.89 110.077 178.835 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -43.4 -56.52 3.53 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.237 1.015 . . . . 3.05 112.188 -178.405 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.8 mt -59.16 -47.38 85.53 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.178 -0.915 . . . . 1.31 110.818 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.482 ' CG ' HG22 ' A' ' 7' ' ' THR . 83.9 mt-10 -53.08 -50.92 63.42 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.354 1.061 . . . . 2.19 111.569 176.071 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -54.85 -53.06 60.23 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.488 0.661 . . . . 4.23 110.011 175.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 84.8 p -62.07 -44.03 97.56 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.867 -0.521 . . . . 1.6 111.69 -174.943 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.452 HG21 HD12 ' B' ' 83' ' ' LEU . 1.8 pp -65.38 -40.6 88.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 117.695 -1.145 . . . . 0.78 110.023 175.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -51.52 -55.84 16.77 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 119.779 1.172 . . . . 2.91 110.033 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.7 t -58.42 -36.82 74.19 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.469 0.544 . . . . 1.32 112.469 -171.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.3 m -77.67 -37.2 23.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 O-C-N 120.629 -1.294 . . . . 0.72 111.148 175.055 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.5 t -61.09 -43.55 96.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 124.394 1.078 . . . . 0.8 110.18 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -64.87 -49.35 70.86 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.576 0.625 . . . . 0.63 110.339 176.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 39.7 m -53.3 -44.62 68.49 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.307 0.643 . . . . 0.83 110.055 176.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -59.89 -61.97 2.22 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.037 0.935 . . . . 3.28 110.512 175.021 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -62.52 -41.28 98.75 Favored 'General case' 0 C--O 1.233 0.204 0 O-C-N 121.163 -0.96 . . . . 5.39 111.89 -171.053 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.1 t -65.6 -22.13 66.65 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 119.365 -0.35 . . . . 2.2 111.247 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -81.35 -43.09 19.55 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 118.415 0.552 . . . . 3.01 111.059 166.154 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.08 -28.78 62.92 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 126.304 1.842 . . . . 1.13 111.929 -166.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 33.6 ptt85 -66.38 -34.21 77.45 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.365 1.066 . . . . 3.59 112.383 177.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -41.18 -60.09 1.33 Allowed 'General case' 0 C--N 1.345 0.401 0 C-N-CA 124.604 1.162 . . . . 2.05 112.962 -163.586 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -106.05 75.75 1.12 Allowed 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 104.931 -2.248 . . . . 2.95 104.931 -178.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 60.21 164.16 0.16 Allowed Glycine 0 CA--C 1.533 1.204 0 C-N-CA 125.449 1.499 . . . . 1.6 114.478 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 28.72 100.38 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 128.104 2.562 . . . . 4.77 114.839 165.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.9 pttt -69.38 65.06 0.17 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.317 1.847 . . . . 3.37 112.741 -177.296 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -169.31 -45.08 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 127.571 2.348 . . . . 3.82 108.066 -175.166 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.96 110.92 19.24 Favored 'General case' 0 C--O 1.242 0.659 0 C-N-CA 127.548 2.339 . . . . 1.68 110.193 171.66 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.9 mp -91.3 124.52 35.56 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 118.776 -0.631 . . . . 2.55 109.549 172.03 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.9 t -100.05 -179.88 4.28 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 122.007 0.908 . . . . 2.48 111.109 172.456 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.6 m -57.59 -35.97 52.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 CA-C-N 114.958 -1.019 . . . . 2.94 112.923 -167.123 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -73.18 -50.72 21.0 Favored 'General case' 0 C--O 1.223 -0.316 0 N-CA-C 108.373 -0.973 . . . . 2.07 108.373 -177.519 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 62.3 mt-10 -46.09 -48.17 17.11 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.138 0.975 . . . . 1.86 110.901 172.327 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.17 -58.77 7.08 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.897 -0.592 . . . . 2.85 110.138 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.419 ' HA ' HG22 ' A' ' 42' ' ' VAL . 11.0 ttmm -58.0 -37.05 73.55 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 118.243 0.474 . . . . 2.44 111.577 -175.526 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -53.33 -44.98 68.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.735 0.814 . . . . 3.23 110.547 173.721 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -65.57 -50.28 65.71 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 119.441 1.019 . . . . 2.44 108.699 -172.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.419 HG22 ' HA ' ' A' ' 39' ' ' LYS . 31.0 m -62.66 -41.31 91.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 114.767 -1.106 . . . . 1.38 108.782 -173.478 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 96.6 m -62.19 -50.13 73.02 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.102 0.961 . . . . 2.32 111.235 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -62.77 -54.29 41.39 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.219 1.408 . . . . 3.71 111.818 -168.454 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -149.36 66.86 1.01 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 118.185 0.448 . . . . 4.36 110.336 -177.483 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.427 ' N ' ' CD ' ' A' ' 47' ' ' PRO . 2.5 tp -155.04 29.13 0.04 OUTLIER Pre-proline 0 CA--C 1.544 0.74 0 N-CA-C 114.049 1.129 . . . . 1.88 114.049 173.323 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 46' ' ' LEU . 58.8 Cg_endo -64.12 -46.14 8.69 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.943 2.429 . . . . 1.76 112.932 -166.082 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 -79.6 -45.53 18.98 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.47 -0.937 . . . . 5.16 108.47 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.553 ' CD2' ' HB2' ' A' ' 83' ' ' LEU . 3.4 tp -66.36 -44.24 83.74 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.455 -0.793 . . . . 1.55 111.996 -168.722 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.7 mt -129.16 75.02 1.62 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 119.191 0.905 . . . . 2.57 109.628 165.243 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.96 157.51 5.67 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.164 -0.926 . . . . 5.3 109.64 165.595 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 42.9 t0 61.21 74.05 0.46 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 123.378 1.561 . . . . 4.77 108.838 -164.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.2 m -76.97 4.38 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 CA-C-N 113.079 -1.873 . . . . 2.45 110.582 163.65 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.19 -66.89 1.69 Allowed Glycine 0 C--N 1.341 0.83 0 N-CA-C 107.924 -2.07 . . . . 1.92 107.924 179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 29.2 t -76.28 63.36 1.9 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-O 123.227 1.489 . . . . 1.9 110.23 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -77.83 -31.42 51.59 Favored 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 127.978 2.511 . . . . 1.31 108.323 174.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -46.41 -51.16 15.57 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 127.102 2.161 . . . . 4.12 112.206 172.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -55.78 -53.97 50.16 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.436 -0.579 . . . . 2.92 109.436 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.4 -48.75 78.26 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 109.119 -0.697 . . . . 3.3 109.119 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 8.2 ttt -48.89 -53.73 18.33 Favored 'General case' 0 C--O 1.227 -0.099 0 C-N-CA 123.861 0.864 . . . . 2.32 109.976 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -60.19 -45.78 91.97 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 119.798 -0.144 . . . . 3.13 111.003 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 26.6 m -60.67 -41.45 95.1 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.291 0.478 . . . . 2.41 112.291 177.398 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.8 mt -71.39 -56.17 6.51 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.178 0.991 . . . . 1.84 110.77 -176.139 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -75.09 82.41 2.28 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.356 0.663 . . . . 2.42 109.83 -170.271 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.9 m -45.04 -39.92 2.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 124.492 1.117 . . . . 1.67 113.548 -173.862 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 23.9 p-10 -97.46 -4.32 38.34 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.93 0.715 . . . . 2.61 112.93 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 51.03 50.1 19.81 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.325 1.85 . . . . 3.31 111.243 177.82 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.9 p30 -82.2 -42.32 19.14 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.468 0.707 . . . . 2.28 110.291 176.901 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.4 m 99.92 16.56 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 129.652 3.181 . . . . 1.74 112.112 -170.436 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 70.8 mt-10 -116.23 108.62 16.35 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 105.145 -2.168 . . . . 2.89 105.145 161.268 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -79.04 87.42 4.83 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 102.312 -3.218 . . . . 1.16 102.312 168.783 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.36 145.9 50.0 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.841 -1.541 . . . . 3.38 106.841 177.511 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -37.61 -51.78 1.2 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.775 1.398 . . . . 5.39 114.775 -169.385 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -73.3 -26.5 61.09 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.519 1.054 . . . . 1.67 112.167 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -63.79 -60.36 3.39 Favored 'General case' 0 C--N 1.341 0.238 0 N-CA-C 108.338 -0.986 . . . . 2.34 108.338 164.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -50.59 -44.41 56.88 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.253 0.621 . . . . 3.19 110.604 -175.239 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.671 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 41.7 t90 -44.32 -38.22 3.78 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 125.498 1.519 . . . . 4.32 111.887 -178.375 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 13.2 mmt85 -39.72 -46.6 1.9 Allowed 'General case' 0 C--N 1.341 0.238 0 C-N-CA 124.06 0.944 . . . . 4.01 111.619 173.075 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 12.7 tp -49.58 -50.59 41.85 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.974 0.909 . . . . 0.86 111.492 178.813 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.6 mp -64.7 -24.21 35.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 107.616 -1.253 . . . . 1.75 107.616 -176.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.59 ' CA ' ' CZ2' ' B' ' 77' ' ' TRP . . . -69.79 -55.21 9.94 Favored Glycine 0 CA--C 1.49 -1.525 0 C-N-CA 125.334 1.445 . . . . 1.32 111.822 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.69 -47.19 77.21 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 107.389 -1.337 . . . . 2.39 107.389 -177.476 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.553 ' HB2' ' CD2' ' A' ' 49' ' ' LEU . 4.0 pp -74.09 -39.97 63.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 115.098 1.518 . . . . 2.11 115.098 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.99 -31.95 63.51 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 121.236 -0.915 . . . . 1.2 110.228 170.935 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -79.7 -42.41 24.74 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 124.809 1.244 . . . . 1.93 111.461 175.255 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -45.36 -42.15 9.71 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 126.123 1.769 . . . . 2.93 110.626 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.8 tt -46.46 -32.25 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 123.697 0.799 . . . . 1.65 112.638 178.555 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -121.93 -18.83 6.88 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.925 1.083 . . . . 4.94 113.925 177.431 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.4 tttp . . . . . 0 CA--C 1.534 0.328 0 CA-C-O 123.177 1.465 . . . . 3.38 109.139 175.835 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.3 mt . . . . . 0 CA--C 1.539 0.542 0 CA-C-O 119.082 -0.485 . . . . 2.97 110.364 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.617 HG22 ' CD ' ' B' ' 10' ' ' GLU . 15.3 t -73.98 -154.35 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.543 0.737 . . . . 1.94 109.924 156.885 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -84.13 -62.02 1.67 Allowed 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 121.073 -1.017 . . . . 3.1 111.866 -164.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 mt -47.08 -43.8 20.58 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 120.611 1.55 . . . . 1.26 111.715 168.283 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 10' ' ' GLU . . . . . 0.617 ' CD ' HG22 ' B' ' 7' ' ' THR . 90.6 mt-10 -53.83 -44.58 70.36 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.541 1.136 . . . . 3.07 111.676 173.917 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -35.07 63.58 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.026 -1.671 . . . . 3.86 111.705 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 22.9 t -59.14 -47.19 86.19 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.717 0.807 . . . . 1.81 110.551 177.438 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.263 2.2 pp -58.05 -37.2 60.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 O-C-N 121.124 -0.985 . . . . 1.14 111.522 172.232 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -58.4 -55.17 38.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.663 0.665 . . . . 2.98 110.137 174.952 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . 0.251 4.0 t -54.2 -33.27 57.83 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.247 0.931 . . . . 1.37 112.617 -172.042 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 33.9 m -78.43 -44.35 26.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 119.008 0.822 . . . . 1.08 111.522 173.082 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 38.2 t -53.23 -46.74 56.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-O 119.025 -0.512 . . . . 1.14 110.491 177.423 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 15.3 t -62.38 -45.89 91.08 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.15 0.886 . . . . 1.46 111.43 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 20.4 m -54.82 -50.65 68.06 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 120.621 1.555 . . . . 1.2 109.788 174.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -55.21 -51.46 66.5 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.207 0.603 . . . . 7.13 110.513 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -64.06 -48.26 76.93 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 126.505 1.922 . . . . 2.73 111.285 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 30.4 p -57.36 -53.29 59.82 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.412 -0.588 . . . . 2.16 109.412 176.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -56.1 -39.57 72.36 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.782 0.719 . . . . 3.07 111.258 175.286 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.32 -29.23 63.77 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.266 1.026 . . . . 1.21 110.851 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -53.74 -32.0 50.51 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 118.105 -0.95 . . . . 4.64 111.494 176.696 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.16 -65.99 0.47 Allowed 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 116.033 1.864 . . . . 2.2 116.033 -143.142 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 71.7 mt-10 -91.72 -74.87 0.49 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.846 0.831 . . . . 3.7 112.319 -175.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.46 163.73 28.9 Favored Glycine 0 C--N 1.336 0.563 0 C-N-CA 126.898 2.19 . . . . 1.96 111.361 167.758 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 38.1 ttm180 36.25 102.93 0.0 OUTLIER 'General case' 0 C--O 1.242 0.709 0 C-N-CA 125.675 1.59 . . . . 4.12 115.155 142.386 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -72.11 34.82 0.06 Allowed 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 115.213 1.56 . . . . 3.36 115.213 -173.254 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -147.8 -50.82 0.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.458 -0.942 . . . . 4.05 108.458 -167.799 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 20.2 m -87.43 130.68 34.58 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-N 115.851 -0.613 . . . . 1.96 109.837 173.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -87.11 160.19 18.64 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.488 1.515 . . . . 2.44 109.186 172.982 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 7.0 m -154.71 169.51 23.75 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.787 0.835 . . . . 2.18 109.699 -167.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.55 120.36 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 101.503 -3.517 . . . . 3.69 101.503 152.274 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -118.1 98.45 6.32 Favored 'General case' 0 C--N 1.331 -0.198 1 C-N-CA 131.944 4.098 . . . . 2.31 107.309 9.889 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -155.03 -52.49 0.09 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 113.592 -1.64 . . . . 2.43 106.852 -175.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -59.3 -49.35 78.18 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 114.132 -1.394 . . . . 1.98 108.314 176.148 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -58.38 -36.83 74.11 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 120.259 -0.576 . . . . 2.77 110.631 -175.569 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -58.0 -38.83 76.89 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 112.512 0.56 . . . . 2.7 112.512 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 7.7 tp -66.75 -47.79 71.15 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 119.207 0.912 . . . . 1.96 108.849 -178.288 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 16.2 m -69.59 -39.01 77.82 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.814 -0.63 . . . . 0.72 109.536 -172.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 97.8 m -64.21 -60.1 3.61 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.446 0.698 . . . . 1.01 110.604 174.9 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -81.83 -57.39 3.45 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.701 0.8 . . . . 1.99 111.939 -166.971 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -82.47 -40.61 20.89 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.709 1.204 . . . . 3.11 112.74 -167.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 18.4 tp -81.0 -19.16 0.27 Allowed Pre-proline 0 CA--C 1.538 0.499 0 N-CA-C 116.095 1.887 . . . . 1.97 116.095 -167.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -30.67 -63.26 0.1 Allowed 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 124.82 3.68 . . . . 1.75 116.938 -126.355 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -80.7 -51.26 8.89 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.87 0.759 . . . . 2.11 112.799 -162.25 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.418 HD23 ' HB2' ' B' ' 83' ' ' LEU . 17.5 tp -18.84 -62.82 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 127.296 2.238 . . . . 1.72 116.329 -175.156 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 pp -117.71 145.22 44.58 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-O 121.354 0.597 . . . . 2.53 109.438 168.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.22 163.2 18.82 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.558 -0.746 . . . . 5.8 111.054 -173.637 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 61.1 t0 57.35 66.73 1.09 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 124.606 2.146 . . . . 3.73 110.236 172.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 18.3 m -71.82 8.59 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.892 0 CA-C-N 110.486 -3.052 . . . . 1.91 111.171 157.26 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -83.59 -55.37 2.87 Favored Glycine 0 C--N 1.343 0.933 0 N-CA-C 108.467 -1.853 . . . . 2.33 108.467 179.138 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 17.2 t -69.05 59.16 0.1 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.811 2.445 . . . . 2.55 109.83 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -86.16 -29.5 23.2 Favored 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 124.257 1.023 . . . . 1.12 110.348 -172.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -57.75 -46.45 84.47 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.845 0.858 . . . . 3.71 110.281 173.59 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -51.51 -60.27 3.33 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.174 0.99 . . . . 2.48 109.832 171.863 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.07 -49.05 74.87 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.846 0.458 . . . . 3.24 109.957 -176.734 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tpt -49.05 -56.84 7.77 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 126.464 1.906 . . . . 3.04 108.614 178.346 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -60.83 -39.73 90.12 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 111.624 0.231 . . . . 3.57 111.624 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.6 t -58.35 -39.05 78.49 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.83 0.452 . . . . 1.64 111.322 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 3.5 mp -74.61 -52.89 10.48 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.549 -0.719 . . . . 1.6 111.956 174.153 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -54.39 -10.9 0.44 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 116.939 2.2 . . . . 1.46 116.939 -163.962 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 28.1 m -34.27 -22.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 130.591 3.557 . . . . 1.49 118.906 -137.855 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -57.26 -24.48 55.1 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.669 1.577 . . . . 2.72 111.608 163.625 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 69.73 56.62 0.33 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.119 1.367 . . . . 3.37 110.871 168.358 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 47.2 p30 -110.6 -12.29 14.36 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.578 1.551 . . . . 1.79 111.898 177.78 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 14.2 m 72.96 1.08 3.9 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.41 1.884 . . . . 2.08 114.154 -174.915 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -105.14 107.15 17.98 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.351 1.46 . . . . 2.98 107.594 169.299 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -80.86 94.86 6.54 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 107.354 -1.35 . . . . 1.03 107.354 -179.364 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 7.6 ptmt -83.38 175.11 10.09 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.03 0.532 . . . . 3.37 110.248 -173.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 40.7 p90 -93.76 52.87 1.74 Allowed 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.616 -0.677 . . . . 4.55 111.996 -175.27 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -155.62 49.54 0.54 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.377 -0.971 . . . . 2.46 108.377 112.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -93.32 -62.09 1.44 Allowed 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 107.475 -1.306 . . . . 2.13 107.475 142.23 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -46.85 -48.28 21.02 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 126.431 1.893 . . . . 4.12 112.156 -172.505 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.671 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 7.5 t-105 -40.34 -40.68 1.22 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.754 1.222 . . . . 4.83 111.916 175.662 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 8.3 mtp-105 -39.54 -46.31 1.72 Allowed 'General case' 0 C--N 1.347 0.462 0 C-N-CA 124.11 0.964 . . . . 4.97 112.681 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.0 tp -54.68 -38.73 67.33 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 118.861 -0.59 . . . . 0.8 110.922 -176.47 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 68.3 mt -58.66 -38.09 69.45 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 N-CA-C 109.17 -0.678 . . . . 1.41 109.17 -177.379 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.575 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -74.2 -42.83 34.41 Favored Glycine 0 CA--C 1.488 -1.655 0 N-CA-C 110.715 -0.954 . . . . 1.25 110.715 -174.264 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 82' ' ' GLU . . . . . 0.405 ' C ' ' HG2' ' B' ' 86' ' ' GLU . 1.8 mm-40 -64.38 -63.27 1.18 Allowed 'General case' 0 N--CA 1.427 -1.616 0 N-CA-C 104.722 -2.325 . . . . 2.18 104.722 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.452 HD12 HG21 ' A' ' 13' ' ' ILE . 3.4 pp -52.12 -38.97 59.16 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.069 0.849 . . . . 1.92 111.948 -176.068 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.2 -60.04 3.86 Favored 'General case' 0 C--N 1.341 0.212 0 N-CA-C 112.237 0.458 . . . . 1.41 112.237 171.639 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.18 -35.15 66.35 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.001 0.819 . . . . 1.57 111.71 -174.112 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.405 ' HG2' ' C ' ' B' ' 82' ' ' GLU . 0.9 OUTLIER -48.62 -34.21 11.24 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 125.719 1.607 . . . . 2.93 110.524 -178.509 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 11.8 tt -39.94 -48.29 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 123.972 0.909 . . . . 1.06 110.839 174.077 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 49.3 ttt180 -85.72 -56.76 3.34 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.339 1.455 . . . . 4.19 111.692 168.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 18.2 mttt . . . . . 0 N--CA 1.461 0.11 0 C-N-CA 124.957 1.303 . . . . 7.35 112.859 -157.592 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 . . . . . 0 N--CA 1.442 -0.865 0 N-CA-C 107.625 -1.25 . . . . 6.03 107.625 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -64.02 149.22 90.95 Favored 'Trans proline' 0 N--CA 1.451 -1.002 0 N-CA-C 107.65 -1.711 . . . . 2.23 107.65 172.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.53 -164.19 0.92 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.729 -0.841 . . . . 1.6 108.729 -172.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.406 ' HB ' ' HB2' ' A' ' 10' ' ' GLU . 7.3 m -64.93 140.92 58.92 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 120.914 -1.116 . . . . 3.97 109.615 177.554 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -39.51 -56.52 1.62 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.159 0.984 . . . . 2.86 112.322 173.748 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.1 mt -69.62 -38.75 77.36 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.257 -0.902 . . . . 1.64 112.153 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.406 ' HB2' ' HB ' ' A' ' 7' ' ' THR . 80.6 tt0 -50.04 -49.45 51.02 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.802 1.241 . . . . 3.17 111.16 170.867 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -52.25 -52.11 54.48 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.583 0.753 . . . . 4.25 109.077 173.161 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.9 p -63.19 -42.37 99.33 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.241 -0.436 . . . . 1.81 111.765 -173.622 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.28 2.6 pp -71.1 -36.15 61.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 O-C-N 121.742 -0.599 . . . . 0.6 110.405 179.079 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -55.46 -56.03 24.9 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.122 0.874 . . . . 2.66 109.678 172.647 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.2 t -58.57 -28.63 65.71 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 119.712 -0.795 . . . . 1.32 112.75 -170.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.7 m -80.72 -39.56 18.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 O-C-N 121.361 -0.837 . . . . 0.63 111.556 170.976 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.8 t -54.57 -46.89 72.35 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 119.267 0.939 . . . . 0.53 110.743 175.42 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.5 t -59.25 -46.88 87.31 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.715 1.143 . . . . 0.79 111.055 176.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.6 m -59.63 -39.3 83.83 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.848 0.859 . . . . 0.97 110.839 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -56.63 -61.13 2.64 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.474 0.71 . . . . 3.64 109.635 168.608 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -62.09 -45.97 91.16 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.81 0.844 . . . . 2.78 110.801 -164.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -59.79 -33.57 71.89 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.526 -0.306 . . . . 1.99 110.935 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -76.98 -41.57 42.42 Favored 'General case' 0 C--O 1.22 -0.472 0 O-C-N 121.921 -0.487 . . . . 2.76 111.338 173.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.38 -25.76 66.13 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 125.442 1.497 . . . . 0.99 111.604 -169.351 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -71.21 -25.18 62.39 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 117.079 -1.439 . . . . 3.96 113.329 175.871 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -44.11 -53.82 6.08 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-N 119.742 1.156 . . . . 1.69 112.355 -167.367 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -124.26 170.71 10.5 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 106.422 -1.695 . . . . 2.7 106.422 176.042 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -7.87 119.15 0.01 OUTLIER Glycine 0 CA--C 1.537 1.409 0 C-N-CA 127.47 2.462 . . . . 1.86 115.972 177.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 60.4 105.33 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.397 1.479 . . . . 6.19 114.885 159.257 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -72.56 60.87 0.49 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.467 1.107 . . . . 3.94 113.471 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -147.65 -48.1 0.17 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 129.02 2.928 . . . . 4.88 105.419 167.712 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -81.77 117.15 21.84 Favored 'General case' 0 C--O 1.242 0.669 0 C-N-CA 128.141 2.576 . . . . 1.66 111.116 174.949 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.402 HD22 ' CD1' ' A' ' 76' ' ' TYR . 6.7 mp -89.27 132.48 34.88 Favored 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 122.661 0.384 . . . . 2.3 110.068 164.434 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 29.1 t -82.23 174.67 10.95 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.473 1.509 . . . . 2.46 109.313 175.644 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.6 t -55.07 -46.34 77.33 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 108.893 -0.78 . . . . 2.18 108.893 172.412 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -54.8 -62.3 1.75 Allowed 'General case' 0 C--N 1.34 0.179 0 C-N-CA 123.056 0.543 . . . . 4.05 109.897 176.629 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -49.78 -48.4 50.5 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 124.435 1.094 . . . . 1.96 110.857 -177.365 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.588 ' CZ ' HD21 ' A' ' 56' ' ' LEU . 3.7 t80 -61.59 -55.89 25.87 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 116.197 -0.456 . . . . 2.71 110.567 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 40.3 tttt -60.14 -38.18 82.3 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.549 -0.72 . . . . 2.86 111.174 -174.276 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -54.74 -34.23 62.22 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.813 -0.613 . . . . 2.55 112.087 174.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.81 -55.64 21.51 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 119.751 1.16 . . . . 2.69 108.407 -177.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.9 m -65.94 -38.56 82.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 CA-C-N 115.042 -0.981 . . . . 1.06 109.464 -172.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.8 m -60.84 -52.49 64.84 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 123.627 0.771 . . . . 1.2 110.865 174.156 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -76.25 -51.2 12.52 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.039 0.536 . . . . 2.49 111.709 -167.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -146.02 78.25 1.52 Allowed 'General case' 0 CA--C 1.523 -0.086 0 C-N-CA 123.006 0.522 . . . . 3.56 110.1 -175.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.4 tp -153.78 48.99 0.45 Allowed Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 113.313 0.857 . . . . 1.72 113.313 159.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -68.02 139.81 48.04 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.793 2.329 . . . . 4.05 111.984 -177.696 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 76.48 -1.74 2.84 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.241 1.417 . . . . 3.97 113.681 165.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 11.1 tp -100.47 -92.25 0.29 Allowed 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 124.313 1.045 . . . . 1.31 110.565 -175.688 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 28.6 mt -65.74 -42.06 91.43 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 118.283 0.492 . . . . 3.15 110.864 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt 57.1 -168.59 0.11 Allowed 'General case' 0 C--N 1.344 0.367 0 C-N-CA 123.185 0.594 . . . . 7.16 110.869 -160.818 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.6 t0 60.39 44.11 12.56 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 124.028 1.871 . . . . 3.94 110.447 175.114 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.4 m -53.48 -24.32 8.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 112.76 -2.018 . . . . 2.5 110.796 159.031 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -62.99 -78.31 0.18 Allowed Glycine 0 CA--C 1.528 0.88 0 N-CA-C 110.64 -0.984 . . . . 1.52 110.64 171.276 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.25 32.34 0.5 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.229 1.012 . . . . 2.97 111.528 -167.208 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.588 HD21 ' CZ ' ' A' ' 38' ' ' PHE . 3.2 tm? -50.31 -37.55 37.13 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 124.761 1.225 . . . . 1.37 110.022 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.91 -19.74 45.23 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.25 1.82 . . . . 4.33 113.682 -177.317 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -80.18 -41.23 25.68 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 120.62 1.554 . . . . 2.98 110.351 166.234 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.66 -47.19 70.6 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 108.515 -0.92 . . . . 2.9 108.515 174.749 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -43.96 -51.83 7.4 Favored 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 124.688 1.195 . . . . 1.47 110.153 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.5 mttp -69.39 -47.47 64.11 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 110.333 -0.247 . . . . 3.87 110.333 -177.075 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.5 m -57.29 -31.49 65.68 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.31 0.644 . . . . 2.73 112.476 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.1 mt -75.69 -60.17 2.43 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.155 1.382 . . . . 2.0 109.409 174.939 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -76.43 75.37 3.18 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 123.685 0.794 . . . . 1.84 110.717 -174.429 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.2 m -49.55 -34.49 8.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.203 1.001 . . . . 2.41 113.059 -179.133 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -89.86 -32.28 16.96 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.19 0.596 . . . . 2.99 112.127 -178.454 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 56.85 44.1 23.84 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.296 1.038 . . . . 3.08 111.466 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 23.8 p30 -50.95 -42.1 59.61 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.14 0.976 . . . . 2.13 110.02 155.658 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.6 t 113.25 18.37 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.635 1 C-N-CA 131.706 4.002 . . . . 1.7 112.277 -174.325 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -134.24 126.98 30.96 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.802 1.241 . . . . 4.65 109.211 178.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -80.43 77.58 7.2 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 104.218 -2.512 . . . . 1.25 104.218 168.721 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.1 tppt? -49.93 153.76 1.25 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 128.124 2.569 . . . . 4.0 108.885 173.552 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -38.95 -59.95 0.91 Allowed 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.352 1.433 . . . . 5.43 112.836 -166.165 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.08 -40.03 96.45 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.096 0.558 . . . . 1.81 110.853 -177.022 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -64.06 -41.72 97.26 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.176 0.591 . . . . 2.38 111.278 177.467 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.402 ' CD1' HD22 ' A' ' 33' ' ' LEU . 31.5 t80 -68.64 -53.86 19.92 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 118.937 0.79 . . . . 2.66 109.31 176.122 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.508 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.7 OUTLIER -40.5 -42.19 1.59 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.317 1.047 . . . . 4.82 108.918 176.216 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 11.3 ttt180 -38.69 -52.39 1.67 Allowed 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 117.868 -1.063 . . . . 5.02 111.266 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.4 tp -43.77 -42.47 5.55 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 123.929 0.892 . . . . 0.71 111.085 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 29.5 mt -68.66 -43.61 83.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 C-N-CA 125.81 1.644 . . . . 1.45 108.066 -174.238 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -59.46 -47.76 89.32 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 110.591 -1.004 . . . . 1.22 110.591 172.924 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -58.42 -39.94 81.14 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 124.156 0.982 . . . . 2.52 109.898 178.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 13.7 mt -56.76 -48.62 77.44 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 120.069 1.304 . . . . 2.33 110.984 174.611 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.36 -27.71 64.45 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.222 0.609 . . . . 1.23 111.86 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.2 ttmt -75.58 -60.64 2.22 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.333 0.653 . . . . 1.86 109.744 168.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -48.67 -49.3 38.15 Favored 'General case' 0 C--N 1.334 -0.068 0 C-N-CA 125.861 1.664 . . . . 2.34 111.223 -172.791 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.9 tt -51.2 -39.78 21.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 C-N-CA 122.577 0.351 . . . . 1.1 111.625 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.43 -31.02 26.83 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.015 1.326 . . . . 4.47 109.965 -177.025 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 43.4 tttm . . . . . 0 CA--C 1.542 0.662 0 C-N-CA 125.561 1.544 . . . . 4.15 112.138 -168.714 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.7 mt . . . . . 0 CA--C 1.543 0.679 0 CA-C-O 119.396 -0.335 . . . . 2.37 110.762 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 1.7 t -129.43 -79.9 0.56 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.857 1.263 . . . . 2.62 112.381 -174.256 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -159.5 -71.32 0.08 Allowed 'General case' 0 C--N 1.342 0.263 0 CA-C-N 119.38 0.991 . . . . 2.32 109.256 -176.021 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.2 mt -50.98 -49.67 59.77 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.522 -0.736 . . . . 1.05 110.106 169.026 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 22.8 mp0 -50.68 -46.17 58.57 Favored 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 124.636 1.175 . . . . 3.91 111.788 173.16 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -60.34 -41.18 93.04 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.519 -0.738 . . . . 4.44 110.398 176.485 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 31.6 p -64.96 -39.3 93.28 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.595 -0.691 . . . . 1.61 111.51 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.322 2.8 pp -69.57 -32.44 52.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 O-C-N 121.524 -0.735 . . . . 0.8 111.41 172.006 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -58.76 -57.27 13.78 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.466 -0.771 . . . . 2.79 110.339 173.354 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.4 t -51.52 -39.46 57.71 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.762 0.71 . . . . 1.35 111.731 -171.879 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 23.2 m -72.68 -37.02 54.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 120.995 -1.066 . . . . 0.76 111.896 176.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 42.1 t -60.57 -45.27 97.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 119.43 1.014 . . . . 0.89 110.786 173.436 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -66.22 -41.4 90.15 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.98 -1.075 . . . . 1.11 110.783 176.663 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 61.6 m -59.23 -46.7 87.78 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.151 0.887 . . . . 0.99 110.826 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -48.25 -61.86 1.78 Allowed 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 108.073 -1.084 . . . . 3.85 108.073 169.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -52.95 -52.81 56.71 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.203 1.001 . . . . 3.21 112.238 -172.498 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 7.1 t -61.55 -29.97 70.35 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 119.075 -0.488 . . . . 2.67 111.826 -174.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -81.69 -40.25 23.09 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 119.358 0.981 . . . . 3.01 111.538 170.381 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.16 -25.26 65.4 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 126.913 2.085 . . . . 0.9 112.653 -168.391 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 20.3 ptt180 -58.62 -28.86 66.04 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 117.675 -1.155 . . . . 5.09 112.9 172.23 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -52.01 -63.83 1.01 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 115.448 1.647 . . . . 2.12 115.448 -155.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -88.93 -76.74 0.4 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.361 0.6 . . . . 3.33 112.384 -166.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.75 165.38 27.03 Favored Glycine 0 C--N 1.337 0.635 0 C-N-CA 127.791 2.615 . . . . 2.15 110.885 158.634 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 38.94 103.07 0.0 OUTLIER 'General case' 0 C--O 1.238 0.487 0 N-CA-C 115.973 1.842 . . . . 3.63 115.973 139.121 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 18.3 pttm -54.58 -32.08 57.96 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.948 1.299 . . . . 3.97 114.033 174.642 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -79.37 -33.43 42.88 Favored 'General case' 0 CA--C 1.531 0.226 0 O-C-N 121.591 -0.693 . . . . 4.05 111.626 -173.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.0 p -100.73 130.23 46.74 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.953 -0.758 . . . . 1.69 108.953 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.26 170.72 4.39 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 122.486 1.136 . . . . 1.98 108.995 161.894 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 4.7 m -157.24 -173.5 4.46 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 106.259 -1.756 . . . . 3.57 106.259 -154.37 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 93.3 t -71.77 -111.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 101.397 -3.557 . . . . 3.13 101.397 -175.926 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -75.07 59.68 0.97 Allowed 'General case' 0 CA--C 1.551 0.998 0 O-C-N 119.597 -1.94 . . . . 2.38 110.074 -176.856 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -115.37 -52.05 2.67 Favored 'General case' 0 N--CA 1.452 -0.347 1 C-N-CA 132.574 4.35 . . . . 2.45 107.621 144.505 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -56.31 -50.33 71.76 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.677 -1.231 . . . . 2.89 107.677 173.347 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 7.8 tttp -56.0 -39.5 71.97 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 121.02 -0.272 . . . . 2.96 110.723 178.737 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -56.36 -45.06 80.64 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 122.642 0.377 . . . . 2.55 110.745 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 7.2 tt -64.23 -48.83 74.31 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.381 -0.97 . . . . 2.15 108.381 -174.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 42' ' ' VAL . . . . . 0.406 HG21 HD23 ' B' ' 56' ' ' LEU . 6.8 m -67.05 -42.69 88.78 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-N 115.773 -0.649 . . . . 0.8 109.899 -173.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 88.1 m -61.22 -53.33 58.28 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.929 0.892 . . . . 0.97 110.843 175.72 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -76.76 -61.16 2.06 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 124.036 0.935 . . . . 1.85 110.617 -167.167 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -82.64 -53.13 6.18 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.72 0.408 . . . . 2.85 110.575 -173.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 5.8 tp -83.47 -18.77 0.26 Allowed Pre-proline 0 CA--C 1.542 0.653 0 N-CA-C 121.281 3.808 . . . . 2.29 121.281 -143.163 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -46.17 -54.81 4.26 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 CA-C-N 123.108 2.146 . . . . 3.08 116.154 -145.154 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -79.69 55.85 2.12 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 118.971 0.805 . . . . 2.44 112.055 -175.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 33.2 tp -147.39 -87.1 0.09 Allowed 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 125.898 1.679 . . . . 1.3 107.117 170.624 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 53.1 mt -73.99 77.46 1.69 Allowed 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 107.29 -1.374 . . . . 1.87 107.29 165.17 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.5 151.76 2.15 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.247 -0.888 . . . . 5.59 109.583 174.77 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 61.3 t0 66.7 73.47 0.35 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 123.665 1.697 . . . . 3.59 108.893 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 14.3 m -78.42 6.68 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 CA-C-N 112.172 -2.285 . . . . 1.55 110.284 163.803 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -74.11 -58.9 4.15 Favored Glycine 0 C--N 1.342 0.904 0 N-CA-C 106.681 -2.568 . . . . 2.35 106.681 172.907 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 1.7 t -77.34 49.07 0.68 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.706 0.765 . . . . 2.62 110.46 172.48 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.406 HD23 HG21 ' B' ' 42' ' ' VAL . 2.2 tm? -62.32 -47.47 84.12 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 107.634 -1.247 . . . . 0.96 107.634 167.745 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -63.25 -30.72 71.81 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.844 0.857 . . . . 4.59 111.221 -165.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -52.98 -59.94 3.91 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.132 0.973 . . . . 2.41 110.113 163.82 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -58.51 -39.42 80.04 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.436 -0.792 . . . . 4.62 109.982 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -52.49 -55.77 19.74 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 119.066 0.848 . . . . 1.84 109.232 174.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 35.1 mtmt -58.1 -40.9 82.35 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.226 0.921 . . . . 3.29 111.954 176.971 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 18.0 t -61.35 -25.27 67.04 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.734 -0.604 . . . . 1.75 112.475 173.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.831 ' HB3' HD11 ' B' ' 71' ' ' LEU . 1.2 tp -81.95 -52.07 7.43 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.035 1.734 . . . . 2.44 110.625 176.929 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -62.16 -13.73 30.17 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 128.662 2.785 . . . . 1.67 115.211 -164.187 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 30.1 m -35.98 -27.12 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 C-N-CA 130.931 3.693 . . . . 1.48 118.456 -130.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -65.25 -11.52 42.05 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.603 1.092 . . . . 2.37 111.643 166.957 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 70.15 28.67 3.94 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.712 1.205 . . . . 4.19 112.297 165.099 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 55.4 p30 -91.54 -1.21 57.59 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.783 1.233 . . . . 2.13 112.73 177.664 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 8.1 t 69.39 1.56 3.35 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 114.524 1.305 . . . . 2.7 114.524 -176.394 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -103.64 126.77 50.99 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 119.855 1.207 . . . . 3.7 108.412 171.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 71' ' ' LEU . . . . . 0.831 HD11 ' HB3' ' B' ' 63' ' ' LEU . 3.8 mm? -98.76 80.85 2.58 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.802 -1.184 . . . . 1.57 107.802 175.47 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 11.0 ptpp? -83.42 177.75 8.34 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.513 1.125 . . . . 3.92 111.772 -174.207 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -83.08 56.65 3.57 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.373 -0.829 . . . . 3.91 112.898 -173.144 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -163.19 49.07 0.15 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.375 -0.972 . . . . 2.31 108.375 109.689 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -93.78 -62.47 1.35 Allowed 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 124.885 1.274 . . . . 1.76 108.428 150.376 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -61.1 -32.32 71.99 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.174 -0.921 . . . . 4.69 112.012 -164.073 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.425 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 5.8 t90 -41.11 -44.64 2.55 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 124.49 1.119 . . . . 4.58 109.541 175.916 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 60.1 mtp85 -38.92 -41.19 0.73 Allowed 'General case' 0 C--N 1.344 0.36 0 C-N-CA 123.833 0.853 . . . . 4.11 111.509 -178.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 16.7 tp -51.53 -54.5 26.7 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.934 0.788 . . . . 1.09 112.822 176.329 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.6 mt -70.23 -30.94 45.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 120.144 1.338 . . . . 1.43 108.529 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -41.92 -51.98 4.9 Favored Glycine 0 C--N 1.344 0.999 0 C-N-CA 125.437 1.494 . . . . 1.41 110.184 165.867 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -75.58 -57.9 3.61 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 112.89 -1.655 . . . . 2.23 109.862 -176.775 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 10.5 mp -41.69 -59.33 1.68 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 120.62 1.555 . . . . 2.19 112.212 -176.95 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.71 -28.84 70.16 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-N 115.436 -0.802 . . . . 1.32 111.739 -174.662 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -71.24 -62.09 1.53 Allowed 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 108.12 -1.067 . . . . 1.76 108.12 172.877 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -58.27 -39.11 78.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.047 0.939 . . . . 2.73 111.87 -166.462 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 11.4 tt -47.51 -47.37 10.64 Favored 'Isoleucine or valine' 0 C--N 1.347 0.492 0 CA-C-N 119.603 1.092 . . . . 1.05 112.104 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 5.9 ttp85 -82.27 -48.4 11.26 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 122.313 1.054 . . . . 4.27 110.14 173.511 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 2.7 tttt . . . . . 0 N--CA 1.45 -0.462 0 C-N-CA 126.846 2.058 . . . . 6.41 109.022 -169.685 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 . . . . . 0 CA--C 1.537 0.462 0 CA-C-O 119.182 -0.437 . . . . 5.51 110.199 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.69 103.4 1.7 Allowed 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.912 2.408 . . . . 2.63 110.467 -177.238 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 88.5 mt -67.65 164.82 18.4 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.228 0.537 . . . . 1.29 110.833 173.575 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.8 t -83.18 175.68 9.77 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.658 -0.867 . . . . 2.03 108.658 171.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -69.37 -48.52 60.99 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.567 0.747 . . . . 2.58 109.175 -167.562 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.5 mp -62.33 -52.46 63.56 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 119.361 -0.352 . . . . 2.33 111.226 178.304 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -54.42 -50.55 67.34 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.226 1.01 . . . . 2.89 110.248 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -50.99 -55.2 18.52 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.3 1.04 . . . . 3.58 110.606 172.451 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.9 m -55.24 -49.77 71.17 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.878 -0.514 . . . . 2.23 111.654 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.293 2.9 pp -62.49 -37.12 78.02 Favored 'Isoleucine or valine' 0 C--N 1.339 0.13 0 C-N-CA 119.763 -0.775 . . . . 0.67 110.332 178.074 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -60.65 -58.08 9.98 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.093 0.86 . . . . 2.63 110.431 175.499 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.9 t -52.33 -39.86 61.18 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.392 0.996 . . . . 1.18 111.583 -172.007 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.0 m -73.36 -42.09 57.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 O-C-N 121.107 -0.996 . . . . 0.75 111.271 175.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 28.2 t -55.39 -51.29 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 119.376 0.989 . . . . 0.62 110.853 175.312 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.6 t -60.27 -48.34 82.15 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.163 0.892 . . . . 0.84 110.448 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 90.6 m -55.29 -51.38 66.85 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-N 118.691 0.678 . . . . 0.98 110.251 178.252 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -46.88 -58.9 3.47 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 123.658 0.783 . . . . 2.96 109.447 171.116 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -57.09 -47.07 81.95 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.617 1.167 . . . . 2.64 111.452 -169.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.05 -41.85 65.19 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 119.101 -0.476 . . . . 2.38 111.945 178.203 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -81.41 -31.18 33.31 Favored 'General case' 0 C--O 1.221 -0.427 0 C-N-CA 123.668 0.787 . . . . 3.54 111.71 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.01 -34.91 72.42 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 120.432 -1.417 . . . . 0.98 109.762 178.03 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 33.7 ttp180 -69.27 -26.24 64.66 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.12 1.768 . . . . 4.59 113.589 178.214 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -41.05 -60.82 1.11 Allowed 'General case' 0 C--N 1.344 0.345 0 CA-C-N 120.49 1.495 . . . . 1.78 113.514 -168.158 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -110.54 169.27 8.86 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 127.009 2.124 . . . . 2.63 106.346 175.972 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -11.91 121.09 0.01 OUTLIER Glycine 0 CA--C 1.533 1.2 0 C-N-CA 127.264 2.364 . . . . 1.4 115.19 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.27 106.3 0.06 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.932 0.893 . . . . 5.76 113.072 170.118 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -68.08 55.22 0.07 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.163 1.385 . . . . 3.63 111.769 168.062 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -158.83 -61.8 0.08 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 126.572 1.949 . . . . 4.14 105.771 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.7 m -82.53 127.24 33.14 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.003 -0.999 . . . . 2.3 109.365 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.408 HD22 ' CE2' ' A' ' 76' ' ' TYR . 5.8 mp -93.29 132.41 37.51 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.694 0.283 . . . . 2.28 110.537 170.956 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.5 t -81.5 175.78 10.23 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.276 1.43 . . . . 2.56 108.429 172.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.1 t -64.73 -48.58 84.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 C-N-CA 123.1 0.56 . . . . 1.97 109.642 -175.103 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -59.5 -56.8 17.45 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 118.932 -0.556 . . . . 2.11 109.537 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -39.23 -52.14 1.96 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 125.098 1.359 . . . . 1.72 112.479 172.765 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -58.58 -58.2 9.59 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.476 -0.564 . . . . 3.04 109.476 175.778 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 33.9 tttm -52.98 -39.59 63.14 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 119.216 -0.421 . . . . 3.55 111.823 -175.124 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 67.9 mt-10 -47.78 -47.56 30.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 118.972 -0.537 . . . . 2.89 111.224 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.3 tp -65.95 -46.76 77.0 Favored 'General case' 0 C--N 1.337 0.063 0 CA-C-N 119.816 1.189 . . . . 2.68 109.266 -171.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.8 m -69.04 -36.29 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-O 121.494 0.664 . . . . 0.95 109.471 -173.676 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 57.9 m -75.35 -30.34 60.2 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.393 0.677 . . . . 1.19 110.795 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -80.53 -57.42 3.59 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.754 1.222 . . . . 2.18 110.655 -176.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.4 mp0 -97.95 -125.95 0.15 Allowed 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 109.109 -0.701 . . . . 3.98 109.109 177.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.587 ' CD1' HD23 ' A' ' 49' ' ' LEU . 1.4 mm? 28.96 64.61 0.73 Allowed Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 127.973 2.509 . . . . 2.34 115.62 175.377 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -75.54 -50.12 0.13 Allowed 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 121.918 1.745 . . . . 1.72 111.062 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 19.6 t-160 -107.47 -22.77 12.43 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.13 0.972 . . . . 4.12 112.181 -166.4 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.816 HD21 ' HB2' ' A' ' 83' ' ' LEU . 18.1 tp -74.73 -91.08 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.475 1.11 . . . . 1.2 109.733 -167.285 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.6 mt -82.65 68.08 8.97 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.117 -1.068 . . . . 2.11 108.117 172.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -59.74 156.1 14.62 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.155 -0.475 . . . . 5.42 110.054 170.927 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 60.1 t0 67.69 84.58 0.15 Allowed 'General case' 0 C--O 1.231 0.089 0 C-N-CA 125.879 1.672 . . . . 4.44 109.055 -155.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 25.2 m -100.09 28.72 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 114.224 -1.353 . . . . 2.08 109.244 166.819 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -104.57 -59.0 0.68 Allowed Glycine 0 C--N 1.34 0.778 0 C-N-CA 126.419 1.961 . . . . 1.45 108.74 177.221 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 t -77.28 60.81 2.04 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 123.242 1.496 . . . . 2.04 109.571 175.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -73.88 -25.01 59.81 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 124.782 1.233 . . . . 1.2 109.078 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -52.83 -53.07 53.86 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.953 1.701 . . . . 4.02 111.613 171.641 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLU . . . . . 0.409 ' OE1' ' NZ ' ' A' ' 59' ' ' LYS . 2.1 tt0 -54.26 -56.74 15.41 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.132 0.973 . . . . 3.39 108.903 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.409 ' NZ ' ' OE1' ' A' ' 58' ' ' GLU . 0.0 OUTLIER -53.43 -45.52 69.48 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.969 -0.56 . . . . 2.62 110.034 179.502 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -57.35 -56.06 26.68 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 123.514 0.725 . . . . 1.37 109.693 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 60.1 mttt -63.05 -33.08 74.67 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 111.665 0.246 . . . . 3.67 111.665 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -62.09 -41.96 98.73 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.132 -0.355 . . . . 1.92 110.781 173.396 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 21.5 mt -76.54 -56.4 4.65 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.214 1.406 . . . . 1.5 112.773 -174.948 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -59.34 114.42 2.65 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.04 0.936 . . . . 1.85 108.834 -175.242 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.2 t -73.76 -30.66 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 N-CA-C 109.169 -0.678 . . . . 3.63 109.169 -173.403 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -84.19 -40.5 18.06 Favored 'General case' 0 C--O 1.227 -0.109 0 N-CA-C 109.197 -0.668 . . . . 2.12 109.197 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 65.36 64.56 0.6 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.014 1.326 . . . . 3.42 108.032 -158.569 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -104.11 -125.11 0.21 Allowed 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 105.467 -2.049 . . . . 3.64 105.467 172.1 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.3 t -137.28 18.22 2.96 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.365 1.066 . . . . 2.47 110.117 170.477 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 40.0 mp0 -133.12 113.38 12.66 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 125.282 1.433 . . . . 5.02 107.399 -165.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -84.27 87.85 7.21 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 105.461 -2.052 . . . . 1.0 105.461 167.241 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -54.64 158.96 2.34 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 118.222 -0.894 . . . . 4.53 109.485 176.066 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -37.25 -53.03 1.07 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.44 1.096 . . . . 4.88 112.011 -176.707 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -70.23 -40.31 74.56 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.565 0.58 . . . . 2.55 112.565 -178.08 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -63.07 -34.76 78.28 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.873 0.469 . . . . 2.12 110.576 176.358 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.408 ' CE2' HD22 ' A' ' 33' ' ' LEU . 28.3 t80 -75.63 -47.04 28.18 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 119.008 -0.52 . . . . 3.43 109.832 175.999 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.526 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 2.3 t-105 -43.74 -43.94 6.31 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 108.73 -0.841 . . . . 4.79 108.73 173.515 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.0 mtp180 -39.71 -51.48 2.33 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-O 117.087 -1.435 . . . . 4.28 109.44 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.7 tp -43.6 -47.64 7.52 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 120.44 1.473 . . . . 0.73 112.198 177.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.5 mp -68.19 -44.11 84.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 125.689 1.595 . . . . 1.76 108.707 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -60.49 -36.97 92.53 Favored Glycine 0 C--N 1.332 0.314 0 CA-C-O 122.121 0.845 . . . . 1.56 113.48 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.422 ' O ' ' HD2' ' A' ' 85' ' ' LYS . 5.9 mm-40 -75.99 -56.04 5.03 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 104.979 -2.23 . . . . 3.12 104.979 -175.347 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.816 ' HB2' HD21 ' A' ' 49' ' ' LEU 0.282 4.6 pp -57.14 -32.18 66.11 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 121.207 -0.933 . . . . 2.2 113.38 177.027 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.12 -25.09 68.2 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 118.065 -0.969 . . . . 1.77 112.876 175.615 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.422 ' HD2' ' O ' ' A' ' 82' ' ' GLU 0.308 0.0 OUTLIER -84.74 -41.4 16.24 Favored 'General case' 0 C--N 1.344 0.346 0 CA-C-N 120.201 1.364 . . . . 2.24 112.507 158.968 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.487 ' HB2' ' HA ' ' A' ' 83' ' ' LEU . 16.8 mm-40 -52.94 -39.39 62.84 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 119.211 0.914 . . . . 2.54 111.336 -171.474 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.415 HG21 HG21 ' B' ' 17' ' ' VAL . 4.3 tp -26.87 -50.47 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.449 1.1 . . . . 1.81 111.963 166.115 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -115.24 -42.68 3.15 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.007 0.923 . . . . 4.65 112.981 -176.445 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 44.6 tttm . . . . . 0 C--O 1.232 0.166 0 O-C-N 119.92 -1.737 . . . . 3.05 109.298 171.811 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.442 ' HB2' ' HB3' ' B' ' 10' ' ' GLU . 0.3 OUTLIER . . . . . 0 CA--C 1.549 0.912 0 N-CA-C 112.188 0.44 . . . . 3.37 112.188 . . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 5.1 t -79.85 -159.9 0.24 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.403 1.881 . . . . 2.05 113.068 -173.13 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -75.28 -66.83 0.72 Allowed 'General case' 0 C--O 1.223 -0.29 0 O-C-N 121.957 -0.465 . . . . 2.68 111.786 -172.745 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.0 mt -48.81 -41.67 33.54 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 120.852 -1.155 . . . . 1.04 110.353 175.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 10' ' ' GLU . . . . . 0.599 ' HG3' HD22 ' A' ' 49' ' ' LEU . 1.6 mt-10 -44.69 -61.51 1.55 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.323 1.849 . . . . 3.52 113.71 164.676 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.66 -34.94 78.12 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 120.464 -1.397 . . . . 4.29 110.234 -177.963 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.8 m -64.16 -38.06 89.71 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.204 0.602 . . . . 2.3 111.238 178.591 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.263 2.9 pp -71.47 -36.51 60.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 O-C-N 121.477 -0.765 . . . . 1.12 111.209 167.562 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -53.11 -57.3 10.9 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 118.857 0.753 . . . . 2.65 110.043 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.1 t -47.24 -44.51 22.77 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.284 0.947 . . . . 1.36 112.699 -176.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.0 m -74.36 -36.22 41.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 O-C-N 120.832 -1.168 . . . . 1.23 110.967 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.415 HG21 HG21 ' A' ' 87' ' ' ILE . 56.3 t -61.53 -48.18 89.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 118.828 0.74 . . . . 0.99 110.739 175.696 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 10.1 t -59.89 -44.91 93.97 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 120.197 1.362 . . . . 1.15 110.532 176.335 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 56.5 m -55.7 -49.81 72.0 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.422 0.63 . . . . 1.18 110.483 175.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -49.75 -55.64 13.24 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 118.155 -0.926 . . . . 3.79 110.751 170.77 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -49.61 -57.74 6.58 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 120.125 1.329 . . . . 4.21 111.161 178.408 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 30.5 p -60.05 -45.75 91.82 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 122.311 -0.243 . . . . 2.04 110.398 -172.294 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -66.21 -49.38 67.47 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 121.506 0.67 . . . . 3.54 110.488 177.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.02 -30.24 64.03 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 126.011 1.724 . . . . 0.82 110.384 -177.805 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -58.5 -26.11 63.1 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 117.541 -1.218 . . . . 7.16 111.453 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.403 ' HB2' ' HG2' ' B' ' 37' ' ' GLU . 0.3 OUTLIER -45.05 -66.19 0.43 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.87 1.804 . . . . 1.72 115.87 -156.949 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -90.21 -75.41 0.46 Allowed 'General case' 0 C--N 1.341 0.219 0 C-N-CA 119.604 -0.838 . . . . 3.48 111.694 -168.598 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.85 165.18 29.28 Favored Glycine 0 C--N 1.337 0.628 0 C-N-CA 126.891 2.186 . . . . 1.98 110.741 156.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 18.4 mmt85 36.33 105.5 0.0 OUTLIER 'General case' 0 C--O 1.242 0.67 0 N-CA-C 116.819 2.155 . . . . 5.46 116.819 136.773 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -66.09 46.76 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.833 2.053 . . . . 4.07 114.448 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -148.07 -55.98 0.22 Allowed 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 124.872 1.269 . . . . 4.43 108.161 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 2.6 p -81.89 117.55 22.23 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.791 1.636 . . . . 1.73 109.952 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.423 ' N ' HD12 ' B' ' 33' ' ' LEU . 7.7 mp -96.22 137.59 35.07 Favored 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 108.382 -0.97 . . . . 2.22 108.382 169.382 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 34' ' ' SER . . . . . 0.457 ' C ' ' H ' ' B' ' 36' ' ' ASN . 0.8 OUTLIER -81.77 -171.5 3.38 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 128.547 2.739 . . . . 2.54 108.055 179.464 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 13.2 p -96.52 42.99 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 CA-C-O 123.454 1.597 . . . . 2.51 108.569 164.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 36' ' ' ASN . . . . . 0.457 ' H ' ' C ' ' B' ' 34' ' ' SER . 0.6 OUTLIER -161.09 170.55 20.22 Favored 'General case' 0 CA--C 1.544 0.747 1 C-N-CA 141.317 7.847 . . . . 3.68 101.403 169.592 . . . . . . . . 4 4 . 1 . 004 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.403 ' HG2' ' HB2' ' B' ' 26' ' ' GLN . 63.8 mt-10 58.0 -65.36 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 121.918 2.145 . . . . 1.6 110.156 -153.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -57.62 -50.59 72.64 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.709 -0.849 . . . . 2.2 108.709 177.289 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -57.32 -48.58 78.6 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.741 -0.208 . . . . 4.4 110.885 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -53.86 -38.48 64.74 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 121.917 -0.49 . . . . 3.61 111.137 174.145 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 8.8 tt -68.56 -47.04 67.85 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.955 -0.758 . . . . 2.42 108.955 -177.183 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 42' ' ' VAL . . . . . 0.451 HG21 HD23 ' B' ' 56' ' ' LEU . 0.2 OUTLIER -65.24 -51.79 60.67 Favored 'Isoleucine or valine' 0 C--N 1.34 0.155 0 CA-C-N 118.379 0.536 . . . . 1.01 110.187 -179.535 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 63.3 m -53.39 -53.58 49.17 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.878 0.871 . . . . 0.94 111.252 177.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -81.64 -60.44 2.25 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.93 0.492 . . . . 1.68 112.139 -171.19 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -80.92 -44.19 18.64 Favored 'General case' 0 C--N 1.337 0.039 0 N-CA-C 113.808 1.04 . . . . 2.51 113.808 -159.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 46' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' B' ' 42' ' ' VAL . 1.2 mm? -39.89 -57.08 2.83 Favored Pre-proline 0 N--CA 1.467 0.418 0 CA-C-O 117.333 -1.317 . . . . 2.39 112.823 -164.196 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -87.22 -27.57 5.2 Favored 'Cis proline' 0 N--CA 1.45 -1.04 0 CA-C-N 120.48 1.207 . . . . 2.15 109.506 -25.07 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 22.2 t-160 -98.72 -44.36 6.44 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.467 1.107 . . . . 2.73 110.327 -166.824 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.467 HD23 ' HG ' ' B' ' 83' ' ' LEU . 13.0 tp -29.34 -57.8 0.15 Allowed 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.555 1.942 . . . . 1.07 114.652 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 72.0 mt -97.56 116.19 29.29 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 109.398 -0.593 . . . . 1.57 109.398 175.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.21 178.23 8.19 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.108 0.563 . . . . 5.31 109.617 164.414 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.326 1.0 OUTLIER 62.6 16.26 8.67 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.761 2.025 . . . . 4.31 114.075 176.973 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 19.3 m -54.76 -20.17 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 C-N-CA 125.812 1.645 . . . . 2.38 113.101 171.005 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.3 -44.95 21.42 Favored Glycine 0 CA--C 1.532 1.095 0 N-CA-C 110.456 -1.058 . . . . 2.6 110.456 166.04 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 18.4 m -92.17 40.34 1.04 Allowed 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.821 1.248 . . . . 2.55 110.872 174.832 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.522 HD13 ' C ' ' B' ' 56' ' ' LEU . 2.6 tm? -48.36 -48.67 36.39 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 119.541 1.064 . . . . 1.13 109.809 176.391 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -45.41 -36.73 4.5 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.188 1.795 . . . . 4.83 112.819 177.663 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -64.69 -51.39 62.73 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.139 -0.976 . . . . 2.88 110.111 172.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 4.4 mmpt? -54.16 -53.61 51.04 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 107.997 -1.112 . . . . 3.35 107.997 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.03 -42.08 98.78 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.876 -0.583 . . . . 2.02 110.464 -174.065 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -53.84 -37.17 63.34 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.178 0.899 . . . . 3.54 112.051 171.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 9.2 m -68.86 -44.81 72.6 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 122.708 0.403 . . . . 1.96 111.703 176.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 6.5 mp -69.5 -43.61 72.77 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.23 -0.919 . . . . 1.61 111.816 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.268 16.9 t0 -62.88 -9.0 8.12 Favored 'General case' 0 C--O 1.221 -0.395 0 C-N-CA 127.874 2.469 . . . . 1.46 115.99 -166.103 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.3 m -32.26 -21.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 130.57 3.548 . . . . 1.54 120.139 -131.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -53.94 -33.82 57.89 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 121.191 1.814 . . . . 2.41 110.723 155.672 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 58.92 55.33 4.59 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.638 0.775 . . . . 4.21 109.658 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 34.2 p30 -81.66 -34.24 30.88 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.331 -0.849 . . . . 2.13 109.056 172.791 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 24.8 m 109.07 -6.23 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 129.531 3.132 . . . . 1.9 111.879 -175.413 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -111.85 98.22 7.23 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.852 1.661 . . . . 5.39 106.568 -177.193 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -76.02 91.19 3.06 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 126.674 1.99 . . . . 0.98 106.843 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 12.3 ptmt -84.25 176.37 8.79 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.873 1.269 . . . . 3.14 110.25 -177.307 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -83.73 50.24 1.76 Allowed 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.42 1.267 . . . . 4.5 114.42 -176.687 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -162.13 49.46 0.19 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.206 1.402 . . . . 2.14 107.882 125.762 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -95.54 -58.85 2.01 Favored 'General case' 0 N--CA 1.44 -0.963 0 O-C-N 119.498 -2.001 . . . . 1.85 108.475 131.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -46.27 -44.53 16.56 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 124.15 0.98 . . . . 3.57 112.967 -173.106 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.417 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 7.7 t90 -43.2 -46.65 6.13 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 123.636 0.585 . . . . 4.31 110.207 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -41.57 -37.7 1.18 Allowed 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.749 -0.643 . . . . 5.72 111.802 -177.776 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 11.1 tp -50.34 -55.51 15.26 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 119.186 0.903 . . . . 0.92 111.935 175.735 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.2 mt -71.29 -30.51 40.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 120.183 1.356 . . . . 1.45 108.353 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -41.77 -49.57 5.05 Favored Glycine 0 C--N 1.344 1.001 0 C-N-CA 125.687 1.613 . . . . 1.67 111.298 166.03 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -80.51 -59.54 2.65 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 112.538 -1.831 . . . . 2.42 108.676 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.467 ' HG ' HD23 ' B' ' 49' ' ' LEU . 8.4 mp -39.01 -56.48 1.41 Allowed 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 121.374 1.897 . . . . 2.27 113.893 -174.097 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.35 -30.34 69.48 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 123.146 0.578 . . . . 1.29 111.953 -177.866 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt -75.84 -46.58 29.66 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 123.971 0.908 . . . . 1.73 109.896 169.629 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -56.77 -40.86 76.59 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-N 120.372 1.442 . . . . 2.66 111.931 -175.577 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 5.7 tt -55.52 -32.36 30.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 CA-C-N 118.776 0.717 . . . . 1.04 111.657 174.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 50.2 tpt85 -81.86 -40.53 22.29 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.449 1.1 . . . . 3.61 112.79 175.482 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 43.4 tttp . . . . . 0 CA--C 1.532 0.259 0 C-N-CA 125.182 1.393 . . . . 4.28 112.866 -157.52 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 . . . . . 0 N--CA 1.448 -0.548 0 N-CA-C 110.064 -0.347 . . . . 4.2 110.064 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.41 101.46 1.36 Allowed 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 122.583 2.189 . . . . 2.71 109.688 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 91.4 mt -60.08 152.17 24.85 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.473 0.654 . . . . 1.46 110.82 175.744 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.4 t -69.07 151.06 46.91 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.823 0.849 . . . . 2.0 109.249 178.855 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -39.09 -59.12 1.04 Allowed 'General case' 0 CA--C 1.527 0.084 0 C-N-CA 126.291 1.836 . . . . 3.2 112.147 -172.688 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 10.3 mt -69.07 -46.05 68.79 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.435 -0.793 . . . . 1.54 111.16 -172.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -54.61 -48.55 72.06 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.996 0.919 . . . . 2.94 110.597 175.979 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -50.67 -60.8 2.66 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.984 1.314 . . . . 3.85 109.655 171.402 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 54.5 p -55.92 -42.95 76.86 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.606 0.362 . . . . 1.48 111.478 -173.625 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.306 2.6 pp -66.34 -41.03 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-O 117.671 -1.157 . . . . 0.76 111.346 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.72 -52.72 64.28 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 120.046 1.294 . . . . 2.52 108.818 172.591 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -43.23 -43.84 4.97 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.962 1.305 . . . . 2.06 113.72 177.839 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 35.1 m -81.43 -39.35 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.886 1.221 . . . . 0.74 112.619 173.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.3 t -57.47 -40.8 76.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 C-N-CA 123.816 0.847 . . . . 0.71 110.592 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.7 t -59.6 -50.78 72.55 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.544 0.611 . . . . 0.75 110.882 176.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.2 m -57.25 -50.89 71.45 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.376 -0.828 . . . . 0.82 110.12 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -49.1 -58.57 4.74 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.945 0.898 . . . . 3.01 109.951 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -63.15 -45.86 89.93 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 118.552 -0.737 . . . . 5.08 111.839 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.6 t -60.58 -44.7 95.92 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.506 1.048 . . . . 2.16 110.056 -176.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -61.17 -48.61 80.8 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 121.127 0.489 . . . . 2.66 111.02 172.037 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.2 -22.12 66.82 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 120.953 -1.092 . . . . 1.31 112.178 -175.67 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -79.04 -17.18 55.73 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.665 1.986 . . . . 6.21 112.378 174.239 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.437 ' HB3' ' HG3' ' A' ' 37' ' ' GLU . 6.4 tp60 -39.74 -55.28 1.96 Allowed 'General case' 0 C--N 1.344 0.335 0 CA-C-N 119.86 1.209 . . . . 2.8 111.255 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -145.64 -165.39 2.18 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 123.94 0.896 . . . . 5.34 109.471 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -18.28 113.58 0.01 OUTLIER Glycine 0 CA--C 1.527 0.806 0 C-N-CA 128.393 2.901 . . . . 1.89 114.37 -166.187 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? 66.05 106.9 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.48 1.112 . . . . 5.07 112.956 173.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.89 -26.11 65.63 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 113.32 0.859 . . . . 7.05 113.32 176.347 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -90.56 9.92 27.56 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.577 0.626 . . . . 4.64 111.99 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.6 p -151.35 160.5 43.74 Favored 'General case' 0 C--O 1.24 0.568 0 O-C-N 120.908 -1.12 . . . . 1.97 111.708 174.394 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.414 HD13 ' CG ' ' A' ' 76' ' ' TYR . 3.8 mp -118.03 127.97 54.32 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 122.678 0.391 . . . . 2.91 110.918 -172.488 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.7 t -81.92 172.46 13.27 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.502 -0.925 . . . . 2.23 108.502 174.444 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 43.1 t -67.28 -48.75 77.1 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 O-C-N 121.492 -0.755 . . . . 2.99 110.36 -168.667 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -56.99 -52.03 66.87 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 109.473 -0.565 . . . . 2.55 109.473 172.252 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.437 ' HG3' ' HB3' ' A' ' 26' ' ' GLN . 7.2 tt0 -48.71 -49.58 37.3 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.349 1.46 . . . . 2.1 110.39 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.564 ' CZ ' HD21 ' A' ' 56' ' ' LEU . 1.9 t80 -59.47 -57.65 12.05 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 124.553 1.141 . . . . 2.8 109.932 172.652 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -52.02 -44.72 64.29 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 117.948 0.34 . . . . 4.76 111.78 -174.145 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -48.58 -37.79 18.93 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.295 0.48 . . . . 2.74 112.295 177.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -64.65 -47.27 79.1 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 108.534 -0.913 . . . . 2.23 108.534 -176.028 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.539 HG21 HD23 ' A' ' 56' ' ' LEU . 28.7 m -71.01 -40.64 76.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 116.287 -0.415 . . . . 1.42 110.126 -175.827 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.8 m -61.5 -42.01 98.14 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.385 0.674 . . . . 1.77 110.88 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -80.63 -55.6 4.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.122 0.569 . . . . 2.11 111.478 -171.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -92.97 -122.34 0.09 Allowed 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.303 0.501 . . . . 4.27 110.421 177.461 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.653 ' H ' HD12 ' A' ' 46' ' ' LEU . 6.9 mp 12.81 71.53 0.11 Allowed Pre-proline 0 CA--C 1.545 0.754 0 C-N-CA 129.927 3.291 . . . . 2.43 115.502 -174.018 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.59 -52.22 0.6 Allowed 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 123.055 2.504 . . . . 1.66 113.263 -177.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 -136.0 61.58 1.64 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.78 0.8 . . . . 3.13 110.081 -168.637 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.674 HD21 ' HB2' ' A' ' 83' ' ' LEU . 5.9 tp -143.94 -118.72 0.09 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.876 -1.056 . . . . 1.88 108.477 -164.459 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 68.2 mt -68.56 77.83 0.28 Allowed 'General case' 0 C--N 1.34 0.164 0 N-CA-C 108.524 -0.917 . . . . 2.8 108.524 163.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -66.65 -168.91 0.07 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.43 -0.805 . . . . 5.33 110.433 172.063 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 63.93 37.84 9.19 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 124.698 1.199 . . . . 3.55 109.46 178.293 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -63.02 -22.38 30.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 124.796 1.238 . . . . 2.08 111.742 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -49.82 -35.82 24.98 Favored Glycine 0 CA--C 1.532 1.117 0 N-CA-C 111.235 -0.746 . . . . 1.98 111.235 166.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.8 t -108.06 46.59 0.94 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.118 1.367 . . . . 2.45 109.55 173.238 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.564 HD21 ' CZ ' ' A' ' 38' ' ' PHE . 2.4 tm? -55.39 -46.5 76.56 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.077 -1.015 . . . . 1.23 109.342 167.55 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -62.63 -22.82 66.71 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.355 1.062 . . . . 5.3 111.775 -169.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -62.34 -48.73 78.52 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 120.801 -1.187 . . . . 3.27 110.437 166.286 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.23 -37.78 81.37 Favored 'General case' 0 C--O 1.225 -0.232 0 O-C-N 121.441 -0.787 . . . . 3.25 109.406 174.266 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.0 ttp -53.33 -53.47 50.53 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 118.952 0.797 . . . . 1.88 109.876 173.719 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -57.21 -41.63 79.81 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 119.207 -0.425 . . . . 3.26 112.021 177.566 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.8 t -55.79 -57.47 11.89 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 118.908 0.776 . . . . 2.22 110.159 172.767 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 40.6 mt -58.97 -53.31 59.87 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.435 1.094 . . . . 1.56 110.971 -171.259 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -68.96 81.05 0.31 Allowed 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 123.66 0.6 . . . . 2.12 109.461 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.8 m -47.27 -33.34 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 C-N-CA 124.252 1.021 . . . . 1.82 111.722 172.468 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -92.83 -11.5 33.49 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.636 0.976 . . . . 2.24 113.636 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 45.41 59.02 3.79 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.587 1.555 . . . . 3.4 111.208 -176.389 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -77.73 -98.88 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 106.316 -1.735 . . . . 3.29 106.316 164.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.1 m 178.72 44.27 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 130.949 3.699 . . . . 1.8 106.003 162.091 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.66 109.34 3.45 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 105.792 -1.929 . . . . 4.01 105.792 -169.07 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -84.7 94.75 8.73 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 105.443 -2.058 . . . . 0.9 105.443 -176.183 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.54 151.67 45.87 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 107.858 -1.164 . . . . 3.24 107.858 175.35 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -39.13 -54.11 1.78 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.593 0.96 . . . . 5.86 113.593 -171.289 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -73.35 -26.95 61.24 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.553 0.575 . . . . 1.78 112.553 -176.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.32 -59.65 3.82 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 108.08 -1.082 . . . . 2.13 108.08 169.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.414 ' CG ' HD13 ' A' ' 33' ' ' LEU . 56.7 t80 -49.92 -49.53 49.49 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 124.044 0.937 . . . . 3.21 110.463 -177.189 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 1.3 t-105 -39.61 -42.41 1.18 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 125.266 1.426 . . . . 4.16 111.393 -178.844 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 -49.13 -38.98 26.87 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-O 117.994 -1.003 . . . . 3.74 112.102 -178.488 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 tp -46.43 -48.12 18.87 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 119.088 0.858 . . . . 0.97 110.763 178.485 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.6 mp -60.78 -34.44 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 108.0 -1.111 . . . . 1.84 108.0 -177.516 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.569 ' HA3' ' CE2' ' B' ' 77' ' ' TRP . . . -70.4 -48.45 37.3 Favored Glycine 0 CA--C 1.491 -1.415 0 C-N-CA 124.217 0.913 . . . . 1.26 110.904 -178.408 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.18 -58.69 7.54 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 104.503 -2.406 . . . . 2.74 104.503 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.674 ' HB2' HD21 ' A' ' 49' ' ' LEU 0.26 3.8 pp -56.01 -40.95 74.15 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.703 1.372 . . . . 2.05 114.703 177.324 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.79 -23.87 66.49 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 118.793 0.724 . . . . 1.44 112.27 174.81 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -80.91 -44.69 17.9 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 125.415 1.486 . . . . 1.91 109.514 168.529 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.427 ' CD ' ' HZ2' ' A' ' 89' ' ' LYS . 36.7 mm-40 -61.84 -34.21 75.55 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 120.061 1.3 . . . . 2.24 111.419 -172.149 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.4 tt -49.04 -37.7 10.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-N 118.114 0.415 . . . . 1.37 111.955 171.849 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.66 -53.96 4.51 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.246 1.018 . . . . 5.36 109.056 176.631 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.427 ' HZ2' ' CD ' ' A' ' 86' ' ' GLU . 3.1 ttpm? . . . . . 0 N--CA 1.437 -1.122 0 C-N-CA 125.601 1.56 . . . . 3.72 112.826 -170.002 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 44.1 mt . . . . . 0 CA--C 1.542 0.659 0 N-CA-C 112.772 0.656 . . . . 2.34 112.772 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 10.2 t -89.36 -132.04 0.09 Allowed 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.04 1.336 . . . . 1.8 110.513 171.238 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -92.44 -59.06 2.17 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.111 1.365 . . . . 2.11 114.03 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.5 mt -62.93 -50.33 71.24 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 120.846 -1.159 . . . . 1.06 111.482 -173.792 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 10' ' ' GLU . . . . . 0.549 ' HG2' HD22 ' A' ' 49' ' ' LEU . 0.0 OUTLIER -88.02 115.22 25.34 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 100.433 -3.914 . . . . 4.82 100.433 138.399 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -54.67 -50.98 66.93 Favored 'General case' 0 C--N 1.342 0.271 1 C-N-CA 133.753 4.821 . . . . 3.68 118.752 19.719 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 52.7 p -51.74 -40.05 59.55 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.474 0.916 . . . . 1.45 113.474 -155.349 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.56 HD12 ' N ' ' B' ' 14' ' ' GLU . 2.7 pp -57.34 -42.68 80.85 Favored 'Isoleucine or valine' 0 C--N 1.339 0.134 0 N-CA-C 112.837 0.68 . . . . 1.03 112.837 174.103 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 14' ' ' GLU . . . . . 0.56 ' N ' HD12 ' B' ' 13' ' ' ILE . 1.2 tm-20 -60.2 -50.04 75.22 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.867 -1.16 . . . . 2.42 107.867 173.544 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -50.05 -38.69 39.2 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.526 0.73 . . . . 2.56 112.882 -178.529 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 35.8 m -80.36 -40.54 19.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 O-C-N 121.124 -0.985 . . . . 1.14 111.924 171.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 18.0 t -55.22 -43.99 73.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 123.645 0.778 . . . . 1.12 111.308 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 10.2 t -57.26 -49.05 77.27 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.233 0.924 . . . . 1.32 110.428 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 34.6 m -57.61 -52.68 64.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.753 -0.462 . . . . 1.28 109.753 176.958 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -46.47 -51.82 14.44 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.407 1.083 . . . . 4.41 111.395 174.131 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -66.18 -53.87 32.11 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.088 0.47 . . . . 3.67 109.8 -173.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 1.3 t -64.55 -32.66 74.4 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 122.092 -0.38 . . . . 3.33 110.363 -176.159 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -61.35 -59.03 5.91 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.591 1.157 . . . . 5.61 110.238 170.33 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.48 -22.94 35.8 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 126.638 1.975 . . . . 1.1 112.033 -178.626 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -18.01 22.58 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 117.678 -1.153 . . . . 4.75 113.456 171.849 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -45.99 -62.37 1.35 Allowed 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.237 1.569 . . . . 2.7 115.237 -172.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -73.11 -42.5 62.89 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 116.174 1.916 . . . . 5.24 116.174 -152.425 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -80.35 -88.29 0.55 Allowed Glycine 0 CA--C 1.528 0.874 0 C-N-CA 130.015 3.674 . . . . 2.82 115.1 18.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 43.49 72.88 0.16 Allowed 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.864 -0.786 . . . . 4.59 109.092 -163.272 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 61.23 2.31 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.951 1.3 . . . . 5.24 111.064 -174.164 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -168.66 -59.7 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 127.286 2.234 . . . . 4.39 106.658 171.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 4.1 p -83.86 149.41 26.39 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.72 -0.673 . . . . 1.81 111.164 -174.05 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -107.12 128.64 54.57 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 107.951 -1.129 . . . . 2.27 107.951 174.573 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 52.8 m -114.11 174.65 5.84 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 119.335 0.97 . . . . 2.92 108.851 166.322 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 12.7 p -84.88 56.1 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.167 0 O-C-N 120.826 -1.171 . . . . 2.66 111.45 -174.977 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -152.9 55.89 0.78 Allowed 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 123.683 1.706 . . . . 2.17 108.24 130.515 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -141.49 -57.51 0.48 Allowed 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 130.408 3.483 . . . . 1.94 101.976 164.142 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -40.76 -52.82 2.93 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.206 1.003 . . . . 2.56 112.616 -177.232 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -68.19 -28.04 66.93 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.373 0.509 . . . . 2.91 112.373 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -66.91 -35.53 80.22 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 121.376 -0.827 . . . . 3.45 110.886 -178.242 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.52 -49.13 70.11 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.324 -0.86 . . . . 2.57 109.181 -176.338 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -62.56 -44.07 99.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 114.957 -1.019 . . . . 0.74 109.217 -176.218 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 99.4 m -57.31 -55.65 32.04 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.583 0.753 . . . . 1.04 111.257 172.555 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -80.9 -62.61 1.62 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.349 0.66 . . . . 1.97 112.443 -162.211 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 -82.41 -39.87 22.06 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 121.805 -0.559 . . . . 2.97 111.985 -173.841 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.62 -12.77 0.19 Allowed Pre-proline 0 CA--C 1.544 0.746 1 N-CA-C 121.954 4.057 . . . . 2.12 121.954 -153.919 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -49.89 -41.46 47.39 Favored 'Trans proline' 0 CA--C 1.535 0.569 0 C-N-CA 122.726 2.284 . . . . 1.9 116.676 -147.644 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 61.5 t-80 -86.77 50.03 1.93 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 120.795 1.634 . . . . 3.35 109.415 -174.654 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.525 HD23 ' HB2' ' B' ' 83' ' ' LEU . 10.3 tp -151.18 -82.52 0.1 Allowed 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.076 0.55 . . . . 1.03 110.444 -175.877 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 69.9 mt -80.64 70.95 7.48 Favored 'General case' 0 CA--C 1.522 -0.117 0 N-CA-C 108.501 -0.926 . . . . 1.59 108.501 171.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.05 137.53 10.27 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.513 -0.921 . . . . 6.08 108.513 155.27 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 16.2 t0 70.71 79.07 0.18 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 126.021 1.728 . . . . 3.35 109.869 -156.641 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 18.1 m -90.47 6.87 4.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 114.085 -1.416 . . . . 1.52 110.209 160.052 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -89.16 -65.13 1.27 Allowed Glycine 0 C--N 1.341 0.854 0 N-CA-C 108.123 -1.991 . . . . 2.3 108.123 -171.022 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 13.0 t -78.17 50.04 0.87 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.104 0.961 . . . . 2.65 108.493 172.068 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.68 -41.47 99.12 Favored 'General case' 0 N--CA 1.445 -0.681 0 O-C-N 120.469 -1.394 . . . . 1.16 108.214 171.323 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -32.33 71.39 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.689 1.596 . . . . 4.35 110.338 -170.734 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -56.8 -55.73 30.63 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.646 1.179 . . . . 2.38 110.615 167.21 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.17 -48.52 73.66 Favored 'General case' 0 C--N 1.343 0.295 0 N-CA-C 108.184 -1.043 . . . . 3.94 108.184 177.682 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -48.88 -51.01 32.17 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 123.576 0.75 . . . . 1.77 110.411 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -49.28 -46.76 46.8 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.379 0.671 . . . . 3.4 111.494 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 10.0 t -71.16 -39.22 72.03 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.95 0.5 . . . . 2.14 111.417 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 41.0 mt -68.63 -46.66 68.62 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.583 1.153 . . . . 1.63 110.826 -174.897 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -61.46 -10.31 7.39 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.694 2.398 . . . . 1.64 115.989 -173.985 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 1.1 p -33.49 -18.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.529 1 C-N-CA 132.607 4.363 . . . . 2.82 119.956 -141.095 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.33 -38.3 41.14 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 120.053 1.297 . . . . 3.24 109.476 156.377 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 70.94 67.68 0.17 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 126.626 1.97 . . . . 3.27 109.303 -177.888 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 16.5 p30 -126.97 -13.66 5.7 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.463 1.905 . . . . 1.97 113.525 -174.055 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 4.5 m 88.53 -10.0 0.48 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 127.203 2.201 . . . . 2.22 114.061 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -111.57 115.04 28.51 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 119.346 0.975 . . . . 3.32 108.922 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.73 97.53 9.18 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 106.016 -1.846 . . . . 1.35 106.016 173.241 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -82.95 178.28 8.23 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.71 0.686 . . . . 4.28 110.67 -178.184 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 42.3 p90 -82.8 52.56 2.16 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 114.066 1.136 . . . . 5.56 114.066 -166.9 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -162.69 47.35 0.15 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.465 -1.309 . . . . 2.37 107.465 126.578 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -96.18 -63.79 1.11 Allowed 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 120.046 -1.658 . . . . 2.07 109.057 153.681 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -50.12 -43.63 51.89 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 125.992 1.717 . . . . 3.48 110.543 -175.759 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 7.7 t-105 -41.78 -43.55 2.97 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.943 0.897 . . . . 4.6 111.637 176.24 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 21.6 mtt180 -45.53 -44.57 12.76 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.615 0.643 . . . . 4.16 111.382 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.0 tp -53.72 -39.47 65.27 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.337 0.655 . . . . 0.87 111.39 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 62.5 mt -65.28 -32.73 59.52 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 N-CA-C 106.688 -1.597 . . . . 1.36 106.688 -177.758 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.559 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -69.22 -44.95 63.47 Favored Glycine 0 CA--C 1.496 -1.152 0 N-CA-C 110.297 -1.121 . . . . 1.45 110.297 -178.747 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 82' ' ' GLU . . . . . 0.442 ' OE2' ' NZ ' ' B' ' 85' ' ' LYS . 3.2 mm-40 -66.17 -62.27 1.58 Allowed 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 106.867 -1.531 . . . . 2.18 106.867 -179.382 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.525 ' HB2' HD23 ' B' ' 49' ' ' LEU . 3.7 pp -54.42 -37.06 64.66 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.466 1.03 . . . . 1.76 112.452 -178.506 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.69 -61.44 2.62 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.549 0.613 . . . . 2.02 109.869 173.143 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 85' ' ' LYS . . . . . 0.442 ' NZ ' ' OE2' ' B' ' 82' ' ' GLU . 2.1 ptpp? -66.73 -23.76 66.14 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 118.037 -0.982 . . . . 1.45 111.789 -173.457 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -53.11 -25.67 13.88 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.993 1.717 . . . . 3.08 111.656 173.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 3.8 tt -59.57 -36.27 64.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 CA-C-N 118.709 0.686 . . . . 1.01 110.447 172.753 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 -82.91 -48.23 10.93 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.801 1.641 . . . . 4.03 112.011 169.527 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 43.5 tttm . . . . . 0 CA--C 1.536 0.405 0 C-N-CA 125.934 1.694 . . . . 6.51 112.043 -159.341 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 . . . . . 0 CA--C 1.542 0.638 0 N-CA-C 109.955 -0.387 . . . . 7.94 109.955 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -82.5 -13.93 9.47 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.964 2.443 . . . . 7.44 113.291 -173.926 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 58.5 mt -72.23 134.8 45.82 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.38 0.672 . . . . 2.28 110.737 -162.255 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.6 t -63.52 -61.65 2.19 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.916 0.886 . . . . 3.62 112.062 -170.317 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -177.97 -75.32 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 126.253 1.821 . . . . 3.31 106.475 -175.438 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.06 -42.93 40.26 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.471 0.708 . . . . 1.25 111.154 171.88 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -49.64 -44.0 47.26 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.586 1.154 . . . . 2.24 112.497 174.018 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -54.59 -49.55 70.14 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.982 0.81 . . . . 3.81 109.229 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.3 t -63.78 -54.2 38.94 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.762 -0.654 . . . . 2.26 109.812 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.515 HG21 HD12 ' B' ' 83' ' ' LEU 0.352 2.8 pp -62.81 -34.6 66.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 C-N-CA 118.503 -1.279 . . . . 0.79 112.562 -178.042 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -61.06 -56.64 18.66 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 119.352 0.978 . . . . 2.86 108.95 173.142 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.88 -39.31 65.6 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.878 0.847 . . . . 1.39 111.556 -171.798 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.8 m -75.23 -37.43 39.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 120.798 -1.189 . . . . 0.9 111.815 175.644 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 28.3 t -58.66 -48.68 85.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 119.808 1.186 . . . . 0.88 110.803 174.225 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -59.52 -38.32 80.67 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.853 -1.154 . . . . 0.99 110.347 175.351 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.0 m -56.14 -49.82 72.85 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 118.669 0.668 . . . . 1.02 110.115 171.482 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -50.99 -52.7 40.11 Favored 'General case' 0 C--N 1.342 0.276 0 CA-C-N 118.613 0.642 . . . . 5.01 109.805 176.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -55.94 -58.21 8.83 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.199 0.444 . . . . 3.49 112.199 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -65.07 -24.31 67.42 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 121.152 0.501 . . . . 2.38 111.397 -175.316 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.512 ' CZ ' ' HB2' ' A' ' 41' ' ' LEU . 8.1 t80 -80.55 -51.77 8.38 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 124.271 1.028 . . . . 4.55 112.711 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.7 -22.89 65.73 Favored 'General case' 0 C--O 1.24 0.59 0 C-N-CA 126.352 1.861 . . . . 1.52 113.065 -166.153 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -69.12 -19.8 64.04 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.215 1.406 . . . . 4.69 112.385 175.575 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -41.9 -62.19 0.96 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.396 0.998 . . . . 2.82 113.041 -172.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -127.37 106.8 9.45 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 126.495 1.918 . . . . 3.86 105.93 -175.68 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 62.56 118.11 0.01 OUTLIER Glycine 0 CA--C 1.534 1.269 0 CA-C-N 118.822 0.737 . . . . 2.4 113.763 169.654 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.0 ttm180 63.41 102.85 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 121.794 0.806 . . . . 4.89 113.006 162.63 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt -73.06 59.96 0.54 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.219 1.007 . . . . 5.93 112.845 -177.256 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -156.19 -62.76 0.11 Allowed 'General case' 0 C--O 1.231 0.091 0 C-N-CA 128.023 2.529 . . . . 3.69 106.404 177.018 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.0 p -84.13 135.55 34.34 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 123.666 0.786 . . . . 2.12 110.993 -174.071 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -88.93 143.6 26.76 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.418 -0.956 . . . . 2.45 108.418 168.109 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.9 m -111.9 175.86 5.26 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.349 0.659 . . . . 2.05 109.952 168.839 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.9 p -57.05 -50.22 77.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 N-CA-C 114.008 1.114 . . . . 3.09 114.008 -164.327 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -64.94 -50.41 66.54 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 118.697 0.68 . . . . 3.19 109.184 -177.089 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -37.02 -57.85 0.81 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.149 1.38 . . . . 2.28 110.097 166.001 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.49 -55.6 23.99 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 121.917 -0.489 . . . . 3.12 110.75 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -55.84 -41.94 75.05 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 120.658 -0.417 . . . . 4.22 111.505 -177.414 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -49.94 -44.09 50.34 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 118.159 0.436 . . . . 2.9 111.022 177.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.512 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 9.6 tp -66.47 -47.58 72.63 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.831 0.741 . . . . 2.73 109.323 -173.195 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 23.3 m -74.12 -29.13 24.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-N 115.041 -0.981 . . . . 1.66 109.951 -171.58 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 84.8 m -78.05 -47.04 19.27 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.712 0.805 . . . . 2.36 110.263 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -81.39 -59.95 2.44 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.373 1.069 . . . . 2.79 111.93 -171.321 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.459 HE21 HD12 ' A' ' 41' ' ' LEU . 3.3 mp0 -76.8 -51.8 10.69 Favored 'General case' 0 C--N 1.338 0.083 0 O-C-N 122.101 -0.375 . . . . 4.41 110.206 -169.985 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 mp -81.69 114.44 50.04 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 124.846 1.258 . . . . 1.93 110.033 -171.623 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -84.79 -58.96 0.02 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 122.965 2.444 . . . . 2.11 110.304 -174.34 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -141.26 9.03 2.06 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.068 0.947 . . . . 4.49 113.442 -168.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.4 tp -55.68 -78.88 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 122.073 0.939 . . . . 1.87 109.348 171.148 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.6 mt -79.4 -55.88 4.74 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.539 -0.912 . . . . 3.69 108.539 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 39.79 38.14 0.41 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.467 1.907 . . . . 5.49 112.331 -168.507 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 62.2 t0 -108.37 12.51 26.28 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 130.137 3.375 . . . . 6.15 108.616 -175.769 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 18.8 m -66.25 -22.43 30.2 Favored 'Isoleucine or valine' 0 C--N 1.341 0.207 0 C-N-CA 124.738 1.215 . . . . 2.28 112.172 -171.781 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.6 -32.55 46.63 Favored Glycine 0 CA--C 1.529 0.967 0 N-CA-C 111.009 -0.836 . . . . 3.33 111.009 169.658 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 18.7 m -124.22 60.42 1.14 Allowed 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.186 0.994 . . . . 3.06 108.928 178.591 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -74.37 -38.65 63.12 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.792 1.237 . . . . 1.77 110.172 176.096 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -54.51 -50.84 66.88 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.406 0.682 . . . . 4.37 111.415 -173.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -57.21 -41.44 79.42 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 121.897 -0.502 . . . . 2.8 111.713 177.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.04 -59.33 5.44 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.36 -0.978 . . . . 2.61 108.36 173.122 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -46.84 -51.48 16.5 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.202 0.601 . . . . 1.52 111.001 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -56.99 -47.6 80.42 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.665 0.786 . . . . 3.33 110.72 177.6 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 45.6 m -59.62 -39.67 85.06 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 122.195 -0.316 . . . . 1.85 111.419 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -69.81 -49.43 52.83 Favored 'General case' 0 CA--C 1.53 0.18 0 O-C-N 121.933 -0.479 . . . . 1.79 110.812 176.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -76.85 62.28 2.04 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.661 0.784 . . . . 1.82 110.043 -176.718 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.6 m -56.78 -31.32 35.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 124.698 1.199 . . . . 1.78 112.194 -176.101 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -88.8 -3.0 58.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.558 1.543 . . . . 2.58 112.057 178.8 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 54.87 63.35 2.16 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 125.6 1.56 . . . . 4.21 111.982 165.042 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.3 p30 -130.41 -1.77 4.42 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.784 1.234 . . . . 2.2 112.894 -173.979 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.2 p 64.3 12.67 7.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.231 1.812 . . . . 2.98 114.062 -175.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -113.37 106.47 14.63 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.614 1.565 . . . . 3.27 108.377 169.043 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.14 81.78 7.25 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 103.414 -2.81 . . . . 1.11 103.414 167.201 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.3 ttmt -67.37 161.15 25.81 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.638 0.775 . . . . 4.44 108.985 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -38.65 -53.57 1.61 Allowed 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.309 1.226 . . . . 5.79 114.309 -169.941 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -65.06 -40.22 94.4 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 121.53 -0.731 . . . . 2.28 112.637 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -63.8 -52.73 58.92 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.805 -1.183 . . . . 1.99 107.805 178.631 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -52.13 -45.59 65.03 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.55 0.74 . . . . 3.12 110.704 176.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.454 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.4 OUTLIER -40.29 -45.1 2.04 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-O 117.364 -1.303 . . . . 5.25 110.382 173.59 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -39.36 -46.34 1.59 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 120.753 1.615 . . . . 5.45 111.776 -178.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.2 tp -56.25 -45.14 80.17 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.016 0.826 . . . . 0.97 112.989 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.1 mt -69.44 -40.78 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 C-N-CA 125.155 1.382 . . . . 2.29 108.18 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.437 ' HA3' ' CZ2' ' B' ' 77' ' ' TRP . . . -44.45 -57.99 4.82 Favored Glycine 0 N--CA 1.436 -1.337 0 N-CA-C 109.529 -1.428 . . . . 2.14 109.529 172.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -66.57 -50.97 61.37 Favored 'General case' 0 N--CA 1.435 -1.213 0 CA-C-N 112.134 -2.033 . . . . 2.8 107.751 -174.308 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.1 tp -37.26 -53.88 1.06 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.297 1.839 . . . . 3.06 111.747 -178.807 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.02 -34.02 65.46 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.976 0.911 . . . . 1.83 112.802 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -81.84 -48.18 11.9 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.119 0.968 . . . . 2.19 111.637 170.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.25 -26.52 66.5 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 123.743 0.817 . . . . 4.08 112.909 -170.309 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.6 tp -36.79 -47.27 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 123.5 0.72 . . . . 1.56 111.046 165.44 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.52 -51.54 6.81 Favored 'General case' 0 C--N 1.345 0.382 0 O-C-N 121.472 -0.767 . . . . 5.03 109.979 170.203 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.3 tttt . . . . . 0 CA--C 1.538 0.503 0 C-N-CA 125.148 1.379 . . . . 3.66 112.177 -170.341 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.428 ' HB2' ' HB3' ' B' ' 10' ' ' GLU . 0.7 OUTLIER . . . . . 0 N--CA 1.447 -0.597 0 N-CA-C 109.723 -0.473 . . . . 3.76 109.723 . . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.406 HG22 ' HB2' ' B' ' 10' ' ' GLU . 10.7 t -75.33 -166.24 0.5 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.03 0.932 . . . . 2.08 111.907 -172.391 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -73.82 -60.17 2.38 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.049 -0.407 . . . . 2.82 111.091 -171.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mt -47.59 -45.75 27.59 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.169 -0.957 . . . . 1.33 110.363 172.888 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 10' ' ' GLU . . . . . 0.428 ' HB3' ' HB2' ' B' ' 6' ' ' LEU . 2.0 tt0 -48.71 -58.78 4.23 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 126.043 1.737 . . . . 3.22 112.981 170.4 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.22 -36.9 83.38 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 120.863 -1.148 . . . . 5.11 109.204 -176.917 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 15.8 m -63.17 -37.07 85.77 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.925 0.49 . . . . 2.22 111.329 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.335 2.9 pp -70.51 -38.99 75.62 Favored 'Isoleucine or valine' 0 C--N 1.343 0.292 0 CA-C-N 118.691 0.678 . . . . 1.53 111.428 167.585 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -55.33 -52.18 64.34 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.421 1.01 . . . . 3.68 110.76 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 11.9 t -55.02 -39.63 69.33 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.42 0.629 . . . . 1.78 111.66 -176.532 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 25.6 m -77.61 -34.8 20.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 120.713 -1.242 . . . . 1.39 110.781 177.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 45.3 t -59.22 -45.54 92.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-N 119.167 0.894 . . . . 1.27 110.366 173.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.2 t -65.59 -42.41 91.73 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.711 0.687 . . . . 1.6 110.412 177.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 34.9 m -55.46 -47.34 76.23 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.089 0.859 . . . . 1.3 110.282 174.367 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -53.44 -56.43 16.93 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.157 -0.965 . . . . 3.8 110.173 172.346 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -49.52 -51.07 38.98 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.498 1.519 . . . . 3.62 111.585 -177.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 32.5 p -64.07 -28.59 69.89 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.184 -0.436 . . . . 2.3 111.736 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -82.17 -34.5 29.04 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-N 118.665 0.666 . . . . 2.98 111.791 170.309 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.54 -39.48 73.45 Favored 'General case' 0 C--O 1.239 0.531 0 O-C-N 120.949 -1.094 . . . . 1.03 110.475 -172.636 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 5.2 ptt180 -53.97 -44.09 70.5 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.626 -0.715 . . . . 4.22 111.755 174.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.428 ' CB ' ' HG2' ' B' ' 37' ' ' GLU . 0.5 OUTLIER -41.62 -66.24 0.36 Allowed 'General case' 0 N--CA 1.443 -0.792 0 O-C-N 124.249 0.968 . . . . 2.05 113.012 -126.572 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -96.92 -72.84 0.62 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 124.13 1.919 . . . . 6.09 112.385 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.44 80.63 1.51 Allowed Glycine 0 N--CA 1.439 -1.109 0 CA-C-N 112.076 -2.329 . . . . 2.69 109.579 -171.525 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 15.2 ttt180 71.44 111.93 0.06 Allowed 'General case' 0 C--O 1.241 0.647 0 CA-C-N 120.725 2.262 . . . . 6.09 114.026 159.733 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -66.98 64.37 0.05 Allowed 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.886 -1.134 . . . . 4.0 111.727 172.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -132.48 -65.77 0.71 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 125.374 1.47 . . . . 4.96 107.261 172.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 50.0 m -113.93 159.83 19.46 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.18 -0.918 . . . . 2.26 110.812 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 10.5 mp -98.73 123.27 42.85 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.518 1.127 . . . . 2.16 109.036 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 1.1 t -94.87 176.77 6.13 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.509 1.123 . . . . 3.04 109.377 173.402 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 23.3 m -88.55 52.94 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 O-C-N 120.655 -1.278 . . . . 2.89 112.012 -178.925 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -157.54 58.11 0.5 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 106.103 -1.814 . . . . 2.54 106.103 143.912 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.428 ' HG2' ' CB ' ' B' ' 26' ' ' GLN . 50.4 mt-10 -163.34 -57.21 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 129.578 3.151 . . . . 2.21 103.167 -176.121 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.439 ' CZ ' HD13 ' B' ' 63' ' ' LEU . 4.2 t80 -62.01 -59.94 4.34 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.377 -1.283 . . . . 2.26 109.456 171.426 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -56.82 -40.88 76.8 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 120.27 -0.572 . . . . 3.57 110.749 -174.863 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -50.7 -41.27 55.85 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.188 0.305 . . . . 2.64 111.437 175.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.18 -55.96 26.26 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.674 -1.232 . . . . 2.42 107.674 -175.818 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.2 m -67.94 -44.26 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.674 -0.693 . . . . 0.96 109.574 -170.602 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 87.5 m -62.86 -47.61 82.63 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 124.061 0.945 . . . . 1.58 110.243 -178.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -80.62 -55.79 4.61 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.085 0.402 . . . . 2.92 112.085 -173.428 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -81.19 -41.83 21.74 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 113.798 1.036 . . . . 2.95 113.798 -158.861 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -62.03 -28.76 4.16 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.186 0.81 . . . . 1.9 113.186 -156.509 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -57.27 -24.55 60.27 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.132 -2.445 . . . . 2.14 111.342 -78.21 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -91.52 -33.24 15.25 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.899 1.679 . . . . 2.93 110.653 -175.892 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 42.8 tp -58.61 -56.4 22.68 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.507 0.323 . . . . 1.32 111.449 -165.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 30.2 mt -87.24 162.69 17.3 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 108.404 -0.962 . . . . 1.97 108.404 161.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.29 170.92 14.75 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 107.557 -1.275 . . . . 4.94 107.557 165.373 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 18.7 t0 55.15 72.63 0.46 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 123.393 1.568 . . . . 4.2 109.25 -161.814 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 28.0 m -87.7 22.21 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 112.643 -2.071 . . . . 1.93 109.786 160.778 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -103.59 -70.74 0.84 Allowed Glycine 0 C--N 1.342 0.89 0 N-CA-C 108.81 -1.716 . . . . 2.61 108.81 -177.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 46.7 t -79.02 50.2 1.01 Allowed 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.619 1.167 . . . . 3.3 109.677 178.248 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -50.94 -41.65 59.16 Favored 'General case' 0 N--CA 1.444 -0.752 0 C-N-CA 125.679 1.592 . . . . 1.44 109.066 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -30.47 -48.18 0.1 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 127.743 2.417 . . . . 4.14 113.526 170.739 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -60.35 -54.55 44.33 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.309 0.576 . . . . 2.85 110.28 178.309 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 59' ' ' LYS . . . . . 0.422 ' H ' ' HE3' ' B' ' 59' ' ' LYS . 0.0 OUTLIER -58.3 -54.29 48.68 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.115 -1.439 . . . . 4.24 107.115 -179.547 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -45.51 -55.05 6.64 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.863 1.265 . . . . 1.76 110.635 178.247 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -64.43 -39.82 94.56 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.268 0.485 . . . . 3.14 110.855 -177.586 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.4 t -63.89 -30.23 71.33 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 122.833 0.453 . . . . 1.57 111.791 175.549 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.439 HD13 ' CZ ' ' B' ' 38' ' ' PHE . 36.6 mt -80.13 -53.91 6.25 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.595 1.158 . . . . 1.33 110.809 -178.97 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.261 16.8 t0 -54.63 -8.47 0.24 Allowed 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 128.531 2.732 . . . . 1.75 117.324 -168.869 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.8 m -34.17 -20.14 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 130.706 3.602 . . . . 1.92 119.762 -134.95 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -60.35 -25.16 65.64 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 121.281 1.855 . . . . 3.69 111.043 161.804 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 62.33 64.12 0.98 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.939 1.695 . . . . 3.47 109.908 176.147 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 39.4 p30 -104.33 -27.42 11.99 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.029 1.332 . . . . 2.56 111.546 176.363 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 35.0 m 111.35 -21.06 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.337 3.055 . . . . 2.31 111.926 -174.503 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -113.18 114.8 27.27 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 125.882 1.673 . . . . 6.14 108.566 -168.316 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -83.16 104.56 13.44 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.76 1.224 . . . . 1.42 108.336 -176.171 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -84.28 174.32 10.25 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 127.462 2.305 . . . . 5.36 112.339 -165.579 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -80.42 55.2 2.21 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.512 0.725 . . . . 5.5 109.782 167.137 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 8.3 p-10 -167.53 46.68 0.05 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 120.316 -0.554 . . . . 4.76 111.067 102.121 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 69.2 mt-10 -91.33 -60.09 1.98 Allowed 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.473 1.509 . . . . 2.18 108.577 162.094 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -45.2 -41.48 8.31 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 125.011 1.324 . . . . 3.56 111.707 -175.688 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.461 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 1.4 t90 -39.5 -48.93 2.07 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 124.527 1.142 . . . . 4.52 109.312 178.632 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 48.6 mtp85 -42.58 -36.93 1.51 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.197 0.908 . . . . 4.32 113.15 -176.153 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.1 tp -63.69 -45.26 90.83 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.829 1.195 . . . . 0.93 111.177 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 8.2 pt -77.74 -31.52 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 C-N-CA 124.216 1.006 . . . . 3.63 108.664 -177.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -46.83 -59.27 5.62 Favored Glycine 0 N--CA 1.433 -1.563 0 N-CA-C 108.461 -1.856 . . . . 1.78 108.461 165.704 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -74.51 -53.97 8.43 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 113.531 -1.334 . . . . 2.87 110.916 -169.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.515 HD12 HG21 ' A' ' 13' ' ' ILE 0.292 4.5 pp -50.6 -29.28 10.5 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 121.116 1.78 . . . . 1.85 113.157 -175.892 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.63 -46.63 77.39 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.761 0.652 . . . . 1.14 112.761 168.263 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -77.45 -35.21 54.13 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 117.871 -1.062 . . . . 2.04 112.281 172.415 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -52.99 -31.92 43.47 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 120.753 1.615 . . . . 3.22 112.17 -172.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 9.2 tt -43.34 -46.44 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 123.16 0.584 . . . . 1.52 111.61 170.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 9.5 ptm85 -85.55 -49.51 7.98 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.326 1.45 . . . . 3.81 113.699 168.574 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 23.4 tttm . . . . . 0 CA--C 1.531 0.247 0 O-C-N 121.128 -0.983 . . . . 6.91 111.659 -174.558 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 . . . . . 0 N--CA 1.451 -0.385 0 N-CA-C 109.031 -0.729 . . . . 4.93 109.031 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -72.06 154.46 57.56 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 122.174 1.916 . . . . 2.13 108.754 175.202 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 73.6 mt -109.33 169.68 8.54 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.187 0.995 . . . . 1.32 108.577 -174.459 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.5 t -75.18 159.97 30.97 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 120.885 -1.134 . . . . 1.75 110.504 -176.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -46.45 -56.85 5.32 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.193 -0.942 . . . . 2.79 113.164 -175.811 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 mt -61.08 -44.44 97.37 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.532 -0.747 . . . . 1.57 111.085 -178.307 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -54.36 -53.14 57.9 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.536 2.334 . . . . 2.66 112.208 173.65 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -53.26 -55.7 22.43 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.406 1.082 . . . . 3.58 109.274 172.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.0 t -53.08 -51.84 60.54 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.581 0.752 . . . . 1.72 112.076 -178.768 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.4 pp -65.56 -39.32 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-O 118.472 -0.775 . . . . 0.68 110.155 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -56.06 -58.08 9.42 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 119.138 0.881 . . . . 2.45 109.653 177.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.2 t -54.7 -40.86 69.59 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.351 0.596 . . . . 1.25 111.726 -172.219 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.4 m -74.28 -35.54 40.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 O-C-N 120.929 -1.107 . . . . 0.61 111.401 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 37.4 t -60.6 -48.4 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 119.285 0.948 . . . . 0.52 110.114 175.089 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.1 t -62.52 -42.08 99.27 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.077 0.853 . . . . 0.68 110.623 177.104 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 48.4 m -57.52 -53.45 57.98 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 118.736 0.698 . . . . 0.73 110.226 176.125 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -45.61 -54.1 8.18 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.109 0.964 . . . . 3.02 109.98 171.535 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -60.93 -50.19 74.39 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.578 0.751 . . . . 3.21 111.772 -173.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.0 t -63.94 -30.8 71.85 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.95 -0.469 . . . . 1.94 110.836 -178.561 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -69.71 -42.64 73.75 Favored 'General case' 0 C--O 1.221 -0.406 0 O-C-N 121.631 -0.668 . . . . 2.81 111.13 166.997 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.81 -22.48 66.93 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 125.259 1.423 . . . . 0.76 112.747 -170.283 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.253 0.0 OUTLIER -80.66 -15.73 55.82 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 117.112 -1.423 . . . . 4.08 113.543 175.046 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.69 -66.09 0.33 Allowed 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 120.071 1.305 . . . . 2.21 112.595 178.182 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -117.44 172.73 7.14 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 126.621 1.968 . . . . 2.47 107.219 -173.972 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -3.52 112.5 0.01 OUTLIER Glycine 0 CA--C 1.531 1.059 0 C-N-CA 127.906 2.67 . . . . 1.62 114.454 172.299 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.5 mtp180 62.99 106.54 0.03 OUTLIER 'General case' 0 C--O 1.236 0.387 0 N-CA-C 114.309 1.226 . . . . 6.09 114.309 175.618 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 51.56 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.835 1.654 . . . . 4.67 112.263 157.099 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -148.14 -53.13 0.19 Allowed 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 125.746 1.618 . . . . 3.99 107.505 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -118.96 162.71 18.07 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 124.533 1.133 . . . . 1.65 111.339 -175.727 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 mp -112.92 170.17 8.39 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 124.547 1.139 . . . . 2.36 110.461 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.6 t -153.77 179.48 8.82 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.991 1.716 . . . . 3.33 106.794 175.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.7 t -37.28 -62.85 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 125.768 1.627 . . . . 2.46 113.619 -166.349 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -66.2 -56.29 12.05 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.647 0.658 . . . . 2.18 109.951 -174.52 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -38.84 -45.89 1.22 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.238 1.415 . . . . 1.72 112.704 171.826 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -67.53 -58.02 5.45 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 122.996 0.519 . . . . 2.76 110.304 176.824 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -54.17 -39.98 67.1 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.071 0.396 . . . . 2.84 111.11 -174.215 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -47.76 -40.43 20.65 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 112.741 0.645 . . . . 3.03 112.741 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 tp -66.22 -45.92 79.01 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-N 119.404 1.002 . . . . 2.63 108.787 -175.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.8 m -68.15 -53.6 28.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 N-CA-C 108.66 -0.867 . . . . 1.35 108.66 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 93.9 m -53.08 -48.9 67.39 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.983 0.913 . . . . 1.23 111.983 179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -80.39 -52.88 7.16 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.751 0.42 . . . . 2.03 111.433 -174.663 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -106.0 6.55 31.36 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.523 1.129 . . . . 3.39 113.087 -162.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 tp -136.28 84.03 30.7 Favored Pre-proline 0 CA--C 1.537 0.457 0 O-C-N 121.079 -1.013 . . . . 1.96 108.36 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.07 -29.23 48.49 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.431 2.088 . . . . 2.35 111.696 -170.554 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -141.22 -99.52 0.14 Allowed 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 118.901 -0.571 . . . . 3.86 109.556 173.347 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.466 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 5.8 tp 51.39 -87.99 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.785 1.634 . . . . 1.5 113.127 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.4 mt -73.62 -29.52 62.41 Favored 'General case' 0 N--CA 1.458 -0.034 0 C-N-CA 125.743 1.617 . . . . 3.1 110.66 177.373 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 49.4 -173.26 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.948 2.099 . . . . 6.64 113.057 -179.097 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 46.64 42.59 11.6 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 125.958 1.703 . . . . 6.41 111.482 170.106 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -61.74 2.08 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 127.985 2.514 . . . . 2.54 113.613 -177.497 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.17 -70.15 0.97 Allowed Glycine 0 CA--C 1.53 1.0 0 N-CA-C 109.502 -1.439 . . . . 1.74 109.502 164.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -81.9 63.81 6.31 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 122.664 1.221 . . . . 1.97 110.156 -174.855 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -73.23 -28.93 62.44 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 124.553 1.141 . . . . 1.62 109.706 175.85 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 29.7 p-10 -42.02 -52.89 4.08 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.537 1.535 . . . . 4.76 112.371 173.229 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -49.2 -50.75 36.81 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.647 0.779 . . . . 4.27 110.082 176.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.45 -47.53 75.84 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.8 -0.444 . . . . 3.12 109.8 -177.259 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 16.2 tmm? -52.41 -43.69 64.95 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 123.284 0.634 . . . . 3.28 109.466 176.625 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.6 tptt -70.17 -38.32 75.38 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 122.663 0.385 . . . . 4.89 111.658 178.569 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.2 m -58.97 -34.87 72.3 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.807 0.443 . . . . 2.44 110.443 172.691 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 83.8 mt -69.37 -78.27 0.07 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 109.433 -0.58 . . . . 2.4 109.433 168.553 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.62 80.13 4.1 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 122.012 0.91 . . . . 2.55 110.443 -178.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.2 m -65.19 -19.16 25.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-N 115.617 -0.72 . . . . 3.59 111.318 165.959 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -69.42 -58.36 4.09 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 118.92 -0.562 . . . . 4.02 112.232 -168.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 121.85 -35.39 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 130.503 3.521 . . . . 3.99 110.322 -167.653 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' ASP . . . . . 0.434 ' C ' ' H ' ' A' ' 70' ' ' GLU . 4.0 p-10 -62.54 99.99 0.17 Allowed 'General case' 0 C--N 1.347 0.464 0 N-CA-C 105.711 -1.959 . . . . 4.22 105.711 169.852 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.0 m -78.94 36.15 0.27 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.222 1.409 . . . . 2.83 111.664 -166.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . 0.434 ' H ' ' C ' ' A' ' 68' ' ' ASP . 12.1 mp0 -121.27 121.11 37.0 Favored 'General case' 0 N--CA 1.426 -1.656 0 C-N-CA 131.647 3.979 . . . . 5.92 102.898 -178.544 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -93.15 101.25 13.54 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 106.734 -1.58 . . . . 0.98 106.734 -177.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.95 160.05 15.67 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.51 1.124 . . . . 3.72 108.575 169.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -40.45 -60.02 1.2 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.587 1.155 . . . . 5.27 111.667 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -69.14 -25.7 64.51 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.565 0.746 . . . . 1.74 112.036 -176.679 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -68.04 -59.61 3.12 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 108.497 -0.927 . . . . 1.93 108.497 172.547 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -55.44 -43.11 75.09 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.643 0.377 . . . . 3.18 110.496 -175.695 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 8.2 t-105 -39.97 -37.2 0.55 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.688 1.195 . . . . 4.17 112.171 173.578 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 44.2 mtt180 -39.49 -48.0 1.93 Allowed 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 120.302 1.41 . . . . 3.84 112.12 173.191 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.7 tp -51.52 -38.85 56.08 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.703 0.801 . . . . 0.97 111.492 -178.056 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 84.5 mt -67.05 -32.19 56.76 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 108.269 -1.011 . . . . 1.94 108.269 -176.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.556 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -69.61 -46.19 55.76 Favored Glycine 0 CA--C 1.485 -1.822 0 N-CA-C 110.025 -1.23 . . . . 1.24 110.025 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -61.79 -57.2 12.77 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 105.716 -1.957 . . . . 2.41 105.716 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.466 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 4.4 mp -38.39 -59.99 0.84 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 120.074 1.307 . . . . 2.75 112.339 172.476 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.46 -28.13 69.6 Favored 'General case' 0 C--O 1.225 -0.231 0 N-CA-C 113.153 0.798 . . . . 1.28 113.153 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.0 ttmt -81.45 -62.4 1.66 Allowed 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.814 1.246 . . . . 1.56 110.522 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -39.85 -49.5 2.39 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 126.489 1.915 . . . . 2.44 110.536 -174.007 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.513 HG21 HG21 ' B' ' 17' ' ' VAL . 12.2 tt -37.12 -43.71 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 125.513 1.525 . . . . 1.19 113.128 177.074 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.31 67.36 1.08 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.392 1.077 . . . . 6.66 109.86 165.457 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 84.6 tttt . . . . . 0 C--N 1.327 -0.384 0 C-N-CA 124.389 1.075 . . . . 4.25 109.252 170.753 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 46.7 mt . . . . . 0 CA--C 1.539 0.545 0 N-CA-C 111.536 0.198 . . . . 2.92 111.536 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.494 HG23 ' N ' ' B' ' 8' ' ' GLU . 6.1 t -76.27 -68.52 0.58 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.38 1.472 . . . . 2.72 114.276 178.431 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.494 ' N ' HG23 ' B' ' 7' ' ' THR . 43.6 tt0 -169.57 -71.69 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.09 1.356 . . . . 2.19 108.702 -164.238 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.1 mt -51.58 -45.32 63.07 Favored 'General case' 0 C--N 1.341 0.199 0 O-C-N 121.37 -0.831 . . . . 1.14 109.243 166.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 10' ' ' GLU . . . . . 0.463 ' OE1' HG22 ' B' ' 7' ' ' THR . 47.0 mt-10 -51.55 -47.27 63.49 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.514 1.526 . . . . 3.17 111.621 172.318 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -59.4 -48.46 81.56 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.224 -0.923 . . . . 3.69 110.072 176.504 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 14.4 p -62.93 -40.79 98.71 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.284 -0.885 . . . . 1.25 111.282 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.617 ' O ' HG23 ' B' ' 17' ' ' VAL 0.358 2.9 pp -62.15 -37.87 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 O-C-N 121.159 -0.963 . . . . 1.0 110.525 174.15 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -59.04 -46.07 89.16 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 119.189 -1.004 . . . . 3.3 111.961 170.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . 0.29 1.3 t -56.03 -36.7 68.27 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 120.2 1.363 . . . . 1.38 112.002 -177.056 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 8.8 m -76.17 -35.82 29.18 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 O-C-N 120.414 -1.429 . . . . 0.81 111.578 174.464 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.617 HG23 ' O ' ' B' ' 13' ' ' ILE . 94.1 t -57.63 -46.69 86.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 119.188 0.903 . . . . 1.29 110.254 174.653 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.8 t -64.54 -40.84 96.32 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.411 -0.805 . . . . 1.58 110.474 177.908 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 27.6 m -57.25 -54.87 41.89 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.478 1.036 . . . . 1.21 109.355 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -42.15 -60.79 1.33 Allowed 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 124.799 1.239 . . . . 4.43 110.582 171.877 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -57.78 -54.18 49.79 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.035 0.934 . . . . 3.72 111.683 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 36.9 p -57.33 -43.34 83.29 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 122.842 0.457 . . . . 2.37 110.908 -177.639 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -68.49 -43.64 76.46 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 118.565 0.62 . . . . 2.88 111.591 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.87 -32.77 63.96 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 125.48 1.512 . . . . 1.01 110.33 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.14 -26.34 66.2 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 117.781 -1.104 . . . . 4.2 112.581 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.484 ' CB ' ' HG2' ' B' ' 37' ' ' GLU . 1.1 tp60 -52.96 -64.15 0.91 Allowed 'General case' 0 C--N 1.343 0.323 0 N-CA-C 114.799 1.407 . . . . 2.26 114.799 -153.783 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -89.43 -72.86 0.53 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.891 0.853 . . . . 2.89 110.535 -170.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.88 155.74 22.64 Favored Glycine 0 C--N 1.336 0.54 0 C-N-CA 126.634 2.064 . . . . 1.83 110.594 164.458 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 39.06 105.23 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 116.367 1.988 . . . . 4.59 116.367 131.891 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -72.74 15.33 0.2 Allowed 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.816 1.784 . . . . 4.73 115.816 -171.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 27.7 p-10 -90.99 -39.9 11.96 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 126.238 1.815 . . . . 4.64 110.205 175.16 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 11.6 p -99.67 141.33 32.62 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 127.889 2.475 . . . . 2.52 108.951 -164.938 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -89.25 179.62 6.07 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 107.779 -1.193 . . . . 2.1 107.779 147.091 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 17.0 t -155.66 -168.32 2.77 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 123.279 1.514 . . . . 2.35 112.191 -144.276 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 5.2 t -69.36 -157.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 N-CA-C 100.807 -3.775 . . . . 3.08 100.807 135.936 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -76.66 57.74 1.3 Allowed 'General case' 0 CA--C 1.549 0.915 1 O-C-N 116.153 -4.092 . . . . 2.93 112.866 -136.181 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.484 ' HG2' ' CB ' ' B' ' 26' ' ' GLN . 36.9 mt-10 -80.21 -44.53 19.6 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 127.504 2.322 . . . . 2.07 108.259 125.359 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.413 ' CZ ' HD13 ' B' ' 63' ' ' LEU . 0.2 OUTLIER -65.33 -54.35 30.2 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 122.071 -0.393 . . . . 2.45 111.756 -170.041 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 28.6 tttt -59.69 -32.5 70.55 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 118.706 -1.198 . . . . 3.25 110.367 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -57.56 -33.48 68.18 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 112.59 0.589 . . . . 2.79 112.59 172.774 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -63.46 -55.5 23.71 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 107.836 -1.172 . . . . 2.81 107.836 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -69.66 -38.91 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 CA-C-N 116.028 -0.533 . . . . 0.85 110.1 -171.988 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 98.1 m -62.57 -54.57 37.74 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.77 0.828 . . . . 0.84 110.684 175.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -72.36 -60.07 2.42 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.107 -0.371 . . . . 3.02 110.755 -172.655 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -80.02 -58.41 3.17 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 122.301 -0.249 . . . . 3.37 111.38 -159.619 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 46' ' ' LEU . . . . . 0.441 HD11 HD22 ' B' ' 83' ' ' LEU . 2.0 mm? -50.53 -38.57 42.16 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 124.729 1.211 . . . . 2.02 114.242 -155.422 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -52.54 -49.15 18.45 Favored 'Trans proline' 0 N--CA 1.452 -0.914 0 C-N-CA 119.783 -3.007 . . . . 2.09 109.021 -76.745 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -51.34 -52.6 44.02 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 126.915 2.086 . . . . 3.22 112.129 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.412 HD23 ' HB2' ' B' ' 83' ' ' LEU . 21.6 tp -54.52 -46.9 73.6 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.607 0.242 . . . . 1.02 110.941 -163.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 91.9 mt -106.16 68.03 0.76 Allowed 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 124.913 1.285 . . . . 1.62 110.046 165.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.29 0.49 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 129.084 2.954 . . . . 6.15 117.715 158.108 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -107.15 90.88 3.44 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 105.233 -2.136 . . . . 3.55 105.233 162.406 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 30.2 m -97.38 21.0 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 115.391 -0.822 . . . . 2.23 109.133 164.468 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -95.17 -76.12 1.31 Allowed Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 108.239 -1.944 . . . . 2.51 108.239 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 11.5 m -79.4 52.25 1.34 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 126.637 1.975 . . . . 2.42 111.465 -164.736 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -67.98 -28.48 67.47 Favored 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 124.129 0.972 . . . . 1.28 109.4 178.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -65.12 -48.12 74.75 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.023 0.829 . . . . 4.01 109.993 173.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -53.66 -53.0 58.15 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.673 0.789 . . . . 2.87 109.126 173.829 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -57.75 -46.26 84.74 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 118.849 -0.596 . . . . 3.99 110.231 178.344 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -53.07 -52.72 57.64 Favored 'General case' 0 N--CA 1.462 0.137 0 C-N-CA 124.215 1.006 . . . . 1.9 109.604 178.941 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -55.73 -44.2 77.32 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.004 0.522 . . . . 3.51 110.119 176.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 16.1 m -66.89 -30.78 71.03 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.028 0.751 . . . . 1.87 113.028 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.413 HD13 ' CZ ' ' B' ' 38' ' ' PHE . 37.4 mt -80.47 -56.41 4.2 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 125.307 1.443 . . . . 1.43 109.641 -177.248 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -67.24 -10.18 48.03 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 127.626 2.37 . . . . 1.58 115.607 -167.345 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 21.4 m -33.01 -20.79 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 C-N-CA 130.349 3.46 . . . . 1.4 119.613 -133.713 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -57.35 -27.86 62.64 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 121.117 1.78 . . . . 2.76 110.978 160.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 64.88 60.93 0.81 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.397 1.479 . . . . 3.08 110.589 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 44.6 p30 -107.22 -13.21 15.2 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.064 1.746 . . . . 1.98 111.656 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 14.3 m 69.41 15.14 8.42 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.412 1.485 . . . . 1.77 113.526 -173.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -114.48 101.12 8.83 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 106.185 -1.783 . . . . 3.11 106.185 160.849 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -78.11 104.16 8.5 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.975 -1.861 . . . . 1.05 105.975 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -81.43 176.8 9.4 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 121.476 0.655 . . . . 4.69 109.742 -171.452 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -80.57 82.71 6.52 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 107.809 -1.182 . . . . 5.14 107.809 -174.854 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 97.68 50.21 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.325 1 C-N-CA 133.666 4.786 . . . . 2.44 108.126 -172.593 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -89.05 -59.48 2.21 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 120.698 -1.251 . . . . 2.16 108.521 107.168 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -38.49 -51.75 1.58 Allowed 'General case' 0 C--N 1.345 0.384 0 C-N-CA 126.525 1.93 . . . . 3.52 112.338 -172.296 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 46.2 t90 -44.61 -34.33 2.12 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 125.737 1.615 . . . . 3.62 112.807 -176.083 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 78' ' ' ARG . . . . . 0.404 ' HB2' HD23 ' B' ' 63' ' ' LEU . 7.8 mmm180 -40.8 -45.51 2.48 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.947 0.899 . . . . 4.09 111.7 172.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 6.1 tp -54.58 -44.49 73.03 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 118.547 0.612 . . . . 0.88 111.402 178.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 34.5 mt -64.08 -30.26 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.806 0 N-CA-C 107.302 -1.37 . . . . 1.49 107.302 -178.034 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.577 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -68.07 -44.43 77.35 Favored Glycine 0 CA--C 1.497 -1.057 0 C-N-CA 124.765 1.174 . . . . 1.5 112.088 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 82' ' ' GLU . . . . . 0.41 ' OE2' ' NZ ' ' B' ' 85' ' ' LYS . 2.3 mm-40 -65.57 -61.89 1.83 Allowed 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 107.203 -1.406 . . . . 2.7 107.203 178.257 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.441 HD22 HD11 ' B' ' 46' ' ' LEU . 3.8 pp -56.85 -34.64 68.0 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.038 0.835 . . . . 1.88 112.062 -178.016 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.67 -61.49 2.55 Favored 'General case' 0 C--N 1.34 0.188 0 O-C-N 121.611 -0.681 . . . . 1.53 110.315 172.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 85' ' ' LYS . . . . . 0.41 ' NZ ' ' OE2' ' B' ' 82' ' ' GLU . 0.1 OUTLIER -60.66 -33.85 73.43 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 118.291 -0.862 . . . . 1.73 110.138 -175.316 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -50.67 -33.75 23.83 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 125.457 1.503 . . . . 2.98 112.046 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 4.3 tt -56.95 -38.66 60.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 119.091 0.859 . . . . 1.16 110.634 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -82.19 -41.59 20.12 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.779 1.632 . . . . 4.22 110.225 175.17 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 82.1 tttt . . . . . 0 N--CA 1.448 -0.566 0 C-N-CA 125.018 1.327 . . . . 4.81 111.254 -166.057 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 . . . . . 0 CA--C 1.54 0.574 0 N-CA-C 109.68 -0.489 . . . . 5.66 109.68 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -76.97 101.32 1.5 Allowed 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.507 2.138 . . . . 3.23 109.853 -178.068 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 94.7 mt -70.54 157.75 37.34 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 121.66 0.743 . . . . 2.04 110.742 175.456 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.1 m -48.44 136.89 12.11 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.307 1.843 . . . . 2.26 111.47 172.042 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -45.31 -54.17 7.49 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 119.027 0.83 . . . . 2.79 112.59 174.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.1 mt -57.67 -43.95 85.37 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 119.534 -0.867 . . . . 1.66 111.167 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -58.96 -51.31 70.62 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.928 0.785 . . . . 2.5 112.132 175.414 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -50.36 -55.7 14.52 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.703 0.764 . . . . 3.15 109.608 176.104 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.5 p -62.94 -42.22 99.74 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.625 -0.716 . . . . 1.44 112.395 -175.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.54 -33.28 48.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 119.651 1.114 . . . . 1.01 111.006 177.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -61.3 -57.24 13.16 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 118.196 -0.907 . . . . 3.23 109.86 176.673 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.1 t -51.13 -41.29 59.98 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.712 1.142 . . . . 2.36 111.876 -173.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.9 m -71.78 -37.35 61.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 O-C-N 120.945 -1.097 . . . . 0.99 111.317 178.193 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 40.3 t -60.25 -52.29 62.98 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 119.542 1.064 . . . . 0.72 110.693 172.69 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.1 t -59.53 -45.13 92.66 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.182 -0.949 . . . . 0.9 110.376 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 88.5 m -57.44 -46.91 83.05 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.877 0.762 . . . . 1.17 111.041 176.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -49.63 -56.69 9.15 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.232 -0.655 . . . . 3.55 109.232 171.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -57.43 -48.43 79.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.976 0.51 . . . . 3.84 111.478 -175.452 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.6 p -60.47 -56.54 20.16 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.451 -0.574 . . . . 2.33 109.451 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -55.03 -39.15 68.82 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.729 0.695 . . . . 2.63 111.469 178.642 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.52 -19.32 61.96 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 125.47 1.508 . . . . 0.96 111.878 -177.393 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.05 -30.74 70.02 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 118.308 -0.854 . . . . 4.31 111.618 175.836 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -45.73 -63.98 0.84 Allowed 'General case' 0 C--N 1.346 0.439 0 N-CA-C 113.493 0.923 . . . . 2.05 113.493 -159.996 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -98.97 80.17 2.45 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 104.155 -2.535 . . . . 3.08 104.155 177.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 34.96 -150.62 0.01 OUTLIER Glycine 0 CA--C 1.525 0.678 0 C-N-CA 127.746 2.593 . . . . 2.21 112.866 -177.505 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 72.2 mtp85 34.16 81.91 0.02 OUTLIER 'General case' 0 C--O 1.24 0.577 0 C-N-CA 126.122 1.769 . . . . 4.9 110.513 164.487 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -74.23 29.64 0.08 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.703 2.001 . . . . 3.65 113.681 -163.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -145.0 -45.77 0.23 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.068 1.347 . . . . 3.63 107.624 -170.341 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.7 p -84.7 134.04 34.36 Favored 'General case' 0 C--O 1.244 0.798 0 O-C-N 121.366 -0.833 . . . . 1.84 111.15 171.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.418 ' HB2' ' HB2' ' A' ' 71' ' ' LEU . 2.3 mm? -90.61 120.73 31.93 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.181 1.392 . . . . 2.21 107.896 171.464 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.3 t -85.55 -179.94 7.0 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.283 1.833 . . . . 2.18 110.921 170.267 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.3 t -57.29 -58.17 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 124.925 1.29 . . . . 2.47 111.532 -176.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -63.26 -48.3 78.77 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 108.138 -1.06 . . . . 3.24 108.138 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -39.15 -52.44 1.91 Allowed 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 124.965 1.306 . . . . 2.0 112.921 172.207 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.417 ' CZ ' HD21 ' A' ' 56' ' ' LEU . 2.3 t80 -61.98 -53.82 50.23 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 120.941 -0.304 . . . . 2.85 110.215 175.383 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.3 tttt -58.23 -36.99 74.01 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 122.047 -0.408 . . . . 3.56 111.337 -172.877 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -53.72 -40.59 66.21 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.497 1.519 . . . . 2.39 110.887 173.482 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 tp -66.83 -44.02 82.2 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 119.35 0.977 . . . . 2.67 109.51 -176.771 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.424 ' HB ' HG12 ' A' ' 53' ' ' VAL . 5.8 m -76.79 -27.27 16.64 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 CA-C-N 115.914 -0.585 . . . . 1.43 111.264 -174.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.3 m -73.37 -54.85 7.33 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.158 0.583 . . . . 1.77 110.013 172.331 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -82.68 -58.78 2.75 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.232 1.413 . . . . 2.7 112.778 -167.955 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -83.57 -49.65 9.01 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.583 0.753 . . . . 3.3 110.901 -167.186 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.68 121.58 85.39 Favored Pre-proline 0 CA--C 1.541 0.611 0 N-CA-C 109.089 -0.708 . . . . 3.38 109.089 175.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.475 ' HD3' HG21 ' B' ' 7' ' ' THR . 97.9 Cg_endo -84.25 -37.4 0.14 Allowed 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.784 2.322 . . . . 3.31 111.627 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -151.74 -47.94 0.11 Allowed 'General case' 0 C--N 1.34 0.166 0 CA-C-O 118.335 -0.84 . . . . 4.5 111.863 -166.073 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.467 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 9.6 tp -20.76 -78.26 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 127.43 2.292 . . . . 1.89 113.409 -178.513 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.645 ' O ' HG13 ' A' ' 53' ' ' VAL . 49.8 mt -77.82 69.1 4.01 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.444 0.698 . . . . 2.6 109.489 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.38 -8.68 0.14 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.084 1.354 . . . . 5.47 114.091 175.691 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.4 -8.92 56.94 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 128.09 2.556 . . . . 5.2 110.679 176.097 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' VAL . . . . . 0.645 HG13 ' O ' ' A' ' 50' ' ' LEU . 33.4 m -39.74 -37.24 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.404 0 C-N-CA 124.395 1.078 . . . . 1.99 113.44 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -46.53 -39.64 10.54 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 124.087 0.851 . . . . 2.1 112.728 176.781 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.1 t -120.39 43.92 2.59 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.771 1.228 . . . . 2.53 109.374 174.164 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.481 HD13 ' C ' ' A' ' 56' ' ' LEU . 2.1 tm? -43.55 -44.98 6.4 Favored 'General case' 0 C--N 1.339 0.111 0 CA-C-O 122.144 0.973 . . . . 1.03 110.052 173.59 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.65 -26.04 65.2 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 125.751 1.62 . . . . 4.8 111.805 -172.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -73.02 -43.73 61.72 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.742 1.156 . . . . 3.56 108.934 171.842 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.06 -41.69 79.19 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 108.605 -0.887 . . . . 2.61 108.605 176.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -52.09 -50.28 61.91 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.038 0.535 . . . . 1.72 110.775 175.246 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.85 -43.21 94.75 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.427 0.558 . . . . 4.21 110.768 178.452 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.0 t -58.96 -40.09 83.67 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.938 0.399 . . . . 1.86 110.929 174.656 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.844 ' HB3' HD11 ' A' ' 71' ' ' LEU . 1.4 tp -65.5 -56.45 12.32 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.635 0.774 . . . . 2.74 109.884 -178.648 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -79.09 75.0 5.63 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.256 0.55 . . . . 1.89 110.576 -177.907 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.7 m -52.48 -25.59 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 123.293 0.637 . . . . 1.76 112.616 177.233 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -79.23 -29.16 42.59 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.625 0.648 . . . . 2.49 112.003 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 54.98 55.1 8.11 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.692 0.797 . . . . 3.68 110.114 -160.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 56.4 p30 -110.28 -8.26 14.75 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.229 1.811 . . . . 2.34 112.353 177.318 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.5 m 67.16 18.23 10.39 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.227 1.411 . . . . 2.15 112.86 -175.685 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -123.53 118.58 27.69 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.877 1.271 . . . . 3.32 108.023 166.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.844 HD11 ' HB3' ' A' ' 63' ' ' LEU . 4.1 mm? -83.22 100.94 10.9 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 106.194 -1.78 . . . . 1.24 106.194 165.203 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -62.79 164.99 7.11 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 109.19 -0.671 . . . . 3.24 109.19 169.367 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -39.5 -58.96 1.17 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.913 1.285 . . . . 4.76 111.218 176.565 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -70.4 -31.32 68.49 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.156 0.982 . . . . 1.69 111.357 -170.434 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -69.07 -56.77 6.71 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.876 -0.787 . . . . 1.96 108.876 173.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -55.04 -42.22 72.4 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 110.058 -0.349 . . . . 3.65 110.058 -178.136 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.658 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 37.3 t90 -46.18 -36.55 6.11 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 124.325 1.05 . . . . 4.6 112.286 176.186 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 8.5 mtm180 -45.71 -42.94 12.33 Favored 'General case' 0 C--N 1.346 0.427 0 CA-C-N 119.129 0.877 . . . . 4.28 111.023 174.48 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.4 tp -48.07 -50.09 29.3 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 123.398 0.679 . . . . 0.82 111.045 176.76 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 19.5 mm -65.25 -27.85 43.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 108.091 -1.077 . . . . 2.18 108.091 -175.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.538 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -61.13 -50.88 62.46 Favored Glycine 0 CA--C 1.494 -1.23 0 N-CA-C 109.429 -1.469 . . . . 1.56 109.429 173.345 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -76.95 -32.31 57.22 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-O 117.8 -1.095 . . . . 2.3 109.028 -171.254 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.467 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 7.0 mp -51.67 -58.02 7.56 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 120.297 1.408 . . . . 2.34 109.9 161.899 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.46 -29.62 67.93 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.792 0.837 . . . . 1.55 112.032 -176.588 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.11 -60.09 2.42 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-O 118.587 -0.72 . . . . 1.89 110.022 167.495 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -47.12 -48.63 23.06 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 127.103 2.161 . . . . 3.2 111.41 -168.97 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.5 tt -51.24 -33.54 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 112.477 0.547 . . . . 1.6 112.477 175.843 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.05 -46.44 6.81 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.597 2.359 . . . . 5.53 111.603 -174.452 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 64.0 tttp . . . . . 0 CA--C 1.536 0.43 0 C-N-CA 128.035 2.534 . . . . 3.38 112.959 -177.961 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.43 HD13 ' HB3' ' B' ' 10' ' ' GLU . 2.1 mt . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 113.594 0.961 . . . . 2.3 113.594 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.475 HG21 ' HD3' ' A' ' 47' ' ' PRO . 10.0 t -81.03 -173.25 4.18 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.758 1.223 . . . . 2.19 110.088 166.432 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 73.8 tt0 -73.11 -54.66 7.93 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.256 0.622 . . . . 3.68 111.875 -173.263 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mt -53.28 -46.66 69.39 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.199 -0.938 . . . . 1.68 109.64 177.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 10' ' ' GLU . . . . . 0.445 ' OE1' HD13 ' A' ' 49' ' ' LEU . 15.7 mt-10 -51.8 -54.99 22.63 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 113.917 1.08 . . . . 2.94 113.917 169.478 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -60.96 -33.97 74.03 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.882 1.219 . . . . 4.16 110.331 -177.986 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 13.4 m -60.94 -55.74 29.39 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.213 0.605 . . . . 1.32 110.891 173.232 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.28 2.3 pp -60.49 -39.23 80.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 O-C-N 121.505 -0.747 . . . . 1.31 110.87 179.58 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -61.12 -55.94 26.59 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.75 0.704 . . . . 2.59 110.241 175.269 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.1 t -54.54 -38.53 66.69 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.194 0.906 . . . . 1.43 111.214 -173.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 12.8 m -75.41 -37.42 38.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 O-C-N 121.356 -0.84 . . . . 1.24 111.494 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 25.0 t -58.6 -46.68 90.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 119.759 1.163 . . . . 1.33 110.785 173.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 15.0 t -65.83 -46.87 76.92 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.353 -0.842 . . . . 1.56 110.516 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 86.1 m -59.21 -45.53 90.86 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 120.081 1.309 . . . . 1.3 110.861 176.428 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -47.07 -54.94 9.22 Favored 'General case' 0 C--O 1.225 -0.196 0 N-CA-C 109.231 -0.655 . . . . 4.3 109.231 170.03 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -58.89 -51.66 69.07 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 122.977 0.511 . . . . 2.67 111.697 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 41.5 p -62.15 -35.18 77.99 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.556 -0.715 . . . . 2.23 111.229 -177.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -70.03 -44.11 69.93 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.468 0.576 . . . . 2.98 111.016 170.376 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.93 -27.13 68.63 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.356 1.463 . . . . 1.11 111.0 -173.045 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -55.72 -26.37 44.93 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 118.926 -0.559 . . . . 3.99 110.957 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.61 -70.9 0.14 Allowed 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 116.085 1.883 . . . . 3.37 116.085 -147.542 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -95.14 -76.92 0.48 Allowed 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 122.328 1.061 . . . . 3.08 113.257 -169.421 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.43 112.38 4.22 Favored Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 127.447 2.451 . . . . 2.33 109.557 168.079 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.6 ttt85 66.85 109.07 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 121.027 2.413 . . . . 4.43 115.845 149.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 21.1 pttt -53.35 -13.64 0.6 Allowed 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 116.565 2.061 . . . . 4.15 116.565 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -88.46 -46.41 9.15 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.761 0.824 . . . . 3.87 110.494 -170.759 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 5.4 p -107.28 163.27 13.17 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 126.69 1.996 . . . . 1.9 109.512 -175.292 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 mp -120.78 140.75 51.26 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-O 121.718 0.771 . . . . 2.78 112.743 170.183 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 5.1 t -86.33 -170.06 2.92 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 128.473 2.709 . . . . 2.7 110.427 174.367 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 67.7 t -66.65 -108.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.384 1 C-N-CA 132.056 4.142 . . . . 2.66 100.215 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -75.42 58.01 0.96 Allowed 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 124.068 3.122 . . . . 2.62 112.511 -175.154 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -123.97 -47.5 1.92 Allowed 'General case' 0 CA--C 1.542 0.639 1 C-N-CA 131.897 4.079 . . . . 2.11 106.301 154.114 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -60.7 -48.02 83.65 Favored 'General case' 0 C--N 1.344 0.336 0 O-C-N 121.282 -0.886 . . . . 2.84 109.925 166.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 13.7 ttmt -59.57 -31.84 69.82 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.217 0.532 . . . . 2.99 110.121 -171.513 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -54.73 -41.37 70.29 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 123.461 0.705 . . . . 2.93 112.241 173.901 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.1 tp -63.89 -47.24 81.41 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 120.391 1.45 . . . . 2.07 109.403 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 16.9 m -69.66 -41.0 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 CA-C-N 115.346 -0.843 . . . . 0.9 109.477 -172.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 85.4 m -68.13 -55.55 11.99 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 123.401 0.68 . . . . 1.12 110.519 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -81.84 -58.84 2.81 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.627 1.571 . . . . 2.45 111.635 -163.941 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.33 -41.23 25.19 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 122.017 -0.427 . . . . 3.91 111.093 -172.878 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.9 tp -82.59 -14.55 0.21 Allowed Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 119.129 3.011 . . . . 2.09 119.129 -158.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -38.96 -56.73 1.1 Allowed 'Trans proline' 0 CA--C 1.535 0.572 1 C-N-CA 125.601 4.201 . . . . 2.33 116.274 -133.725 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -71.44 -26.58 62.79 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.741 -0.6 . . . . 3.41 112.439 -169.013 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 39.0 tp -62.33 -77.01 0.05 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.081 0.552 . . . . 1.44 111.402 -166.144 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.81 97.68 8.75 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.293 -1.003 . . . . 1.63 108.293 168.695 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 15.6 pttp -63.54 179.33 0.47 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.007 0.432 . . . . 5.27 110.209 167.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 57.65 34.98 25.18 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.248 1.019 . . . . 5.77 109.882 177.347 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -55.55 -22.08 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 125.933 1.693 . . . . 3.1 112.999 -173.823 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -46.01 -41.95 11.35 Favored Glycine 0 CA--C 1.531 1.075 0 N-CA-C 111.316 -0.714 . . . . 2.34 111.316 168.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 82.5 p -76.28 43.11 0.29 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 117.723 0.761 . . . . 4.23 112.179 -178.993 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.426 HD13 ' C ' ' B' ' 56' ' ' LEU . 3.2 tm? -74.94 -50.16 17.7 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 120.98 -1.075 . . . . 1.16 109.055 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.46 -14.17 62.74 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.91 -0.494 . . . . 4.36 112.327 -161.003 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -80.54 -41.42 24.17 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.702 0.801 . . . . 2.91 111.517 165.288 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 59' ' ' LYS . . . . . 0.422 ' O ' HD12 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -55.37 -49.64 71.77 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 107.584 -1.265 . . . . 3.54 107.584 171.238 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -39.62 -53.83 2.09 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 124.033 0.933 . . . . 1.96 110.978 176.846 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -60.74 -37.61 82.34 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.361 0.504 . . . . 2.78 112.361 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.0 t -67.18 -30.44 70.39 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.844 0.683 . . . . 2.42 112.844 175.251 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.422 HD12 ' O ' ' B' ' 59' ' ' LYS . 5.9 mp -80.32 -54.52 5.64 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.455 -0.778 . . . . 1.53 110.385 176.046 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -54.31 -12.04 0.6 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 128.562 2.745 . . . . 1.51 116.051 -170.34 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -35.66 -21.99 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.408 1 C-N-CA 132.404 4.281 . . . . 2.68 119.681 -130.367 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 16.8 p30 -64.82 -19.1 65.67 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 120.198 1.363 . . . . 2.37 110.949 163.044 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 65.13 58.8 0.87 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.323 1.049 . . . . 2.9 110.041 169.526 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -108.24 -6.54 16.3 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.395 1.878 . . . . 1.83 110.839 -178.397 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m 67.97 12.66 8.9 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.448 1.499 . . . . 2.16 113.753 -173.515 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -114.93 100.88 8.53 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.372 1.469 . . . . 3.02 107.106 162.249 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.92 100.55 0.21 Allowed 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 106.038 -1.838 . . . . 1.08 106.038 166.992 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.8 tppt? -84.22 167.63 16.48 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.729 1.612 . . . . 4.21 110.199 -167.821 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -92.1 52.44 1.97 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.646 0.736 . . . . 4.35 110.951 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -162.28 49.74 0.19 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 105.925 -1.88 . . . . 2.11 105.925 113.782 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -95.68 -61.08 1.52 Allowed 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 119.914 -1.741 . . . . 2.05 109.097 148.34 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -53.23 -37.73 62.31 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.567 1.147 . . . . 4.27 110.786 -170.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.658 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 17.7 t-105 -39.35 -37.77 0.47 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.129 1.372 . . . . 4.41 111.535 172.608 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 -37.77 -49.39 1.16 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.595 1.558 . . . . 5.47 111.605 173.302 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.8 tp -53.4 -40.79 65.34 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-O 119.741 -0.171 . . . . 0.88 110.582 -176.241 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 76.4 mt -63.75 -28.15 44.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 N-CA-C 108.602 -0.888 . . . . 1.73 108.602 -173.1 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.58 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -76.01 -45.8 15.13 Favored Glycine 0 CA--C 1.487 -1.671 0 N-CA-C 109.857 -1.297 . . . . 1.3 109.857 178.343 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -68.2 -34.63 76.62 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 107.823 -1.177 . . . . 2.28 107.823 -175.08 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 5.4 mt -49.23 -60.16 3.05 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 120.642 1.565 . . . . 2.14 111.087 169.388 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.46 -50.83 68.83 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 122.092 0.949 . . . . 1.18 110.127 -179.355 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 12.7 ttpp -60.18 -40.15 89.01 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 123.769 0.828 . . . . 1.57 110.329 -177.647 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -64.37 -43.11 95.54 Favored 'General case' 0 C--O 1.226 -0.144 0 C-N-CA 125.716 1.606 . . . . 2.77 110.417 176.704 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -32.14 47.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 119.545 -0.862 . . . . 1.62 110.836 171.023 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.91 -36.27 42.15 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 113.75 1.019 . . . . 3.54 113.75 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 16.6 pttp . . . . . 0 N--CA 1.469 0.514 0 C-N-CA 125.25 1.42 . . . . 6.47 112.285 -168.141 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 . . . . . 0 CA--C 1.539 0.548 0 N-CA-C 107.495 -1.298 . . . . 6.6 107.495 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -65.82 164.89 25.24 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 121.359 1.373 . . . . 3.04 111.049 170.684 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.1 mt -112.13 -178.38 3.4 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 127.046 2.138 . . . . 1.77 109.921 -164.298 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.5 t -70.96 167.08 19.91 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.733 -1.229 . . . . 2.03 110.093 176.271 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -61.56 -54.38 43.85 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.166 -0.959 . . . . 2.24 111.607 -166.922 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.7 mt -60.97 -44.24 97.6 Favored 'General case' 0 C--O 1.222 -0.357 0 O-C-N 121.344 -0.847 . . . . 1.44 111.232 177.563 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -50.87 -51.47 51.16 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.207 2.203 . . . . 2.4 112.21 174.846 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -49.84 -58.41 5.45 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.569 0.748 . . . . 4.43 109.157 170.393 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.0 m -56.08 -50.65 70.42 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.973 0.909 . . . . 2.38 111.719 -173.828 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.276 2.7 pp -61.92 -43.61 97.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 109.004 -0.739 . . . . 1.14 109.004 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -61.29 -45.69 93.42 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.305 0.957 . . . . 4.21 110.925 175.404 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.25 -36.53 68.64 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.614 0.766 . . . . 1.83 111.747 -178.403 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . 0.252 31.2 m -79.46 -40.13 21.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 O-C-N 120.926 -1.109 . . . . 1.06 111.5 172.628 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.8 t -51.2 -48.46 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 120.48 1.491 . . . . 1.06 110.989 175.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.2 t -59.55 -40.9 88.79 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.866 -0.522 . . . . 0.75 110.524 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' THR . . . . . 0.782 HG21 HD21 ' B' ' 9' ' ' LEU . 28.7 m -58.94 -50.08 75.39 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.434 0.694 . . . . 1.08 110.039 176.523 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -52.36 -57.25 10.4 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 123.423 0.689 . . . . 6.61 109.191 175.351 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -56.51 -53.38 58.19 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.635 1.174 . . . . 3.62 110.382 -172.233 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.8 t -63.4 -48.5 77.6 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 120.008 -0.677 . . . . 1.83 110.403 -176.909 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -60.62 -42.39 96.74 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 119.458 1.027 . . . . 3.47 110.773 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.2 -17.71 58.94 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 124.804 1.242 . . . . 1.05 111.965 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.7 ptt180 -71.04 -20.14 62.42 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 117.363 -1.304 . . . . 5.03 111.772 173.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -42.35 -63.0 0.83 Allowed 'General case' 0 C--N 1.346 0.456 0 CA-C-N 119.282 0.947 . . . . 2.73 112.009 -175.381 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -120.7 171.42 8.6 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 126.405 1.882 . . . . 2.39 106.781 -176.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -11.1 119.45 0.01 OUTLIER Glycine 0 CA--C 1.53 0.989 0 C-N-CA 127.546 2.498 . . . . 1.38 114.298 175.022 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.6 ttm180 72.56 105.16 0.07 Allowed 'General case' 0 C--O 1.237 0.421 0 C-N-CA 123.446 0.698 . . . . 4.02 112.731 167.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -75.1 50.17 0.47 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.56 1.144 . . . . 3.73 112.868 177.174 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -147.73 -57.6 0.24 Allowed 'General case' 0 C--O 1.227 -0.121 0 C-N-CA 125.802 1.641 . . . . 3.72 106.914 174.261 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.0 144.66 28.98 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 124.311 1.044 . . . . 1.66 111.181 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.6 mp -99.87 121.76 41.79 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.087 -1.079 . . . . 2.75 108.087 172.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.6 m -79.54 166.82 21.53 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 107.772 -1.195 . . . . 2.58 107.772 177.174 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -54.88 -44.66 73.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 O-C-N 120.92 -1.112 . . . . 2.04 112.695 -169.58 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -62.04 -58.18 8.83 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.468 -0.568 . . . . 1.91 109.468 176.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -37.76 -52.04 1.27 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.743 2.017 . . . . 1.88 111.744 172.514 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -58.27 -55.59 32.97 Favored 'General case' 0 N--CA 1.442 -0.834 0 C-N-CA 124.764 1.225 . . . . 2.84 109.15 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.6 tttt -59.85 -42.51 93.81 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 119.28 -0.968 . . . . 3.31 112.307 178.701 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 73.2 mt-10 -52.23 -42.46 63.62 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-N 119.172 0.897 . . . . 2.2 110.621 174.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.4 tt -66.13 -47.18 74.96 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 107.758 -1.201 . . . . 3.01 107.758 -173.664 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -64.32 -51.85 63.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 118.581 -1.248 . . . . 1.22 109.393 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 95.1 m -48.13 -53.99 14.79 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.446 1.098 . . . . 1.36 111.999 178.239 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -80.23 -54.83 5.38 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.337 1.055 . . . . 2.43 110.641 -172.617 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -83.31 -39.63 20.53 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.634 1.174 . . . . 6.0 110.457 -167.486 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -115.48 68.94 2.82 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-N 119.266 0.939 . . . . 2.46 111.288 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -64.78 -37.53 35.09 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.36 2.04 . . . . 2.46 112.302 -178.991 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -123.84 -34.08 3.06 Favored 'General case' 0 C--N 1.342 0.257 0 N-CA-C 113.307 0.854 . . . . 6.48 113.307 -174.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.702 HD13 ' CD1' ' B' ' 6' ' ' LEU . 30.2 tp -54.9 -59.85 4.17 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-N 118.471 0.578 . . . . 2.23 110.182 -175.812 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.0 mt -74.92 124.3 26.66 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 105.21 -2.145 . . . . 2.91 105.21 152.741 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.2 -7.37 21.26 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 125.455 1.502 . . . . 7.86 110.039 -176.024 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -110.22 87.89 2.63 Favored 'General case' 0 N--CA 1.435 -1.188 0 N-CA-C 104.844 -2.28 . . . . 4.46 104.844 169.726 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.5 m -98.26 22.63 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 114.59 -1.187 . . . . 2.44 108.865 161.811 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -93.2 -76.02 1.32 Allowed Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 107.319 -2.312 . . . . 2.28 107.319 176.235 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.7 m -79.22 61.52 3.35 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 126.147 1.779 . . . . 2.35 110.085 -171.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.07 -29.56 64.25 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 125.768 1.627 . . . . 1.48 109.327 178.152 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -53.72 -63.49 1.13 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.869 1.667 . . . . 4.67 112.726 174.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -58.13 -33.66 69.4 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 120.489 -1.382 . . . . 3.03 111.046 177.786 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 -56.76 17.11 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.584 -0.895 . . . . 2.58 108.584 172.276 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -46.99 -50.53 18.97 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 123.877 0.871 . . . . 2.15 110.01 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -60.19 -38.39 83.12 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 117.981 0.355 . . . . 3.85 111.183 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.7 m -68.67 -47.81 65.57 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.642 0.377 . . . . 1.73 111.95 178.952 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.3 mp -73.94 -48.89 27.45 Favored 'General case' 0 C--O 1.232 0.137 0 O-C-N 121.815 -0.553 . . . . 1.91 111.122 -176.1 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -75.7 78.44 2.66 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.48 0.712 . . . . 2.42 109.961 -169.138 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 17.5 m -47.63 -37.4 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 124.152 0.981 . . . . 2.35 113.412 -170.461 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -96.06 -8.51 33.29 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.059 0.763 . . . . 2.78 113.059 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 54.39 55.03 8.58 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 125.969 1.708 . . . . 3.04 111.329 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.3 p30 -87.43 -42.83 12.53 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.57 0.748 . . . . 2.09 110.22 174.999 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.5 m 101.9 13.96 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 130.088 3.355 . . . . 1.66 112.727 -171.043 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -112.93 111.35 22.04 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 105.514 -2.032 . . . . 3.25 105.514 162.154 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -79.93 89.93 5.32 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 103.421 -2.807 . . . . 1.08 103.421 175.286 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.3 ttpt -71.26 160.27 33.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.441 1.097 . . . . 3.37 108.349 -178.023 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -40.09 -60.71 0.99 Allowed 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.561 1.144 . . . . 5.03 112.975 -168.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -69.66 -20.02 63.59 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.195 0.813 . . . . 1.91 113.195 -177.97 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -76.7 -61.35 2.0 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-N 119.866 1.212 . . . . 1.83 108.288 172.796 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -45.33 -39.75 7.04 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 125.586 1.554 . . . . 2.89 110.792 176.685 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.489 ' HE1' ' HA3' ' B' ' 81' ' ' GLY . 11.6 t90 -39.07 -43.59 1.04 Allowed 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 125.243 1.417 . . . . 4.71 114.686 174.296 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.53 -38.92 32.58 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 109.793 -0.447 . . . . 6.58 109.793 178.251 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 tp -57.06 -42.39 80.51 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.862 -0.59 . . . . 1.08 111.278 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 14.9 mm -70.76 -41.07 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 107.195 -1.409 . . . . 1.75 107.195 -177.978 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.521 ' HA2' ' CD2' ' B' ' 77' ' ' TRP . . . -60.97 -38.35 95.34 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-N 115.24 -0.891 . . . . 1.24 111.687 178.636 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -81.02 -49.36 11.02 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-O 117.789 -1.1 . . . . 3.59 111.331 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.464 HD12 HG21 ' B' ' 13' ' ' ILE 0.258 4.0 pp -55.34 -34.0 63.84 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 120.885 1.675 . . . . 2.44 110.881 174.735 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.42 -40.34 78.13 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.219 -0.925 . . . . 2.04 112.52 168.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.3 -48.42 75.74 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 125.068 1.347 . . . . 2.89 111.484 173.793 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -62.38 -28.11 69.54 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.679 1.592 . . . . 2.84 111.936 -158.778 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.0 tt -50.73 -38.05 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 123.497 0.719 . . . . 1.89 111.279 169.073 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . 2.306 0.0 OUTLIER -86.73 -55.13 4.0 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 129.342 3.057 . . . . 5.11 110.472 176.324 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 13.1 tttm . . . . . 0 CA--C 1.537 0.466 0 C-N-CA 127.465 2.306 . . . . 4.92 112.471 -168.839 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.702 ' CD1' HD13 ' A' ' 49' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.552 1.049 0 N-CA-C 115.718 1.747 . . . . 3.54 115.718 . . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.471 ' H ' ' HG2' ' B' ' 10' ' ' GLU . 9.2 t -130.04 -140.97 0.23 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 127.84 2.456 . . . . 2.13 111.409 -171.724 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -87.46 -63.58 1.28 Allowed 'General case' 0 C--N 1.34 0.157 0 C-N-CA 125.448 1.499 . . . . 3.12 107.948 177.206 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 9' ' ' LEU . . . . . 0.782 HD21 HG21 ' A' ' 19' ' ' THR . 0.6 OUTLIER -50.23 -34.13 21.93 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.628 0.771 . . . . 3.28 111.354 -179.395 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 10' ' ' GLU . . . . . 0.471 ' HG2' ' H ' ' B' ' 7' ' ' THR . 0.0 OUTLIER -46.72 -46.83 20.52 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 122.89 0.476 . . . . 6.53 110.933 175.202 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.402 ' N ' ' HG3' ' B' ' 10' ' ' GLU . 19.8 mt-10 -65.04 -44.15 90.04 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 108.149 -1.056 . . . . 5.02 108.149 -171.831 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 24.6 p -75.09 -27.09 59.75 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.157 -0.929 . . . . 1.29 111.682 -173.415 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.464 HG21 HD12 ' A' ' 83' ' ' LEU 0.268 2.0 pp -74.89 -40.66 46.15 Favored 'Isoleucine or valine' 0 C--N 1.34 0.19 0 CA-C-N 119.47 1.032 . . . . 1.5 111.215 166.197 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -53.2 -56.84 13.27 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 119.305 0.957 . . . . 4.01 109.093 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.1 t -52.2 -42.35 63.44 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.048 0.451 . . . . 1.8 111.668 -173.235 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 19.8 m -79.3 -29.58 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 120.942 -1.099 . . . . 1.21 111.804 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 25.3 t -63.42 -41.65 93.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 119.041 0.837 . . . . 1.63 109.551 172.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . 0.255 9.8 t -67.2 -42.98 83.24 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.091 -0.957 . . . . 1.81 110.482 174.15 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 4.2 m -51.56 -56.63 12.43 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.855 1.661 . . . . 1.25 110.382 171.451 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -40.47 -62.0 0.84 Allowed 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 125.097 1.359 . . . . 4.51 110.189 172.742 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -64.81 -48.42 74.45 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.772 0.32 . . . . 2.43 111.596 -171.001 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 54.8 p -60.29 -35.54 75.79 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.07 0.548 . . . . 2.32 111.754 -178.571 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 -69.66 -54.66 12.82 Favored 'General case' 0 N--CA 1.458 -0.07 0 CA-C-O 121.325 0.583 . . . . 2.86 110.403 168.925 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.62 -18.48 64.96 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 126.199 1.8 . . . . 1.11 112.072 -166.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -52.55 -27.25 15.87 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 118.816 -0.611 . . . . 4.05 111.804 169.991 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.02 -68.9 0.17 Allowed 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 117.677 2.473 . . . . 2.28 117.677 -151.154 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -89.18 -76.85 0.4 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.209 0.913 . . . . 2.74 111.922 -161.013 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.16 167.43 29.11 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 127.722 2.582 . . . . 1.77 110.472 150.415 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 29' ' ' ARG . . . . . 0.407 ' NH1' ' OE2' ' B' ' 70' ' ' GLU . 36.8 ttm180 53.63 101.13 0.01 OUTLIER 'General case' 0 C--O 1.238 0.458 0 C-N-CA 124.336 1.054 . . . . 3.6 113.81 136.975 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 14.7 pttm -60.5 -39.01 86.18 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 113.479 0.918 . . . . 3.89 113.479 -175.06 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -77.88 -19.25 55.11 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.343 0.868 . . . . 4.6 113.343 -168.755 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 96.8 p -130.32 160.52 33.69 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-N 119.544 1.065 . . . . 1.7 111.639 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.507 HD13 ' CD1' ' B' ' 76' ' ' TYR . 5.2 mp -113.22 161.84 16.71 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.281 1.032 . . . . 2.2 111.717 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 15.2 m -140.97 170.45 15.72 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 127.095 2.158 . . . . 2.46 105.852 -178.519 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 33.0 m -88.91 54.07 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 O-C-N 121.279 -0.888 . . . . 2.87 112.024 -170.346 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -152.12 54.29 0.81 Allowed 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 105.934 -1.876 . . . . 2.13 105.934 141.818 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -160.56 -58.52 0.06 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 127.952 2.501 . . . . 1.73 104.722 -174.764 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -56.36 -60.01 4.13 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.741 -1.118 . . . . 2.12 110.309 177.599 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 41.3 tttm -58.66 -35.03 71.92 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.303 0.573 . . . . 3.75 109.565 -175.675 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . 0.288 16.3 mm-40 -63.01 -18.7 63.6 Favored 'General case' 0 N--CA 1.44 -0.954 0 N-CA-C 112.824 0.676 . . . . 5.27 112.824 -174.576 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 24.7 tp -62.24 -50.78 70.39 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.573 -0.899 . . . . 1.84 108.573 169.601 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 16.6 m -70.72 -42.73 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 109.816 -0.438 . . . . 0.9 109.816 -174.579 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 24.1 m -51.96 -55.22 21.69 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 122.688 0.395 . . . . 1.01 110.275 173.076 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -82.33 -58.72 2.81 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.835 1.05 . . . . 2.37 113.835 -168.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -79.57 -48.53 13.66 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.51 1.3 . . . . 3.89 114.51 -164.332 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 46' ' ' LEU . . . . . 0.434 HD11 HD11 ' B' ' 83' ' ' LEU . 1.5 mm? -52.43 -38.78 59.93 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 115.69 1.737 . . . . 2.14 115.69 -148.725 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -63.94 -39.3 33.43 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.569 -1.846 . . . . 2.31 109.619 -58.888 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -89.09 -30.6 18.54 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.139 1.375 . . . . 3.56 112.365 -168.057 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 19.3 tp -47.57 -63.28 1.1 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.491 1.516 . . . . 1.17 111.405 -175.761 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' B' ' 50' ' ' LEU . 33.0 mt -93.09 72.42 4.65 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.372 -0.973 . . . . 1.66 108.372 163.13 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.9 147.29 0.22 Allowed 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.81 1.244 . . . . 5.53 110.305 174.235 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 32.0 t0 61.9 41.08 11.86 Favored 'General case' 0 C--N 1.343 0.286 0 N-CA-C 106.856 -1.535 . . . . 4.17 106.856 173.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 5.9 m 32.25 50.54 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 C-N-CA 127.748 2.419 . . . . 3.79 112.924 -172.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 65.07 19.16 65.61 Favored Glycine 0 CA--C 1.525 0.698 0 CA-C-O 118.718 -1.046 . . . . 7.37 114.174 174.094 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 5.6 p 42.22 61.24 2.04 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 118.288 1.044 . . . . 5.03 108.658 -168.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -45.51 -46.75 14.08 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 126.416 1.886 . . . . 2.04 112.648 -148.72 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -40.37 -47.72 2.59 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.598 1.959 . . . . 3.25 112.812 174.977 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -54.22 -60.47 3.29 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 109.332 -0.618 . . . . 4.63 109.332 176.39 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -44.69 95.84 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 118.458 -0.782 . . . . 5.18 109.242 -175.836 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 9.2 mtp -47.54 -60.89 2.22 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.586 1.085 . . . . 3.79 110.508 175.602 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -63.31 -36.8 84.89 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.382 -0.372 . . . . 3.91 110.546 -175.392 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 14.7 t -62.92 -41.28 99.4 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.015 0.526 . . . . 2.69 111.204 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 29.9 mt -77.19 -51.25 11.29 Favored 'General case' 0 CA--C 1.527 0.079 0 C-N-CA 125.317 1.447 . . . . 1.21 110.394 -172.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -53.39 -14.9 0.85 Allowed 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 116.615 2.08 . . . . 2.18 116.615 -165.834 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 17.8 m -36.43 -32.35 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 129.71 3.204 . . . . 1.93 117.468 -139.983 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -65.55 -12.61 54.49 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.352 0.978 . . . . 2.82 112.393 175.849 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 61.51 41.99 11.89 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 124.363 1.065 . . . . 3.18 113.012 167.336 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 48.9 p30 -91.92 -7.93 47.76 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.456 1.502 . . . . 2.18 111.48 163.103 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.0 m 65.31 10.14 6.24 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.985 1.314 . . . . 2.64 113.78 -172.072 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 70' ' ' GLU . . . . . 0.407 ' OE2' ' NH1' ' B' ' 29' ' ' ARG . 35.5 mt-10 -99.44 154.12 18.46 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 108.447 -0.945 . . . . 2.9 108.447 167.001 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -111.81 93.51 4.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 106.215 -1.772 . . . . 1.11 106.215 168.971 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.69 178.98 7.72 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.412 0.685 . . . . 3.84 110.705 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 40.6 p90 -91.61 52.28 2.02 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.885 0.698 . . . . 4.48 112.885 -171.681 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -155.52 49.84 0.55 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 107.002 -1.481 . . . . 2.79 107.002 114.01 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -90.99 -60.88 1.8 Allowed 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 106.066 -1.828 . . . . 1.9 106.066 140.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.507 ' CD1' HD13 ' B' ' 33' ' ' LEU . 65.3 t80 -52.8 -49.74 65.01 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 124.103 0.961 . . . . 4.02 113.259 -168.323 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.521 ' CD2' ' HA2' ' A' ' 81' ' ' GLY . 0.3 OUTLIER -43.9 -34.32 1.61 Allowed 'General case' 0 C--N 1.341 0.233 0 O-C-N 123.786 0.679 . . . . 5.33 111.206 177.34 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' B' B ' 78' ' ' ARG . . . . . 0.425 ' HA ' ' CH2' ' A' ' 77' ' ' TRP . 45.3 mtp180 -51.84 -52.95 45.69 Favored 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 120.098 -0.641 . . . . 4.97 110.933 -175.835 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.632 ' O ' HD13 ' B' ' 83' ' ' LEU . 3.2 tp -57.56 -28.04 63.2 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 118.251 -1.38 . . . . 1.38 110.811 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 45.1 mt -71.84 -47.89 53.82 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.346 0 N-CA-C 107.041 -1.466 . . . . 2.34 107.041 -168.274 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.489 ' HA3' ' HE1' ' A' ' 77' ' ' TRP . . . -80.95 -27.99 47.74 Favored Glycine 0 N--CA 1.42 -2.37 0 CA-C-O 117.863 -1.521 . . . . 2.71 111.227 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -57.28 -47.45 81.42 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 105.264 -2.124 . . . . 3.39 105.264 -173.092 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.632 HD13 ' O ' ' B' ' 79' ' ' LEU . 7.8 mp -38.54 -47.94 1.36 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.904 1.282 . . . . 2.61 113.173 174.283 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.74 -29.8 70.96 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.87 0.868 . . . . 1.35 111.573 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -80.28 -45.9 17.11 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 123.876 0.87 . . . . 1.47 111.24 167.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.39 -50.39 73.15 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.831 1.196 . . . . 3.57 108.193 -171.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 14.3 tt -50.49 -39.22 17.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 123.454 0.701 . . . . 1.45 111.651 174.506 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.66 -19.11 42.37 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.537 1.535 . . . . 3.71 112.598 -176.27 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 42.3 tttp . . . . . 0 CA--C 1.535 0.368 0 C-N-CA 123.984 0.914 . . . . 5.38 111.888 -161.626 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 . . . . . 0 N--CA 1.442 -0.854 0 N-CA-C 108.61 -0.885 . . . . 5.95 108.61 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -70.14 141.15 42.97 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 121.951 1.767 . . . . 2.33 108.133 173.568 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 86.7 mt -99.1 163.73 12.45 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 108.325 -0.991 . . . . 1.33 108.325 -175.062 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.3 t -73.8 153.01 40.14 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 120.739 -1.225 . . . . 1.96 109.898 -175.631 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -45.07 -51.63 9.91 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 121.232 -0.918 . . . . 2.46 112.855 -174.279 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -58.9 -52.08 67.28 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 118.311 -0.852 . . . . 1.54 111.255 178.391 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -48.87 -55.05 12.82 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.083 2.153 . . . . 2.56 111.767 173.554 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -52.52 -52.31 55.29 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.164 0.985 . . . . 3.06 109.932 174.987 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.9 t -57.74 -50.6 72.68 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.385 0.674 . . . . 2.39 111.08 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.279 2.8 pp -62.61 -37.68 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 O-C-N 121.247 -0.908 . . . . 0.66 110.431 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -57.26 -59.4 5.16 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 119.344 0.974 . . . . 2.72 109.965 174.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.6 t -53.92 -40.78 67.02 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 118.986 0.812 . . . . 1.81 111.552 -172.473 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.1 m -76.34 -30.66 19.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 120.525 -1.359 . . . . 0.78 112.108 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.3 t -64.37 -44.69 97.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 119.679 1.127 . . . . 0.6 110.065 173.224 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.4 t -65.42 -42.25 92.7 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.46 -0.775 . . . . 0.9 110.242 175.85 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 50.5 m -55.5 -50.62 69.46 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.906 0.775 . . . . 0.97 110.147 173.678 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -48.25 -60.04 2.96 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 123.405 0.682 . . . . 3.26 110.089 172.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -52.93 -51.56 60.91 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.226 1.01 . . . . 3.43 111.571 -173.759 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.1 t -63.78 -25.15 68.05 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 118.493 -0.765 . . . . 2.2 112.17 -176.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -81.54 -42.84 19.59 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 118.951 0.796 . . . . 2.63 111.456 169.578 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -52.43 -40.25 61.98 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 120.872 -1.142 . . . . 1.1 110.671 -179.09 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -19.21 61.04 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 116.065 -1.921 . . . . 4.98 113.342 -178.804 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -45.0 -61.81 1.48 Allowed 'General case' 0 C--N 1.345 0.395 0 CA-C-N 120.758 1.617 . . . . 2.55 110.133 -168.505 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -128.77 96.74 4.46 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 126.348 1.859 . . . . 5.58 107.613 -177.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.38 149.83 0.11 Allowed Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.425 1.488 . . . . 1.35 114.334 167.325 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 51.92 82.43 0.07 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.134 0.974 . . . . 5.89 110.806 175.203 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -71.27 31.31 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.731 1.382 . . . . 3.62 114.731 -175.368 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -139.57 22.06 2.52 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.604 1.562 . . . . 4.51 108.657 167.828 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.8 m -154.82 140.48 17.99 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.925 -1.109 . . . . 2.71 113.165 -179.017 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.1 mp -103.94 117.36 34.13 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.14 1.376 . . . . 2.58 112.705 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.2 t -83.69 177.04 8.55 Favored 'General case' 0 C--O 1.227 -0.131 0 O-C-N 120.84 -1.162 . . . . 2.72 109.784 171.432 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.5 m -55.43 -50.18 67.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 112.903 0.705 . . . . 2.78 112.903 -163.695 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -62.37 -57.4 11.45 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 118.604 0.638 . . . . 2.53 109.781 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -38.1 -50.87 1.4 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.306 1.442 . . . . 2.15 110.787 173.864 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.405 ' CD2' ' HG ' ' A' ' 71' ' ' LEU . 0.8 OUTLIER -58.64 -53.6 56.5 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 114.728 -1.124 . . . . 3.72 110.226 177.892 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -60.71 -37.21 80.91 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 120.618 -0.433 . . . . 3.24 110.06 -174.2 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -53.81 -37.45 63.56 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 119.076 -0.488 . . . . 3.63 110.937 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.8 tp -68.63 -45.72 71.11 Favored 'General case' 0 C--N 1.339 0.115 0 CA-C-N 119.881 1.219 . . . . 2.38 109.27 -177.948 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 10.2 m -69.42 -38.46 77.18 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.178 0 CA-C-O 121.457 0.646 . . . . 1.22 109.359 -173.668 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 74.8 m -69.42 -43.39 73.48 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 124.276 1.031 . . . . 1.35 110.224 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -80.14 -60.47 2.32 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.095 0.558 . . . . 2.07 111.783 -173.46 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLN . . . . . 0.507 ' O ' HG21 ' B' ' 7' ' ' THR . 3.1 mm-40 -79.45 -37.75 36.24 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 118.407 -0.806 . . . . 3.91 113.011 -167.539 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.84 83.51 0.55 Allowed Pre-proline 0 N--CA 1.469 0.478 0 C-N-CA 125.127 1.371 . . . . 2.29 111.732 -165.119 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -64.81 -32.14 56.46 Favored 'Trans proline' 0 N--CA 1.449 -1.115 0 C-N-CA 122.659 2.239 . . . . 1.62 111.898 178.329 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.37 -3.36 0.42 Allowed 'General case' 0 C--N 1.347 0.487 0 N-CA-C 118.332 2.716 . . . . 4.99 118.332 -174.332 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.653 HD23 ' HB2' ' A' ' 83' ' ' LEU . 10.5 tp -58.89 -64.44 0.94 Allowed 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 120.536 1.516 . . . . 1.21 110.487 174.431 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 45.6 mt -78.67 -42.12 29.45 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 115.952 -0.567 . . . . 3.1 110.97 -175.613 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 28.5 40.66 0.0 OUTLIER 'General case' 0 C--N 1.343 0.305 0 C-N-CA 129.281 3.032 . . . . 4.41 114.603 -170.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -136.06 24.76 3.3 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.405 2.282 . . . . 5.05 109.236 -176.621 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.1 m -58.02 -28.94 35.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 124.405 1.082 . . . . 2.07 110.82 -178.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.16 -41.97 16.15 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 124.047 0.832 . . . . 1.98 111.877 172.61 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 87.3 p -104.43 34.23 3.19 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-N 117.979 0.889 . . . . 3.33 111.166 -177.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -54.47 -35.02 62.59 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 121.001 -1.062 . . . . 1.3 110.567 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -56.07 -40.35 73.44 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.395 -0.816 . . . . 4.16 111.954 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -69.2 -49.83 52.93 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 108.019 -1.104 . . . . 3.24 108.019 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.92 -42.78 65.7 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 109.328 -0.619 . . . . 2.66 109.328 177.111 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.5 tmm? -61.7 -52.53 63.9 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 124.686 1.194 . . . . 2.0 110.093 178.374 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -53.97 -38.93 65.52 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 118.744 -0.646 . . . . 2.99 111.906 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.1 t -60.79 -61.54 2.51 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-N 118.908 0.776 . . . . 2.61 109.198 168.75 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 28.5 mt -53.27 -61.31 2.38 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 125.29 1.436 . . . . 1.4 112.36 -166.769 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -72.13 88.77 1.12 Allowed 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.028 -0.73 . . . . 2.09 109.028 -171.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.9 m -49.07 -28.07 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 C-N-CA 124.299 1.04 . . . . 2.34 113.71 -175.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -104.56 -11.66 16.86 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.031 1.332 . . . . 2.58 112.845 178.407 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 52.69 50.4 18.22 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.473 1.109 . . . . 4.14 111.361 177.848 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.0 p30 -82.33 -20.62 37.0 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 109.077 -0.712 . . . . 1.65 109.077 166.739 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 78.95 26.57 0.45 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.244 1.418 . . . . 2.09 111.449 176.671 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -135.13 120.73 19.37 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 104.313 -2.477 . . . . 5.39 104.313 162.023 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.405 ' HG ' ' CD2' ' A' ' 38' ' ' PHE . 0.8 OUTLIER -93.31 90.99 7.01 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.057 -1.46 . . . . 1.19 107.057 -168.037 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.0 pttt -76.22 169.59 17.93 Favored 'General case' 0 CA--C 1.528 0.113 0 O-C-N 123.147 0.279 . . . . 4.1 110.726 -178.024 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.2 p90 -36.66 -61.63 0.52 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.441 1.275 . . . . 6.26 114.441 -163.4 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.98 -26.56 54.05 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.539 1.063 . . . . 2.23 111.212 -175.148 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -64.98 -56.75 11.36 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 108.374 -0.973 . . . . 2.08 108.374 174.835 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -48.9 -54.93 13.34 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.871 1.268 . . . . 3.15 109.775 173.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 59.2 t90 -46.85 -41.89 16.44 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.955 0.902 . . . . 4.23 111.956 -168.799 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 23.6 ttp85 -45.06 -40.67 6.91 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 118.305 -0.855 . . . . 3.68 111.357 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 6.6 tp -45.09 -50.35 11.1 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 118.154 -0.927 . . . . 0.95 111.87 177.052 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 92.1 mt -58.81 -32.03 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 108.316 -0.994 . . . . 1.64 108.316 -176.727 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.616 ' HA3' ' CE2' ' B' ' 77' ' ' TRP . . . -70.0 -50.14 30.63 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 127.072 2.273 . . . . 1.24 112.103 177.415 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.444 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 3.0 mt-10 -58.2 -62.9 1.49 Allowed 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 106.775 -1.565 . . . . 2.9 106.775 177.129 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.653 ' HB2' HD23 ' A' ' 49' ' ' LEU 0.262 4.3 pp -53.34 -37.42 62.31 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.301 0.955 . . . . 2.11 112.305 177.23 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.52 -62.11 1.9 Allowed 'General case' 0 C--N 1.342 0.245 0 CA-C-N 119.179 0.9 . . . . 2.19 111.073 173.855 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . 0.275 0.0 OUTLIER -70.2 -20.09 63.13 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 119.095 -1.042 . . . . 1.98 112.042 -174.75 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 5.3 mm-40 -56.31 -31.35 63.6 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 118.144 -0.931 . . . . 2.62 110.676 173.379 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.5 tt -58.81 -12.49 2.64 Favored 'Isoleucine or valine' 0 C--N 1.348 0.501 0 N-CA-C 113.417 0.895 . . . . 1.56 113.417 173.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 5.5 ptm85 -118.75 -38.43 3.11 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 118.918 0.781 . . . . 4.22 112.079 172.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.408 0 N-CA-C 116.565 2.061 . . . . 3.31 116.565 -177.028 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 66.1 mt . . . . . 0 CA--C 1.555 1.141 0 N-CA-C 112.675 0.62 . . . . 3.53 112.675 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.688 HG22 ' CG ' ' B' ' 10' ' ' GLU . 2.2 t -66.51 178.04 1.37 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.451 1.501 . . . . 2.05 111.224 178.226 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -59.26 -61.54 2.55 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.436 -0.79 . . . . 2.69 112.387 -175.174 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 14.4 mt -53.63 -43.61 68.84 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.162 -0.961 . . . . 1.28 111.68 175.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 10' ' ' GLU . . . . . 0.688 ' CG ' HG22 ' B' ' 7' ' ' THR . 69.5 mt-10 -53.73 -48.19 69.87 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 124.761 1.225 . . . . 3.54 111.785 175.45 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -59.15 -46.99 86.93 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 120.609 -1.307 . . . . 4.52 109.772 173.669 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 16.1 m -57.44 -43.78 84.17 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.479 0.712 . . . . 1.67 110.977 -175.433 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.256 2.3 pp -67.05 -41.32 87.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.149 0 CA-C-O 118.479 -0.772 . . . . 1.05 111.385 172.042 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -53.49 -56.75 14.37 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.258 0.935 . . . . 2.4 110.661 178.383 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.9 t -49.33 -45.8 45.97 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 118.996 0.816 . . . . 1.3 111.968 -174.373 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 20.3 m -72.62 -38.18 58.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 O-C-N 120.808 -1.182 . . . . 0.92 111.395 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 43.8 t -58.04 -41.28 80.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 O-C-N 121.823 -0.548 . . . . 1.06 110.218 174.179 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . 0.257 11.9 t -70.64 -41.23 72.43 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 118.205 -0.902 . . . . 1.19 111.257 176.456 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 4.0 m -51.21 -52.43 44.58 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-N 120.649 1.568 . . . . 1.09 109.991 171.511 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 20' ' ' PHE . . . . . 0.461 ' CZ ' HD23 ' B' ' 33' ' ' LEU . 25.2 t80 -51.9 -61.07 2.49 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.362 0.665 . . . . 4.23 110.09 174.818 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -61.74 -40.92 96.79 Favored 'General case' 0 C--N 1.334 -0.107 0 C-N-CA 123.463 0.705 . . . . 3.31 111.517 -168.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 41.1 p -60.96 -60.09 4.35 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.474 -0.565 . . . . 2.25 109.474 173.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -57.99 -35.12 70.76 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.417 0.553 . . . . 3.66 111.346 -174.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.04 -29.31 43.38 Favored 'General case' 0 CA--C 1.513 -0.448 0 C-N-CA 127.182 2.193 . . . . 1.06 110.929 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -47.06 -34.31 5.71 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 124.241 0.963 . . . . 4.53 111.873 175.527 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.84 -66.55 0.48 Allowed 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 115.963 1.838 . . . . 1.71 115.963 -146.845 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -91.2 -75.89 0.46 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 119.24 -0.984 . . . . 3.03 113.089 -167.637 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.44 156.19 23.18 Favored Glycine 0 C--N 1.338 0.667 0 C-N-CA 127.394 2.426 . . . . 2.39 109.666 160.019 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 47.4 102.37 0.0 OUTLIER 'General case' 0 C--O 1.242 0.684 0 N-CA-C 114.775 1.398 . . . . 4.61 114.775 144.316 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -71.5 47.28 0.12 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.13 1.372 . . . . 4.17 112.867 176.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -157.24 -51.69 0.07 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.674 0.79 . . . . 3.17 109.448 -173.409 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 33.9 p -85.36 146.39 27.03 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 123.126 0.57 . . . . 1.63 110.366 172.461 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.461 HD23 ' CZ ' ' B' ' 20' ' ' PHE . 0.7 OUTLIER -92.5 178.41 5.82 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 108.2 -1.037 . . . . 2.08 108.2 164.013 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 34' ' ' SER . . . . . 0.41 ' C ' ' O ' ' B' ' 35' ' ' VAL . 28.0 m -154.23 -175.98 5.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 122.077 0.941 . . . . 2.9 110.46 -143.553 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.41 ' O ' ' C ' ' B' ' 34' ' ' SER . 21.7 t -73.18 -166.15 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 N-CA-C 100.781 -3.785 . . . . 3.37 100.781 141.275 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.47 51.85 1.93 Allowed 'General case' 0 CA--C 1.552 1.057 0 O-C-N 116.709 -3.744 . . . . 3.71 113.114 -111.038 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -61.58 -59.41 5.25 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 126.796 2.038 . . . . 1.63 108.887 125.479 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.472 ' CE2' HD13 ' B' ' 63' ' ' LEU . 0.4 OUTLIER -54.96 -44.42 74.35 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 119.727 -0.789 . . . . 2.22 111.786 -163.252 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.87 -35.36 68.83 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.477 -0.764 . . . . 2.9 111.806 176.965 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -56.39 -31.98 64.37 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.474 0.579 . . . . 3.1 111.726 177.002 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -64.43 -55.11 23.07 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 119.294 0.952 . . . . 2.66 108.648 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 13.8 m -69.05 -38.47 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 114.486 -1.233 . . . . 0.94 109.256 -170.208 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 85.5 m -63.63 -57.67 9.33 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.328 1.051 . . . . 1.23 110.958 174.09 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -76.01 -60.79 2.17 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 122.136 -0.353 . . . . 2.46 111.025 -165.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.81 -47.37 12.93 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 122.314 -0.241 . . . . 3.06 111.096 -171.596 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 2.1 tp -84.3 -16.44 0.23 Allowed Pre-proline 0 CA--C 1.544 0.738 0 N-CA-C 120.893 3.664 . . . . 2.07 120.893 -151.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -44.4 -50.97 7.45 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 123.51 2.806 . . . . 1.87 116.053 -143.576 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 42.6 t-80 -76.91 48.95 0.62 Allowed 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.777 0.717 . . . . 3.41 112.215 -176.39 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' B' ' 49' ' ' LEU . 13.2 tp -150.99 -61.62 0.18 Allowed 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 124.257 1.023 . . . . 0.96 109.738 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 96.7 mt -109.59 112.37 24.42 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.378 -0.971 . . . . 1.69 108.378 169.334 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.3 -165.06 0.71 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 108.779 -0.823 . . . . 5.03 108.779 170.709 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 64.64 24.84 13.03 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.849 1.26 . . . . 3.97 110.626 169.892 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 33.0 m -61.62 -18.94 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 125.009 1.324 . . . . 1.76 113.03 -168.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.15 -52.85 49.35 Favored Glycine 0 CA--C 1.53 1.016 0 N-CA-C 110.305 -1.118 . . . . 2.77 110.305 168.096 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 22.6 t -81.29 34.66 0.37 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.797 1.239 . . . . 2.39 111.534 -171.026 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -60.03 -25.19 65.12 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.201 1.4 . . . . 1.22 110.246 -174.319 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -52.29 -33.01 40.25 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.113 1.365 . . . . 3.37 113.215 173.04 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -58.25 -44.67 88.44 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 120.044 1.293 . . . . 2.58 109.049 175.17 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -70.73 -49.18 49.73 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 107.419 -1.326 . . . . 4.08 107.419 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 13.9 tpt -39.68 -55.89 1.81 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.687 1.13 . . . . 2.54 110.615 176.032 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -60.92 -52.46 64.95 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.592 -0.276 . . . . 3.32 111.088 178.435 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.2 m -58.62 -30.37 67.21 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.082 0.771 . . . . 1.68 113.082 -178.915 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.472 HD13 ' CE2' ' B' ' 38' ' ' PHE . 60.3 mt -81.67 -55.28 4.75 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 126.183 1.793 . . . . 1.25 109.855 -176.545 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.26 2.9 t70 -68.72 -10.96 59.47 Favored 'General case' 0 C--O 1.218 -0.602 0 N-CA-C 115.083 1.512 . . . . 2.23 115.083 -170.163 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 18.9 m -31.98 -23.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 N-CA-C 120.069 3.359 . . . . 1.71 120.069 -134.888 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -51.43 -34.38 34.67 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 121.106 1.776 . . . . 2.98 110.223 157.455 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 65.48 47.5 2.25 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.993 1.317 . . . . 2.93 109.163 174.132 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 27.2 p30 -76.9 -29.13 55.6 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.188 -0.915 . . . . 1.93 108.815 168.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 4.0 m 96.14 -5.98 0.08 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 128.25 2.62 . . . . 2.36 113.503 178.961 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -101.68 119.13 38.29 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 107.094 -1.447 . . . . 2.77 107.094 170.389 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.23 112.33 20.65 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.696 -1.224 . . . . 1.27 107.696 178.752 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.43 173.35 11.58 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.932 2.093 . . . . 2.95 110.719 -177.034 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -82.72 52.73 2.18 Favored 'General case' 0 C--N 1.345 0.407 0 O-C-N 121.08 -1.013 . . . . 3.85 111.004 176.675 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -169.58 48.07 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 106.498 -1.667 . . . . 2.54 106.498 125.655 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -97.38 -64.18 1.06 Allowed 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 119.841 -1.787 . . . . 1.98 109.265 152.998 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.455 ' CD2' ' CZ ' ' B' ' 38' ' ' PHE . 22.6 t80 -49.07 -48.71 43.89 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 125.327 1.451 . . . . 3.45 110.138 -177.039 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 0.7 OUTLIER -53.28 -31.64 44.76 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.494 -1.23 . . . . 4.76 110.886 -169.626 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 78' ' ' ARG . . . . . 0.469 ' HB2' ' CD2' ' B' ' 63' ' ' LEU . 28.4 mmt180 -40.16 -46.71 2.27 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.951 0.9 . . . . 4.49 112.283 170.863 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 2.8 tp -54.45 -37.18 64.87 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 117.908 0.322 . . . . 0.98 110.886 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 84.3 mt -63.85 -32.93 58.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 108.31 -0.996 . . . . 1.36 108.31 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.54 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -72.24 -40.88 54.78 Favored Glycine 0 CA--C 1.491 -1.459 0 C-N-CA 124.523 1.059 . . . . 1.46 110.688 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 82' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' B' ' 86' ' ' GLU . 1.2 mm-40 -64.67 -64.92 0.75 Allowed 'General case' 0 N--CA 1.433 -1.308 0 N-CA-C 106.075 -1.824 . . . . 2.25 106.075 177.085 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 3.8 pp -55.44 -34.58 64.58 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 118.533 0.606 . . . . 1.82 112.341 -173.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.65 -62.13 2.08 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 118.346 0.521 . . . . 1.49 111.042 170.127 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.302 0.0 OUTLIER -63.41 -30.63 71.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 118.219 -0.896 . . . . 1.83 111.428 -173.574 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' B' ' 82' ' ' GLU . 12.1 mm-40 -54.21 -26.14 26.79 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.15 0.98 . . . . 2.86 111.952 177.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 3.5 tt -59.4 -38.28 74.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 119.802 1.183 . . . . 1.24 110.834 172.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -82.35 -41.84 19.49 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.6 1.96 . . . . 3.78 110.583 176.747 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.224 -0.247 0 C-N-CA 126.442 1.897 . . . . 5.05 111.011 -165.981 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 . . . . . 0 CA--C 1.538 0.502 0 CA-C-O 117.924 -1.036 . . . . 7.59 110.969 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -71.64 161.98 43.57 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 CA-C-N 121.05 1.411 . . . . 3.91 109.727 170.406 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.5 mt -130.62 -157.9 0.85 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.716 1.606 . . . . 1.92 108.344 -171.351 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 57.3 m -60.55 144.79 50.75 Favored 'General case' 0 C--O 1.224 -0.243 0 O-C-N 120.506 -1.371 . . . . 3.82 109.909 176.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -35.58 -66.86 0.18 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.948 1.299 . . . . 3.7 111.756 170.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.21 -32.69 74.15 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.377 -1.297 . . . . 2.09 113.022 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -52.91 -49.5 65.82 Favored 'General case' 0 C--N 1.347 0.477 0 CA-C-N 120.855 1.661 . . . . 2.25 111.515 168.107 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -49.5 -51.77 34.04 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 108.493 -0.929 . . . . 3.08 108.493 175.22 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.5 m -60.43 -53.14 61.1 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.647 -0.706 . . . . 1.99 111.862 -175.667 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.272 2.7 pp -64.88 -38.49 82.9 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 O-C-N 121.577 -0.702 . . . . 0.8 109.741 -176.513 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -62.47 -50.13 72.65 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.645 -0.66 . . . . 3.03 111.222 175.263 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 t -58.93 -34.65 71.96 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.073 0.851 . . . . 1.2 111.749 -173.834 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 23.0 m -77.13 -41.44 30.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 O-C-N 121.171 -0.956 . . . . 0.73 110.878 174.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.9 t -53.91 -47.7 63.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 118.923 0.783 . . . . 0.76 110.81 175.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.9 t -62.67 -43.16 99.51 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.454 -0.779 . . . . 0.88 110.897 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 39.1 m -59.9 -50.2 74.7 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.877 -0.514 . . . . 1.05 109.689 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -47.73 -56.93 6.26 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.461 0.705 . . . . 3.07 110.585 169.35 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -60.3 -45.32 93.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.077 0.551 . . . . 3.29 111.178 -169.757 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.4 t -61.31 -32.36 72.22 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 120.061 -0.656 . . . . 2.53 110.789 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -70.19 -43.95 69.69 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-N 119.432 1.015 . . . . 3.03 110.72 168.395 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.13 -38.59 39.76 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 124.748 1.219 . . . . 1.05 111.797 -171.271 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.8 ptt85 -75.63 -20.45 58.5 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 117.563 -1.208 . . . . 4.57 113.877 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -47.77 -57.9 5.01 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 120.1 1.318 . . . . 2.33 112.898 -166.537 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -120.66 93.57 4.08 Favored 'General case' 0 C--O 1.242 0.704 0 C-N-CA 128.541 2.736 . . . . 3.13 106.08 -171.552 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 48.59 -174.19 0.03 OUTLIER Glycine 0 CA--C 1.526 0.736 0 C-N-CA 125.699 1.619 . . . . 1.71 112.37 -176.361 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.3 mmt-85 29.74 97.46 0.0 OUTLIER 'General case' 0 C--O 1.24 0.596 0 C-N-CA 126.09 1.756 . . . . 4.75 112.846 164.629 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.53 40.87 0.38 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.598 1.559 . . . . 5.6 109.167 177.749 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -154.81 -51.87 0.09 Allowed 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 106.285 -1.746 . . . . 4.97 106.285 -145.305 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.5 p -115.16 139.3 50.03 Favored 'General case' 0 C--O 1.246 0.889 0 C-N-CA 125.566 1.546 . . . . 2.24 111.097 172.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -101.4 117.64 35.35 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 113.727 -1.579 . . . . 2.5 108.241 -176.846 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 19.0 m -88.35 174.98 7.84 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.074 1.75 . . . . 2.12 110.999 178.776 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.5 m -58.82 -48.82 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 O-C-N 121.395 -0.816 . . . . 2.68 112.979 -172.654 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -68.35 -47.38 67.62 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-O 118.4 -0.81 . . . . 2.95 109.518 -178.262 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -41.81 -46.91 4.04 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.059 0.845 . . . . 2.1 112.02 168.237 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.401 ' CZ ' HD13 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -56.71 -59.99 4.21 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.168 0.587 . . . . 2.9 110.602 172.986 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -57.93 -41.18 82.23 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.491 0.716 . . . . 2.69 111.32 -172.621 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -47.84 -40.63 21.85 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.137 0.975 . . . . 3.19 112.122 174.057 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.32 -52.47 65.49 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 119.617 1.098 . . . . 3.18 108.113 -178.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.1 m -72.94 -50.87 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 CA-C-N 114.919 -1.037 . . . . 1.61 109.703 -169.498 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.2 m -57.36 -44.31 84.27 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 125.401 1.48 . . . . 1.6 111.656 178.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -60.22 -62.34 1.94 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.78 0.718 . . . . 3.74 110.999 -173.284 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -145.15 38.53 1.17 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.493 0.923 . . . . 4.69 113.493 -173.033 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.58 HD21 HD22 ' A' ' 83' ' ' LEU . 0.6 OUTLIER -129.13 31.75 0.22 Allowed Pre-proline 0 CA--C 1.549 0.934 0 N-CA-C 116.074 1.879 . . . . 2.24 116.074 178.857 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -62.38 -60.52 0.19 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.852 2.368 . . . . 2.51 114.232 -165.471 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -66.3 -37.96 86.63 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 121.337 -0.852 . . . . 4.26 111.421 -175.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.459 HD13 HD12 ' B' ' 6' ' ' LEU . 22.5 tp -65.66 -54.32 29.11 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.993 0.517 . . . . 1.48 110.027 -173.46 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.5 mt -107.63 87.71 2.56 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-O 121.841 0.829 . . . . 2.1 109.533 169.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.69 160.35 0.66 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 113.981 -1.463 . . . . 5.53 111.645 170.999 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 57.53 39.66 27.62 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.205 1.002 . . . . 5.39 111.098 168.185 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -41.28 -34.57 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 128.186 2.594 . . . . 2.63 112.658 177.073 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -39.75 -48.69 3.23 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.153 0.883 . . . . 1.71 112.006 174.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.6 t -91.95 20.72 5.49 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.763 0.825 . . . . 1.91 113.226 -172.509 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.498 HD13 ' C ' ' A' ' 56' ' ' LEU . 1.5 tm? -39.2 -46.38 1.48 Allowed 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 125.642 1.577 . . . . 1.72 111.897 173.854 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -49.94 -37.5 32.22 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.932 2.093 . . . . 4.56 111.75 -174.443 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -58.49 -52.9 63.67 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 121.535 0.683 . . . . 2.96 109.781 173.456 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -49.51 76.05 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 107.933 -1.136 . . . . 2.93 107.933 -178.8 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -49.51 -54.6 17.02 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.414 0.686 . . . . 1.61 110.651 177.484 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -59.83 -43.78 94.41 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 122.346 -0.221 . . . . 2.95 111.203 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.6 t -60.24 -44.1 95.53 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.831 0.824 . . . . 1.89 111.185 178.18 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.401 HD13 ' CZ ' ' A' ' 38' ' ' PHE . 11.0 mt -64.69 -46.3 82.96 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.531 1.133 . . . . 2.17 110.601 -179.046 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -69.11 77.0 0.34 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.439 1.096 . . . . 1.64 110.629 -177.04 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.0 m -46.15 -43.35 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 C-N-CA 124.673 1.189 . . . . 1.68 113.648 -172.758 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -96.82 6.6 48.36 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.436 0.694 . . . . 2.24 112.254 -176.239 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 37.5 56.8 1.42 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.831 2.053 . . . . 3.1 112.189 -177.941 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 50.6 p30 -94.42 -5.92 45.22 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.929 1.292 . . . . 1.63 110.565 177.035 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.9 m 67.8 19.94 9.49 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.892 1.277 . . . . 1.73 111.583 -174.471 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -131.03 109.39 10.47 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.685 -1.598 . . . . 3.03 106.685 174.567 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.422 ' CD2' ' N ' ' A' ' 71' ' ' LEU . 0.1 OUTLIER -83.53 105.39 14.42 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 103.86 -2.644 . . . . 1.23 103.86 171.838 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 164.86 1.24 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 108.71 -0.848 . . . . 4.04 108.71 169.37 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -38.05 -60.55 0.74 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.923 1.289 . . . . 4.7 110.98 175.495 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -67.78 -26.64 66.2 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.229 1.012 . . . . 1.56 112.264 -175.367 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -73.36 -59.07 2.88 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.804 0.729 . . . . 2.16 109.067 174.749 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -51.8 -47.86 64.08 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 109.422 -0.584 . . . . 2.55 109.422 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.675 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 55.4 t90 -46.5 -39.53 10.95 Favored 'General case' 0 N--CA 1.44 -0.94 0 O-C-N 124.312 1.007 . . . . 4.13 111.528 -175.808 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 70.6 mtt180 -43.43 -40.99 4.04 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.676 0.671 . . . . 4.03 112.756 175.014 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 28.7 tp -52.55 -44.64 65.97 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.065 0.546 . . . . 1.05 111.149 179.036 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 55.1 mt -60.23 -28.34 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 N-CA-C 108.0 -1.111 . . . . 1.47 108.0 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.587 ' CA ' ' CZ2' ' B' ' 77' ' ' TRP . . . -68.88 -52.76 22.68 Favored Glycine 0 CA--C 1.492 -1.367 0 C-N-CA 126.547 2.022 . . . . 1.27 111.896 178.978 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.43 -59.71 5.01 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 105.792 -1.929 . . . . 2.38 105.792 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.58 HD22 HD21 ' A' ' 46' ' ' LEU 0.298 4.3 pp -54.35 -38.43 66.07 Favored 'General case' 0 CA--C 1.551 1.015 0 O-C-N 121.339 -0.851 . . . . 1.95 112.768 179.016 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 84' ' ' ALA . . . . . 0.463 ' O ' HG22 ' A' ' 87' ' ' ILE . . . -62.84 -29.01 70.41 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.091 -1.005 . . . . 1.25 113.528 175.016 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -81.06 -44.16 18.42 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.601 1.56 . . . . 1.69 109.691 174.784 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -63.29 -25.73 68.45 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.82 1.248 . . . . 2.59 111.162 -175.346 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 84' ' ' ALA . 12.4 tt -48.23 -34.37 4.85 Favored 'Isoleucine or valine' 0 C--N 1.344 0.34 0 CA-C-N 119.259 0.936 . . . . 1.42 112.825 167.725 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 38.1 ttp180 -96.51 -48.6 5.48 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.611 1.164 . . . . 5.11 108.669 177.688 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 74.1 tttt . . . . . 0 CA--C 1.539 0.553 0 N-CA-C 113.527 0.936 . . . . 2.86 113.527 -173.197 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.81 HD12 ' HG3' ' B' ' 10' ' ' GLU . 5.9 mt . . . . . 0 CA--C 1.544 0.72 0 N-CA-C 113.759 1.022 . . . . 4.24 113.759 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 6.8 t -170.09 -175.41 2.0 Allowed 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 120.204 1.366 . . . . 2.25 110.989 -172.937 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 70.8 tt0 -71.42 -67.25 0.53 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.848 1.204 . . . . 2.71 112.118 -167.107 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 11.9 mt -48.97 -42.34 37.31 Favored 'General case' 0 C--N 1.34 0.196 0 O-C-N 121.615 -0.678 . . . . 1.26 110.793 173.815 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 10' ' ' GLU . . . . . 0.81 ' HG3' HD12 ' B' ' 6' ' ' LEU . 11.3 tm-20 -48.94 -61.29 2.14 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 117.76 -1.114 . . . . 5.84 112.472 169.223 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -51.51 -41.6 61.11 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 121.402 1.91 . . . . 3.75 109.946 178.043 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.2 t -61.83 -30.4 70.81 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 118.334 -0.841 . . . . 1.63 112.839 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.408 ' CD1' HD12 ' A' ' 87' ' ' ILE 0.284 2.7 pp -80.51 -35.68 15.4 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 119.842 1.201 . . . . 1.09 110.892 167.341 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -52.38 -53.32 46.33 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 108.066 -1.087 . . . . 3.03 108.066 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 7.8 t -55.02 -35.4 64.38 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.115 0.783 . . . . 1.25 113.115 -175.454 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 20.0 m -80.11 -37.09 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 O-C-N 120.807 -1.183 . . . . 0.77 110.172 175.163 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 43.4 t -58.65 -45.57 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 123.807 0.843 . . . . 0.87 110.593 177.19 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 8.9 t -60.79 -44.08 97.29 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 119.853 1.206 . . . . 1.34 110.609 175.07 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 23.1 m -57.77 -52.16 66.61 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 119.094 0.861 . . . . 1.06 109.733 178.797 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -46.83 -60.88 2.13 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.186 1.394 . . . . 3.9 110.968 171.281 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -59.49 -49.72 76.68 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.977 1.311 . . . . 2.83 110.975 -171.804 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 34.6 p -56.15 -56.68 17.96 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 118.915 -0.564 . . . . 2.19 109.819 177.886 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -52.71 -47.24 67.43 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 119.099 0.863 . . . . 2.83 111.338 175.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.39 -29.7 58.99 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.366 1.467 . . . . 1.2 110.653 -175.56 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.07 -21.25 58.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 117.435 -1.269 . . . . 5.52 113.289 177.48 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.08 -65.03 0.71 Allowed 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 118.148 -1.421 . . . . 2.03 114.56 -156.703 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -88.41 -80.21 0.29 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 119.279 -0.968 . . . . 3.48 112.774 -162.732 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.34 170.05 29.62 Favored Glycine 0 C--N 1.34 0.774 0 C-N-CA 128.802 3.096 . . . . 2.29 110.834 148.689 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 61.29 87.58 0.09 Allowed 'General case' 0 C--O 1.241 0.622 0 N-CA-C 112.283 0.475 . . . . 4.93 112.283 140.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -74.83 52.72 0.55 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 125.631 1.572 . . . . 3.52 110.833 174.997 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -161.94 -58.74 0.05 OUTLIER 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 107.842 -1.17 . . . . 3.92 107.842 -172.013 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 17.1 m -96.66 142.27 28.9 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 124.135 0.974 . . . . 3.55 110.486 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -83.18 131.96 35.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.313 1.045 . . . . 2.11 109.058 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 1.3 p -114.8 174.44 5.97 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.848 1.259 . . . . 2.53 108.724 171.988 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.81 51.23 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.338 0.087 0 O-C-N 121.255 -0.903 . . . . 2.55 111.143 -170.229 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -155.2 53.74 0.63 Allowed 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 105.416 -2.068 . . . . 2.03 105.416 145.247 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -149.24 -54.45 0.17 Allowed 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 130.683 3.593 . . . . 2.01 104.527 173.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.48 -55.11 28.05 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.174 -0.921 . . . . 2.28 109.192 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 42.5 tttt -61.21 -41.73 97.36 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 120.296 -0.561 . . . . 2.98 111.118 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 83.4 mt-10 -51.41 -40.39 59.22 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 118.134 0.425 . . . . 3.11 111.587 177.927 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 10.2 tt -67.98 -47.3 68.94 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 109.15 -0.685 . . . . 1.89 109.15 -175.3 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.4 m -68.52 -47.82 75.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 109.873 -0.417 . . . . 0.84 109.873 -176.121 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 55.8 m -60.29 -55.26 35.83 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.381 1.072 . . . . 0.92 111.501 178.917 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -79.02 -58.81 3.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 118.25 0.477 . . . . 2.46 110.52 -171.851 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -80.98 -50.67 9.41 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 121.203 0.525 . . . . 2.94 110.387 -166.602 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.79 -16.93 0.23 Allowed Pre-proline 0 CA--C 1.543 0.702 0 N-CA-C 120.158 3.392 . . . . 1.86 120.158 -163.53 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -39.91 -50.69 3.26 Favored 'Trans proline' 0 CA--C 1.532 0.386 0 C-N-CA 125.038 3.825 . . . . 2.4 116.841 -134.652 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 13.2 t-160 -66.46 -30.94 71.39 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.968 0.729 . . . . 2.22 112.968 -172.944 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 29.2 tp -67.64 -73.49 0.14 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.573 0.624 . . . . 1.19 110.096 -170.378 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 60.6 mt -79.42 78.96 5.91 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 108.218 -1.03 . . . . 1.67 108.218 170.166 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.18 169.91 0.76 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.67 -0.695 . . . . 4.93 110.243 167.588 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 66.85 40.03 3.23 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.233 1.413 . . . . 4.76 109.602 -167.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 27.3 m -59.78 -24.3 28.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 C-N-CA 124.188 0.995 . . . . 2.0 111.854 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.6 -67.03 2.28 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 109.408 -1.477 . . . . 2.47 109.408 171.636 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.8 m -72.02 61.73 0.44 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 127.032 2.133 . . . . 3.17 111.292 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -80.9 -37.62 29.39 Favored 'General case' 0 N--CA 1.439 -1.019 0 C-N-CA 124.449 1.1 . . . . 1.12 109.178 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -54.63 -49.76 69.75 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.55 0.74 . . . . 3.53 111.342 -175.766 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.63 -38.39 81.22 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 121.872 -0.517 . . . . 3.08 111.348 176.686 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.23 -54.13 48.05 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.352 0.661 . . . . 4.04 109.392 176.595 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -52.75 -52.68 55.44 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 126.321 1.848 . . . . 1.6 110.136 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 77.3 mttt -58.33 -45.96 87.1 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.183 0.593 . . . . 4.3 110.358 178.869 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 12.3 t -57.96 -44.72 87.2 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.095 0.558 . . . . 1.6 110.551 177.994 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 22.9 mt -63.42 -45.03 92.83 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.136 0.575 . . . . 1.75 111.356 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.328 16.1 t0 -51.66 -8.35 0.06 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 118.799 2.888 . . . . 2.11 118.799 -169.202 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 26.9 m -34.07 -19.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.539 1 C-N-CA 131.982 4.113 . . . . 1.87 119.276 -137.099 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -36.62 62.79 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 120.366 1.439 . . . . 3.18 109.656 160.901 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 66.62 63.51 0.5 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 125.586 1.555 . . . . 4.33 109.268 -171.226 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 30.0 p30 -120.35 -16.13 8.48 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.859 2.063 . . . . 2.44 112.668 -175.387 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.5 m 70.87 22.37 4.74 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.247 1.819 . . . . 2.69 113.093 -176.85 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -128.5 112.44 14.34 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.16 -1.793 . . . . 3.37 106.16 166.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -81.02 110.57 16.68 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 106.403 -1.703 . . . . 1.41 106.403 174.781 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 10.5 tppt? -79.0 168.66 19.37 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.518 -0.919 . . . . 3.72 108.518 -173.834 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 20.0 p90 -91.26 50.42 1.75 Allowed 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.999 -0.438 . . . . 5.33 110.314 174.975 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -156.7 48.43 0.46 Allowed 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 106.661 -1.607 . . . . 2.25 106.661 119.158 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -94.65 -62.12 1.38 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.897 1.679 . . . . 2.62 109.078 142.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -44.91 -48.73 11.26 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 125.883 1.673 . . . . 3.74 110.078 -173.451 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.675 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 4.1 t-105 -44.74 -37.13 3.55 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.627 -1.178 . . . . 4.7 111.76 -178.985 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 1.7 ttt85 -40.11 -47.26 2.32 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 119.987 1.267 . . . . 6.8 110.864 174.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 15.8 tp -44.19 -47.07 9.16 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.637 0.775 . . . . 0.86 110.599 -178.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 53.9 mt -62.76 -34.0 63.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.988 0.899 . . . . 1.6 109.559 -173.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.572 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -72.53 -42.81 46.86 Favored Glycine 0 CA--C 1.487 -1.7 0 N-CA-C 109.544 -1.423 . . . . 1.47 109.544 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.262 5.0 mm-40 -67.07 -48.41 68.34 Favored 'General case' 0 N--CA 1.421 -1.882 0 N-CA-C 105.535 -2.024 . . . . 3.29 105.535 -175.819 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 7.7 mt -42.9 -58.07 2.55 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 121.262 1.846 . . . . 2.22 111.896 166.864 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.42 -23.46 49.62 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.618 0.767 . . . . 1.3 112.536 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.01 -57.21 3.74 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.453 1.101 . . . . 2.03 110.581 170.47 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -57.53 -28.03 63.13 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 129.01 2.924 . . . . 2.79 111.68 -168.11 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 2.9 tt -49.58 -44.17 18.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 O-C-N 122.014 -0.429 . . . . 1.14 110.662 168.446 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -85.56 -61.65 1.71 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.62 1.568 . . . . 3.86 113.67 167.861 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 35.3 tttm . . . . . 0 CA--C 1.534 0.329 0 C-N-CA 125.75 1.62 . . . . 7.14 110.947 -173.652 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 . . . . . 0 N--CA 1.45 -0.426 0 CA-C-O 118.995 -0.526 . . . . 4.66 110.565 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.51 113.1 3.63 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 122.346 2.031 . . . . 2.43 109.269 178.394 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 61.5 mt -69.23 164.2 23.25 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.076 0.55 . . . . 1.44 110.312 177.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.4 t -76.63 162.21 27.93 Favored 'General case' 0 CA--C 1.528 0.109 0 N-CA-C 108.992 -0.744 . . . . 2.0 108.992 176.928 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.91 -53.28 59.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.171 0.988 . . . . 3.18 111.216 -169.21 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.5 mt -62.77 -49.87 73.29 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 118.046 -0.978 . . . . 1.42 112.563 178.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -51.1 -54.46 24.81 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 119.687 1.13 . . . . 2.12 110.683 175.897 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -49.26 -56.18 10.22 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.066 1.347 . . . . 3.84 110.161 174.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.3 t -53.5 -46.97 70.24 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.999 0.92 . . . . 2.15 111.392 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.311 2.8 pp -70.04 -35.49 64.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 O-C-N 120.966 -1.084 . . . . 0.99 111.42 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -59.14 -51.84 68.26 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.2 0.909 . . . . 2.79 109.977 176.11 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . 0.256 12.5 t -53.26 -38.94 63.49 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 121.801 -0.562 . . . . 1.87 112.177 -176.786 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 m -72.92 -39.35 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 O-C-N 120.461 -1.399 . . . . 0.9 111.226 175.666 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.4 t -55.22 -47.3 77.76 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.112 0 CA-C-N 118.252 0.478 . . . . 0.81 110.184 175.613 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . 0.253 10.2 t -62.11 -48.57 79.56 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 117.937 -1.03 . . . . 1.23 111.334 178.502 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 16.4 m -49.92 -52.26 34.6 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 120.395 1.452 . . . . 1.51 110.803 173.019 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -50.92 -60.0 3.55 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.228 0.611 . . . . 3.01 110.163 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -61.89 -45.16 94.95 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.96 0.504 . . . . 3.13 111.384 -170.663 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -65.3 -19.22 65.86 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 119.252 -0.404 . . . . 2.16 111.902 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.526 ' HB3' HD21 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -81.54 -44.11 17.78 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 118.401 0.546 . . . . 3.11 111.899 164.947 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.17 -33.11 67.12 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.453 1.501 . . . . 0.78 111.655 -168.191 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 34.2 ptt180 -62.73 -34.96 78.27 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.545 1.138 . . . . 4.66 112.439 177.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -40.86 -64.69 0.5 Allowed 'General case' 0 C--N 1.344 0.365 0 CA-C-O 122.139 0.971 . . . . 1.9 113.255 -160.039 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -106.08 81.93 1.7 Allowed 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 103.889 -2.634 . . . . 3.16 103.889 -178.076 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 48.06 -172.94 0.04 OUTLIER Glycine 0 CA--C 1.53 1.012 0 C-N-CA 126.835 2.16 . . . . 2.17 114.518 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 34.73 88.54 0.01 OUTLIER 'General case' 0 C--O 1.235 0.333 0 C-N-CA 127.267 2.227 . . . . 4.75 112.367 169.05 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -75.97 57.84 1.11 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.955 1.302 . . . . 3.99 112.784 -166.779 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -163.53 -44.79 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 126.646 1.979 . . . . 4.37 106.906 174.539 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 m -82.08 113.39 19.91 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 125.479 1.512 . . . . 1.86 109.59 -179.113 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.645 HD22 ' CE1' ' A' ' 76' ' ' TYR . 4.8 mp -84.33 136.62 33.82 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.149 -0.478 . . . . 2.72 110.05 168.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.9 t -81.2 174.59 11.4 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.519 1.928 . . . . 2.86 108.625 172.541 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 11.5 p -62.21 -43.01 97.4 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 O-C-N 122.079 -0.388 . . . . 2.17 110.01 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -67.58 -57.29 6.72 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 118.182 -0.913 . . . . 2.05 109.113 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.408 ' HB3' HD23 ' A' ' 33' ' ' LEU . 5.5 mt-10 -37.6 -49.16 1.08 Allowed 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.361 1.464 . . . . 1.83 112.072 169.735 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -60.03 -59.99 4.53 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.967 -0.458 . . . . 3.36 110.597 174.271 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -52.92 -40.67 63.78 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.281 0.491 . . . . 3.2 111.671 -176.451 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -51.82 -39.97 59.68 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 123.968 0.907 . . . . 3.28 110.574 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 57.5 tp -68.58 -45.8 71.08 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 119.543 1.065 . . . . 2.37 109.435 -176.699 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.491 HG12 HD22 ' A' ' 46' ' ' LEU . 35.6 m -69.62 -28.1 36.27 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.123 0 CA-C-O 120.99 0.424 . . . . 1.89 110.4 -175.699 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 63.7 m -81.09 -40.23 24.42 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 124.383 1.073 . . . . 1.8 111.105 177.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -82.78 -55.86 4.18 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 124.176 0.991 . . . . 2.56 110.067 -172.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.2 mp0 -96.71 -146.51 0.29 Allowed 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 107.616 -1.253 . . . . 3.97 107.616 169.746 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.537 HD21 HD11 ' A' ' 83' ' ' LEU . 8.0 mp 38.63 44.95 0.68 Allowed Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 126.243 1.817 . . . . 2.53 113.15 -167.284 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.456 ' HD2' HG21 ' B' ' 7' ' ' THR . 58.3 Cg_endo -59.93 -32.86 95.77 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 122.55 2.167 . . . . 1.92 111.966 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.94 -6.33 3.11 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 114.485 1.291 . . . . 3.2 114.485 179.461 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.567 HD23 ' HG ' ' A' ' 83' ' ' LEU 2.134 10.8 mp -2.05 -144.83 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 120.989 3.7 . . . . 2.17 120.989 129.485 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.422 ' C ' ' H ' ' A' ' 52' ' ' ASP . 6.2 mt -82.73 88.13 6.74 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 113.33 -1.759 . . . . 2.06 107.714 174.8 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.73 18.88 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.899 1.444 . . . . 5.07 114.899 177.445 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.422 ' H ' ' C ' ' A' ' 50' ' ' LEU . 64.9 m-20 -115.57 20.67 14.55 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 128.192 2.597 . . . . 5.67 109.289 -172.653 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.0 m -53.33 -15.18 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 126.681 1.992 . . . . 2.69 114.833 -172.197 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -56.33 -51.85 53.47 Favored Glycine 0 CA--C 1.529 0.936 0 N-CA-C 110.048 -1.221 . . . . 2.38 110.048 170.817 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.8 t -84.92 60.45 6.23 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 122.361 1.077 . . . . 2.89 109.826 -173.179 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -77.38 -36.5 53.46 Favored 'General case' 0 N--CA 1.438 -1.057 0 O-C-N 121.628 -0.67 . . . . 1.6 109.79 -176.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -59.61 -46.7 88.19 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.783 0.719 . . . . 4.67 110.496 178.917 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -45.04 -57.92 3.53 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.576 1.15 . . . . 3.33 109.413 170.715 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 6.0 mmpt? -60.28 -45.15 94.32 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 118.735 -0.65 . . . . 5.34 110.78 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -51.34 -54.94 21.4 Favored 'General case' 0 C--N 1.334 -0.087 0 CA-C-N 119.428 1.013 . . . . 1.51 109.59 178.84 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 44.6 mtmt -57.57 -37.64 73.48 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 122.584 0.354 . . . . 3.15 111.001 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 14.5 m -62.9 -47.75 81.95 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.863 -0.523 . . . . 1.88 112.165 175.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.418 HD21 ' HB2' ' A' ' 79' ' ' LEU . 7.2 mp -66.77 -60.24 2.86 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 121.27 -0.894 . . . . 2.03 109.32 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -75.98 74.7 2.88 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.175 1.39 . . . . 1.58 109.683 -168.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.1 m -45.55 -37.19 2.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 124.93 1.292 . . . . 1.75 113.17 -175.971 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 11.0 p-10 -102.37 8.18 40.28 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 113.131 0.789 . . . . 2.84 113.131 -176.159 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 46.81 59.14 4.14 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.76 1.624 . . . . 3.36 112.359 172.233 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 40.5 p30 -108.69 -9.57 15.25 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.36 1.464 . . . . 2.0 111.76 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.2 m 62.47 25.7 15.31 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.173 0.989 . . . . 1.66 111.9 -170.663 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -122.81 100.91 7.15 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 126.194 1.798 . . . . 3.23 107.57 169.662 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -86.49 79.97 8.79 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 105.926 -1.879 . . . . 0.97 105.926 170.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -69.24 171.78 7.94 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 122.776 0.43 . . . . 3.96 110.706 174.209 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -37.92 -61.15 0.67 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.563 1.545 . . . . 5.29 112.842 -167.038 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -68.39 -44.5 74.97 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.582 -0.699 . . . . 2.47 111.432 -177.054 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -57.53 -33.15 67.79 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.209 0.603 . . . . 1.86 111.203 178.147 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.645 ' CE1' HD22 ' A' ' 33' ' ' LEU . 35.5 t80 -78.67 -48.19 15.51 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 118.102 0.41 . . . . 3.23 110.363 175.899 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.622 ' CD1' ' HA2' ' B' ' 81' ' ' GLY . 44.5 t-105 -48.54 -29.09 3.85 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.823 0.849 . . . . 5.08 111.72 176.886 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.406 ' HA ' ' CH2' ' B' ' 77' ' ' TRP . 14.4 mmm180 -37.23 -56.62 0.93 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.347 1.059 . . . . 3.66 110.859 166.766 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.418 ' HB2' HD21 ' A' ' 63' ' ' LEU . 26.0 tp -49.07 -43.33 40.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 123.905 0.882 . . . . 0.8 111.219 -179.588 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mp -80.72 -29.64 11.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 107.925 -1.139 . . . . 1.95 107.925 -168.501 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.43 ' HA3' ' CE2' ' B' ' 77' ' ' TRP . . . -56.22 -51.11 58.04 Favored Glycine 0 N--CA 1.439 -1.141 0 N-CA-C 110.259 -1.137 . . . . 1.13 110.259 164.786 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -63.22 -33.93 76.57 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-O 118.596 -0.716 . . . . 2.43 110.456 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.567 ' HG ' HD23 ' A' ' 49' ' ' LEU . 8.0 mp -57.84 -55.58 33.04 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 119.793 1.179 . . . . 2.4 109.708 173.716 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.12 -48.25 64.91 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.346 0.593 . . . . 1.55 109.914 177.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -55.65 -34.65 65.15 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 117.849 -1.072 . . . . 2.4 112.271 174.306 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -78.91 -14.22 59.35 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 127.406 2.283 . . . . 2.13 112.624 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -91.5 -26.72 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 N-CA-C 113.773 1.027 . . . . 2.75 113.773 157.803 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -65.5 0.75 Allowed 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 119.851 1.205 . . . . 4.82 111.579 175.277 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt . . . . . 0 C--O 1.214 -0.784 0 N-CA-C 104.106 -2.553 . . . . 3.59 104.106 145.345 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . 2.316 0.2 OUTLIER . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 112.751 0.648 . . . . 2.44 112.751 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.593 HG22 ' HB2' ' B' ' 10' ' ' GLU . 1.1 t -118.51 -109.68 0.35 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.738 2.015 . . . . 1.87 108.001 178.662 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -105.75 -68.72 0.85 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 126.351 1.86 . . . . 5.12 107.483 172.525 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 3.7 mp -65.79 -51.09 61.89 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.807 -0.558 . . . . 2.72 110.032 -177.283 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 10' ' ' GLU . . . . . 0.593 ' HB2' HG22 ' B' ' 7' ' ' THR . 4.2 mp0 -52.25 -39.58 60.52 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 119.22 -0.419 . . . . 3.84 111.375 173.301 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.57 -56.09 20.12 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.179 -0.675 . . . . 4.95 109.179 172.725 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 35.9 p -71.35 -39.63 71.19 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 119.926 -0.71 . . . . 2.19 110.822 -167.317 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.3 pp -69.67 -35.54 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 O-C-N 121.261 -0.899 . . . . 1.45 109.863 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -60.83 -55.46 32.86 Favored 'General case' 0 C--N 1.342 0.249 0 CA-C-N 119.199 0.909 . . . . 3.1 109.615 171.992 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.4 t -55.43 -38.84 69.5 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-O 121.911 0.862 . . . . 1.58 111.564 -170.787 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 17.0 m -72.89 -39.17 58.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 O-C-N 120.667 -1.271 . . . . 1.17 111.402 174.274 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 45.2 t -60.85 -44.1 96.98 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 119.447 1.021 . . . . 1.39 111.389 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 10.1 t -62.46 -45.92 90.84 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.725 1.148 . . . . 1.52 110.257 177.702 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 60.3 m -52.93 -55.18 25.31 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.345 0.593 . . . . 1.47 109.73 174.513 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -49.99 -49.83 49.19 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.611 1.164 . . . . 4.2 111.101 175.414 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -62.18 -54.31 42.9 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.889 0.875 . . . . 2.69 110.649 -175.435 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 15.0 t -62.13 -29.32 70.26 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 119.555 -0.858 . . . . 3.44 110.797 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -63.4 -54.02 43.29 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 118.4 0.545 . . . . 3.16 111.092 167.894 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.57 -30.28 62.97 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 126.336 1.854 . . . . 1.68 110.407 -172.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -54.85 -26.88 38.3 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.01 0.924 . . . . 3.97 112.657 176.603 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.451 ' HB3' ' CG ' ' B' ' 37' ' ' GLU . 11.2 tt0 -62.87 -68.64 0.32 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 114.063 1.134 . . . . 4.35 114.063 -157.083 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 27' ' ' GLU . . . . . 0.469 ' CD ' ' H ' ' B' ' 28' ' ' GLY . 0.0 OUTLIER -90.2 -74.91 0.47 Allowed 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 115.026 1.491 . . . . 5.07 115.026 -163.245 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' B' B ' 28' ' ' GLY . . . . . 0.469 ' H ' ' CD ' ' B' ' 27' ' ' GLU . . . -92.08 170.1 32.76 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 127.943 2.687 . . . . 2.66 109.779 154.965 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 38.41 102.09 0.0 OUTLIER 'General case' 0 C--O 1.24 0.58 0 C-N-CA 125.63 1.572 . . . . 4.04 114.792 142.675 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -71.09 49.73 0.14 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.631 1.572 . . . . 3.36 112.578 176.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -153.84 -53.67 0.1 Allowed 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.072 1.349 . . . . 3.72 108.17 -172.828 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.4 p -104.78 157.58 17.1 Favored 'General case' 0 C--O 1.244 0.799 0 C-N-CA 124.219 1.007 . . . . 2.29 113.305 -177.32 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.416 HD13 ' HB3' ' B' ' 37' ' ' GLU . 1.4 mm? -111.03 151.34 28.13 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 127.86 2.464 . . . . 2.34 109.39 -173.054 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 8.2 t -149.95 178.18 9.16 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.378 1.071 . . . . 3.53 108.323 169.976 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 9.2 p -83.89 53.09 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-O 121.865 0.84 . . . . 2.84 111.127 -171.969 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.25 56.12 0.51 Allowed 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 105.618 -1.993 . . . . 2.91 105.618 150.668 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.451 ' CG ' ' HB3' ' B' ' 26' ' ' GLN . 1.3 tt0 -173.78 -59.92 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 104.037 -2.579 . . . . 1.83 104.037 -172.677 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -57.55 -56.46 21.6 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.33 -0.85 . . . . 2.08 109.52 172.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.495 ' HE3' HD12 ' B' ' 56' ' ' LEU . 16.3 ttmt -57.05 -37.8 72.31 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 122.074 -0.391 . . . . 3.0 111.179 -177.005 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.74 -30.03 71.12 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.449 -0.782 . . . . 2.93 111.683 177.833 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.25 -52.54 63.32 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 107.978 -1.119 . . . . 2.66 107.978 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 42' ' ' VAL . . . . . 0.408 ' HA ' HD23 ' B' ' 46' ' ' LEU . 2.6 m -68.17 -42.55 84.9 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 115.125 -0.943 . . . . 0.82 109.969 -174.752 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 96.6 m -54.08 -54.16 43.24 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.941 -0.572 . . . . 1.28 110.054 173.189 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -82.15 -62.78 1.53 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.796 1.035 . . . . 1.96 113.796 -167.015 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -83.19 -36.13 24.91 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 115.932 1.827 . . . . 3.69 115.932 -163.587 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 46' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' B' ' 42' ' ' VAL . 1.5 mm? -46.67 -38.82 12.7 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 114.027 1.121 . . . . 1.79 114.027 -159.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -64.04 -20.87 68.21 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 C-N-CA 122.191 -2.004 . . . . 2.18 109.978 -62.48 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -93.09 -56.27 3.03 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.058 0.943 . . . . 2.87 110.986 -169.789 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.474 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 7.4 tp -30.56 -72.12 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.133 1.773 . . . . 1.2 113.34 -167.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 79.7 mt -90.24 128.74 36.48 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 106.464 -1.68 . . . . 1.89 106.464 169.794 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.43 -5.28 10.81 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.797 1.239 . . . . 6.76 111.835 -173.745 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -88.74 16.61 6.51 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 128.168 2.587 . . . . 4.75 111.201 -177.634 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 14.4 m -52.42 -28.09 11.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 125.259 1.424 . . . . 1.72 111.404 177.33 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.08 -35.13 8.29 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 124.308 0.956 . . . . 3.39 112.657 172.75 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.6 t -124.77 47.83 2.07 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 117.817 0.808 . . . . 2.75 109.23 171.994 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.534 HD13 ' C ' ' B' ' 56' ' ' LEU . 2.3 tm? -45.63 -39.69 8.06 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.159 0.984 . . . . 1.33 110.134 172.304 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -58.38 -25.62 62.28 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.196 0.998 . . . . 4.27 111.854 -174.561 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -58.53 -54.24 49.22 Favored 'General case' 0 C--N 1.344 0.332 0 O-C-N 121.326 -0.859 . . . . 2.87 109.399 165.872 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -49.29 75.49 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 108.421 -0.955 . . . . 3.23 108.421 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 16.3 tpt -46.23 -60.24 2.43 Favored 'General case' 0 N--CA 1.462 0.13 0 C-N-CA 123.635 0.774 . . . . 2.49 108.953 177.625 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -57.46 -42.15 81.96 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 122.516 0.326 . . . . 3.67 111.367 -178.859 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.5 m -65.48 -34.83 79.19 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.116 0.566 . . . . 2.71 112.442 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 39.2 mt -80.02 -44.91 19.31 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.884 1.274 . . . . 1.77 109.645 -176.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -49.35 -8.76 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 128.346 2.658 . . . . 2.32 117.17 -175.48 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 19.8 m -33.65 -28.27 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 131.024 3.73 . . . . 2.38 118.923 -124.125 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -67.4 -20.62 65.56 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 120.724 1.602 . . . . 3.48 110.977 170.869 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 69.85 65.52 0.24 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.059 1.344 . . . . 3.66 110.617 172.226 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 48.9 p30 -119.56 -7.39 10.13 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.37 1.868 . . . . 2.55 112.321 -176.819 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 14.8 m 72.73 18.61 4.17 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.337 1.855 . . . . 2.53 112.673 -174.241 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -126.11 110.28 13.33 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.362 1.465 . . . . 4.12 108.798 170.858 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -80.44 104.08 10.74 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 106.813 -1.551 . . . . 1.55 106.813 170.242 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -91.21 166.64 12.84 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.533 1.933 . . . . 4.07 110.023 -176.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -89.73 56.7 3.61 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.636 -0.665 . . . . 5.77 111.525 179.234 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -158.52 49.26 0.37 Allowed 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 106.861 -1.533 . . . . 2.75 106.861 109.895 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 77.7 mt-10 -95.58 -61.32 1.48 Allowed 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.906 2.083 . . . . 2.56 108.843 145.807 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -48.13 -38.34 17.65 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 125.779 1.632 . . . . 3.48 110.968 -174.042 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.43 ' CE2' ' HA3' ' A' ' 81' ' ' GLY . 23.0 t90 -39.75 -41.94 1.18 Allowed 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 124.228 0.955 . . . . 5.28 111.525 176.637 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 31.8 mmt180 -49.3 -30.28 7.16 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-O 117.666 -1.159 . . . . 5.13 113.095 179.282 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' B' ' 79' ' ' LEU . 18.3 tp -57.66 -44.43 85.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 121.776 2.08 . . . . 1.1 111.184 174.944 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 1.4 mt -80.94 -26.94 10.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 C-N-CA 124.2 1.0 . . . . 1.83 108.832 178.319 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.622 ' HA2' ' CD1' ' A' ' 77' ' ' TRP . . . -37.56 -57.02 1.55 Allowed Glycine 0 C--N 1.347 1.159 0 C-N-CA 127.7 2.572 . . . . 1.8 110.189 159.754 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 82' ' ' GLU . . . . . 0.402 ' C ' ' HG2' ' B' ' 86' ' ' GLU . 45.0 mm-40 -82.46 -63.78 1.31 Allowed 'General case' 0 N--CA 1.421 -1.895 0 CA-C-N 111.644 -2.278 . . . . 2.49 108.252 -172.146 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.474 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 1.7 mp -38.49 -59.6 0.89 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 120.45 1.477 . . . . 2.1 113.428 -169.556 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.34 -36.1 65.92 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 123.148 0.579 . . . . 1.41 111.365 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 22.0 ttpp -80.69 -39.9 26.35 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.031 0.933 . . . . 1.61 112.329 175.756 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.402 ' HG2' ' C ' ' B' ' 82' ' ' GLU . 5.3 mm-40 -60.45 -25.61 66.13 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 119.757 1.162 . . . . 3.19 112.266 -177.039 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 1.5 tp -44.1 -44.44 2.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 N-CA-C 109.566 -0.531 . . . . 1.33 109.566 167.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 -85.71 -60.15 2.1 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.805 2.042 . . . . 4.78 113.198 171.172 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 29.0 tttm . . . . . 0 CA--C 1.531 0.229 0 C-N-CA 125.616 1.566 . . . . 6.34 111.574 -166.9 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 . . . . . 0 N--CA 1.446 -0.625 0 CA-C-O 118.712 -0.661 . . . . 4.92 109.685 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -79.53 98.87 1.18 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.559 2.172 . . . . 2.6 109.575 -177.862 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.61 177.47 7.47 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.586 -0.524 . . . . 2.39 109.586 170.88 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.1 m -58.05 147.07 30.75 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.394 -0.816 . . . . 3.91 110.778 -173.005 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -53.96 -49.38 68.89 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.526 -0.734 . . . . 2.7 110.285 175.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.7 mt -59.22 -39.87 84.07 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 117.98 -1.009 . . . . 1.61 112.891 172.332 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -54.31 -50.27 67.73 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 120.583 1.538 . . . . 2.62 111.465 170.059 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.1 mm-40 -50.48 -53.33 30.66 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.322 -0.622 . . . . 4.15 109.322 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.9 p -67.14 -43.53 82.12 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 121.746 -0.596 . . . . 1.79 111.932 -174.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.482 HG21 HD12 ' B' ' 83' ' ' LEU 0.276 1.8 pp -62.2 -41.04 89.86 Favored 'Isoleucine or valine' 0 C--N 1.342 0.242 0 CA-C-N 119.961 1.255 . . . . 0.8 110.587 176.08 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -58.36 -47.48 83.68 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.285 0.948 . . . . 3.22 110.388 174.488 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -59.53 -35.32 73.97 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.626 0.602 . . . . 1.22 112.626 -175.582 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.0 m -80.16 -38.83 18.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 O-C-N 120.541 -1.35 . . . . 0.74 111.187 173.143 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.5 t -57.95 -44.12 86.09 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 118.708 0.685 . . . . 0.53 110.528 178.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.6 t -61.08 -46.69 89.62 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.375 -0.828 . . . . 0.66 110.075 177.173 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.7 m -56.68 -49.9 73.73 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.687 0.676 . . . . 0.86 109.778 177.28 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -47.83 -57.45 5.62 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.986 0.914 . . . . 3.31 110.951 170.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -67.26 -46.83 72.52 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.124 0.57 . . . . 2.71 111.123 -168.163 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 40.1 p -56.67 -28.49 60.81 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.577 0.751 . . . . 2.61 111.517 176.706 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -75.49 -55.18 5.94 Favored 'General case' 0 C--O 1.222 -0.384 0 C-N-CA 123.339 0.655 . . . . 2.51 111.969 165.938 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.61 -28.37 54.82 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 126.907 2.083 . . . . 0.91 112.173 -169.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -74.35 -18.79 60.63 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.563 1.145 . . . . 3.68 113.083 -179.456 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.66 -67.93 0.22 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.204 0.911 . . . . 2.64 112.516 -175.618 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -108.48 172.69 6.7 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 126.861 2.064 . . . . 2.6 106.703 -174.469 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -9.35 116.73 0.01 OUTLIER Glycine 0 CA--C 1.532 1.127 0 C-N-CA 127.481 2.467 . . . . 1.95 114.814 172.715 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? 64.03 107.34 0.03 OUTLIER 'General case' 0 C--O 1.239 0.529 0 C-N-CA 124.701 1.201 . . . . 4.37 113.279 171.658 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -65.57 58.82 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.086 0.954 . . . . 3.61 111.298 164.376 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -166.51 -47.91 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.788 1.635 . . . . 4.46 108.834 -171.374 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 13.9 p -95.85 129.2 43.16 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 125.446 1.499 . . . . 1.8 109.164 173.458 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.412 HD22 ' CD1' ' A' ' 76' ' ' TYR . 6.7 mp -84.11 136.24 34.08 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.018 -1.105 . . . . 2.55 108.018 161.167 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.1 t -80.24 170.91 15.77 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 125.097 1.359 . . . . 2.77 107.808 167.919 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.4 p -58.99 -41.33 82.88 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 O-C-N 121.882 -0.511 . . . . 3.07 109.872 176.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -66.33 -59.6 3.56 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 118.481 -0.771 . . . . 1.8 109.211 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -37.51 -54.16 1.14 Allowed 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 124.145 0.978 . . . . 1.92 112.048 169.822 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -59.88 -51.89 67.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.633 -0.258 . . . . 2.97 111.128 178.441 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.8 tttm -56.9 -38.96 73.55 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.568 0.622 . . . . 3.84 109.67 -176.499 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -66.32 -19.94 65.95 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 118.816 -0.611 . . . . 5.02 112.125 -176.861 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -61.52 -55.82 26.86 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-N 119.638 1.108 . . . . 2.71 108.053 169.824 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.0 m -71.0 -44.21 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-O 121.811 0.815 . . . . 1.64 109.605 -169.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 38.2 m -68.38 -42.2 79.45 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 124.979 1.312 . . . . 1.4 110.179 -175.765 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -75.79 -50.76 14.28 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.769 0.713 . . . . 2.59 110.646 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -149.45 73.23 1.18 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.314 0.506 . . . . 3.8 112.185 -173.847 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.8 tp -154.65 45.79 0.27 Allowed Pre-proline 0 CA--C 1.549 0.904 0 N-CA-C 112.766 0.654 . . . . 2.05 112.766 155.093 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -62.59 -74.58 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 124.116 3.211 . . . . 1.98 114.726 -162.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 23.0 t-160 -63.62 -24.4 67.78 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 121.47 -0.769 . . . . 4.53 111.107 -169.116 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.6 tp -74.2 -75.43 0.16 Allowed 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 122.617 0.367 . . . . 1.57 110.447 177.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.6 mt -95.71 65.78 2.64 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 108.636 -0.876 . . . . 2.57 108.636 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.464 ' CD ' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -54.68 -30.75 56.41 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 114.253 -1.34 . . . . 5.77 111.936 178.599 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.421 ' OD2' ' NZ ' ' A' ' 59' ' ' LYS . 33.3 t70 -73.35 72.16 1.29 Allowed 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.988 0.899 . . . . 3.47 108.906 162.731 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.2 t -77.11 -6.52 9.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 127.954 2.501 . . . . 2.99 109.557 161.091 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.89 -69.56 1.36 Allowed Glycine 0 C--N 1.345 1.041 0 C-N-CA 124.745 1.164 . . . . 2.27 110.493 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.54 52.89 1.47 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 123.159 1.457 . . . . 4.15 109.766 -176.347 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.3 -25.61 59.57 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 126.818 2.047 . . . . 2.06 110.049 -174.736 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -42.32 -45.67 4.32 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 126.513 1.925 . . . . 4.5 111.576 169.158 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -45.94 -52.83 10.97 Favored 'General case' 0 C--N 1.346 0.433 0 N-CA-C 108.992 -0.744 . . . . 6.39 108.992 177.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.477 ' HE2' ' H ' ' A' ' 59' ' ' LYS . 1.5 mppt? -74.83 -63.28 1.29 Allowed 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 106.015 -1.846 . . . . 4.24 106.015 -174.598 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -47.5 -55.4 9.2 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 123.56 0.744 . . . . 2.27 110.369 -170.621 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.2 ttpp -73.22 -19.0 61.18 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 115.252 -0.885 . . . . 5.78 111.557 -169.528 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 44.9 m -82.81 -38.11 23.56 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.365 0.666 . . . . 2.17 112.536 166.125 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 72.0 mt -69.09 -51.1 42.19 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.391 1.476 . . . . 1.92 109.91 -172.733 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -72.74 73.35 1.09 Allowed 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.108 -1.071 . . . . 2.27 108.108 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.6 m -52.58 -40.86 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 124.222 1.009 . . . . 2.72 112.512 -170.304 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -88.99 -2.79 58.75 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.317 0.488 . . . . 2.47 112.317 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 58.07 55.08 5.44 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.001 1.32 . . . . 3.98 110.958 170.562 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 53.0 p30 -108.48 -3.24 18.31 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.667 1.587 . . . . 2.21 112.378 -177.219 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.8 m 80.35 0.05 1.96 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.66 1.984 . . . . 2.2 113.511 -178.393 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -110.4 131.23 55.23 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 119.065 0.848 . . . . 3.05 109.023 168.627 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -87.9 90.83 8.53 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 105.898 -1.89 . . . . 1.59 105.898 161.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.94 148.78 7.22 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.568 1.076 . . . . 3.63 108.25 169.26 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -38.78 -49.53 1.62 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.026 1.284 . . . . 4.99 113.494 178.979 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -66.46 -34.9 78.97 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.986 0.736 . . . . 2.28 112.986 177.512 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.53 -55.31 18.48 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 119.272 0.942 . . . . 2.65 109.476 172.951 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' TYR . . . . . 0.412 ' CD1' HD22 ' A' ' 33' ' ' LEU . 30.9 t80 -45.86 -51.63 12.69 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 123.848 0.859 . . . . 3.13 109.664 175.645 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.68 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 2.1 t-105 -45.89 -33.56 3.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 117.41 -1.281 . . . . 4.34 112.275 178.967 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -40.64 -47.97 2.84 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 120.237 1.381 . . . . 6.03 110.471 171.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 28.0 tp -41.7 -50.34 4.23 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 124.528 1.131 . . . . 1.47 111.524 176.132 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 85.5 mt -62.51 -30.7 49.76 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 N-CA-C 108.888 -0.782 . . . . 1.79 108.888 -172.271 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.543 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -74.67 -44.97 24.19 Favored Glycine 0 CA--C 1.491 -1.435 0 N-CA-C 109.996 -1.242 . . . . 1.36 109.996 176.447 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -61.21 -31.03 70.8 Favored 'General case' 0 N--CA 1.436 -1.134 0 N-CA-C 107.752 -1.203 . . . . 2.1 107.752 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.6 mt -71.08 -56.86 5.24 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 119.266 0.939 . . . . 2.19 110.826 172.501 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.45 -24.75 47.63 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.963 0.905 . . . . 1.32 111.856 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -80.41 -61.01 2.11 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 126.709 2.004 . . . . 1.57 109.013 171.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -50.39 -40.92 51.13 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.978 1.311 . . . . 2.55 111.237 -176.347 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 10.0 tt -54.85 -34.57 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 O-C-N 120.671 -1.268 . . . . 1.37 112.345 177.071 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -93.07 -62.56 1.36 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.46 1.504 . . . . 4.86 108.588 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 57.3 tttp . . . . . 0 C--O 1.222 -0.377 0 C-N-CA 125.491 1.516 . . . . 4.06 108.422 168.079 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 49.3 mt . . . . . 0 CA--C 1.547 0.839 0 N-CA-C 114.338 1.236 . . . . 2.64 114.338 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 2.0 t -166.28 -111.02 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 120.944 1.702 . . . . 2.71 112.991 -166.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -125.28 -72.74 0.65 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.762 2.025 . . . . 2.35 110.434 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.9 mt -48.89 -49.51 39.42 Favored 'General case' 0 C--O 1.233 0.209 0 O-C-N 121.656 -0.653 . . . . 1.32 110.798 175.59 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -44.29 -52.74 7.3 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.185 0.994 . . . . 3.89 112.515 171.287 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -57.38 -36.81 71.72 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 119.235 0.925 . . . . 4.61 110.396 178.619 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 3.8 t -63.01 -50.14 71.9 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 122.947 0.499 . . . . 1.86 110.606 178.154 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.3 2.6 pp -61.44 -35.24 65.37 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 O-C-N 121.335 -0.853 . . . . 0.95 110.979 173.873 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -58.95 -57.78 11.57 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.874 -0.584 . . . . 3.11 110.145 174.182 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.8 t -52.49 -38.54 59.71 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.618 1.099 . . . . 1.31 111.685 -170.756 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 26.2 m -73.93 -39.82 51.96 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 O-C-N 121.414 -0.804 . . . . 0.95 111.492 175.499 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 38.4 t -57.73 -48.34 83.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 119.092 0.86 . . . . 1.1 111.015 173.339 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.1 t -64.38 -38.89 92.61 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.567 1.076 . . . . 1.32 110.856 177.141 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 85.8 m -58.16 -52.95 63.4 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 120.022 1.283 . . . . 1.23 109.666 174.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -47.26 -54.76 10.07 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.208 1.003 . . . . 3.71 110.279 173.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -55.2 -46.47 75.87 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.809 1.244 . . . . 3.91 111.329 -179.149 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 58.8 m -54.45 -44.27 72.36 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.403 0.681 . . . . 3.2 110.052 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -68.04 -47.3 68.76 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 120.457 -0.497 . . . . 3.09 110.959 171.357 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.45 -30.68 65.21 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.77 1.628 . . . . 1.21 111.467 -170.147 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 -19.32 64.79 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 118.153 -0.927 . . . . 3.78 112.665 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.456 ' HB3' ' HG3' ' B' ' 37' ' ' GLU . 2.3 tt0 -56.16 -68.13 0.24 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 117.902 -1.047 . . . . 3.75 111.562 -160.753 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -74.82 0.47 Allowed 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 114.433 1.272 . . . . 4.49 114.433 -162.847 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.77 160.16 27.37 Favored Glycine 0 N--CA 1.442 -0.924 0 C-N-CA 127.637 2.542 . . . . 1.89 109.906 156.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 36.56 104.95 0.0 OUTLIER 'General case' 0 C--O 1.237 0.42 0 N-CA-C 115.961 1.837 . . . . 5.26 115.961 140.556 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -69.01 46.13 0.06 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.866 1.266 . . . . 3.47 114.331 174.399 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -128.29 -58.2 1.2 Allowed 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 126.481 1.913 . . . . 3.53 106.341 168.726 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 2.1 p -94.15 146.49 23.95 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 125.209 1.403 . . . . 2.21 112.463 -166.101 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -102.95 154.27 19.39 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 126.094 1.757 . . . . 2.1 107.894 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 11.1 t -154.49 176.8 11.92 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 107.512 -1.292 . . . . 2.61 107.512 169.105 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 11.3 p -84.47 53.74 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-O 121.862 0.839 . . . . 2.73 111.188 -170.008 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.65 54.75 0.48 Allowed 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 105.895 -1.891 . . . . 2.5 105.895 149.153 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.456 ' HG3' ' HB3' ' B' ' 26' ' ' GLN . 1.8 tt0 -172.38 -52.61 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.292 1.837 . . . . 2.22 106.532 -170.794 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.46 ' CZ ' HD13 ' B' ' 63' ' ' LEU . 3.7 t80 -55.96 -57.82 10.47 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.564 -1.198 . . . . 2.03 109.771 173.375 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -56.22 -34.29 66.18 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.882 -0.599 . . . . 4.43 111.302 -175.478 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -54.31 -38.25 65.75 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.337 0.655 . . . . 3.45 110.765 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tt -67.15 -49.43 64.81 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.83 -0.804 . . . . 2.29 108.83 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 10.7 m -70.27 -35.08 61.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.295 -0.866 . . . . 0.93 110.155 -174.054 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 86.7 m -69.93 -50.79 38.58 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.018 0.927 . . . . 0.94 110.619 176.939 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -75.65 -61.52 1.89 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.565 0.746 . . . . 2.44 111.135 -169.696 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -80.79 -53.48 6.45 Favored 'General case' 0 C--O 1.227 -0.101 0 CA-C-O 121.343 0.592 . . . . 4.39 109.715 -175.384 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.61 -16.37 0.23 Allowed Pre-proline 0 CA--C 1.541 0.633 1 N-CA-C 121.857 4.021 . . . . 2.49 121.857 -144.985 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -48.96 -43.22 36.38 Favored 'Trans proline' 0 C--N 1.349 0.576 0 CA-C-N 123.473 2.276 . . . . 3.19 115.56 -149.387 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 65.4 t-80 -75.41 59.5 1.08 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.938 0.79 . . . . 2.62 110.669 173.432 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.566 HD23 ' HB2' ' B' ' 83' ' ' LEU . 10.3 tp -164.13 -91.57 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.209 1.404 . . . . 1.67 107.227 175.414 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 80.5 mt -78.79 86.98 4.68 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 120.968 -1.083 . . . . 2.08 109.126 171.113 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.33 169.51 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.386 -1.279 . . . . 6.42 111.566 153.041 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 88.78 5.12 0.19 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 127.446 2.299 . . . . 5.32 112.025 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 24.7 m -50.6 -34.09 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.96 0.904 . . . . 1.93 112.543 -175.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -49.83 -33.62 20.45 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.623 1.106 . . . . 3.25 112.992 175.657 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 8.3 t -130.71 57.15 1.74 Allowed 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.444 -0.947 . . . . 3.94 108.444 170.102 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -44.23 -39.18 4.25 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 124.645 1.178 . . . . 1.06 109.878 167.439 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -30.81 -47.68 0.1 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.331 2.653 . . . . 4.06 113.134 168.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -61.75 -52.47 64.08 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.073 0.464 . . . . 3.17 110.505 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.97 -47.97 81.37 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 107.963 -1.125 . . . . 3.6 107.963 177.618 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -50.15 -52.49 34.84 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 123.464 0.706 . . . . 1.72 110.295 179.023 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 17.8 ttmm -60.13 -44.13 95.15 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 122.305 -0.247 . . . . 2.94 110.911 178.717 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 16.1 m -63.22 -28.79 70.28 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.379 0.672 . . . . 2.29 112.394 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.46 HD13 ' CZ ' ' B' ' 38' ' ' PHE . 26.2 mt -80.04 -57.15 3.77 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.353 1.061 . . . . 1.16 110.231 178.686 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -58.34 -9.76 1.72 Allowed 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 126.96 2.104 . . . . 1.63 116.487 -166.315 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 65' ' ' VAL . . . . . 0.403 HG13 ' H ' ' B' ' 65' ' ' VAL . 27.7 m -34.06 -19.47 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 130.869 3.668 . . . . 1.59 119.705 -140.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 7.8 p-10 -61.61 -22.71 65.48 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 121.314 1.87 . . . . 3.12 111.397 162.076 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 61.25 62.18 1.42 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 125.979 1.712 . . . . 2.96 111.099 175.842 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 38.9 p30 -105.84 -15.94 14.79 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.662 1.585 . . . . 2.25 110.954 174.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 74.31 9.42 4.45 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.366 1.466 . . . . 2.6 111.968 -173.3 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -111.03 101.93 10.43 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 105.915 -1.883 . . . . 3.65 105.915 171.098 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -75.66 108.93 8.84 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 106.653 -1.61 . . . . 1.09 106.653 174.314 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -83.98 160.28 21.07 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.436 1.894 . . . . 4.17 109.356 -176.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -86.05 52.68 2.55 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.775 -0.578 . . . . 4.2 111.933 172.978 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -159.37 48.65 0.31 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.881 -1.155 . . . . 2.24 107.881 114.606 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -93.31 -61.72 1.51 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.685 1.594 . . . . 2.15 107.779 142.904 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -48.54 -46.05 38.28 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 125.816 1.646 . . . . 3.69 111.011 -175.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.68 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 50.1 t90 -49.79 -36.48 26.41 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 123.883 0.74 . . . . 3.56 112.455 -169.812 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -42.24 -40.1 2.3 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.969 0.908 . . . . 4.38 111.91 173.645 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 10.6 tp -53.59 -45.28 69.93 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.212 1.005 . . . . 0.83 111.888 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 59.2 mt -64.3 -31.26 52.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 N-CA-C 107.211 -1.403 . . . . 1.46 107.211 178.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.559 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -64.59 -48.29 74.56 Favored Glycine 0 CA--C 1.492 -1.398 0 C-N-CA 125.894 1.711 . . . . 1.33 112.079 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -66.59 -62.72 1.31 Allowed 'General case' 0 N--CA 1.425 -1.708 0 CA-C-O 117.294 -1.336 . . . . 2.39 107.648 177.026 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.566 ' HB2' HD23 ' B' ' 49' ' ' LEU . 3.4 pp -54.47 -35.29 62.9 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 120.48 1.491 . . . . 1.83 113.041 -175.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.69 -61.63 2.38 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.347 0.522 . . . . 1.64 110.435 170.394 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -65.96 -31.95 73.16 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 117.763 -1.113 . . . . 1.68 111.79 -171.151 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -42.73 -38.09 1.97 Allowed 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 128.335 2.654 . . . . 2.74 111.226 175.806 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 2.7 tt -50.56 -40.49 19.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 122.622 0.369 . . . . 1.31 110.216 177.099 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.4 -59.51 2.36 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.983 2.113 . . . . 5.2 112.738 166.804 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 14.1 tttt . . . . . 0 CA--C 1.535 0.39 0 C-N-CA 129.247 3.019 . . . . 6.82 111.672 -172.022 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 . . . . . 0 N--CA 1.45 -0.427 0 N-CA-C 110.701 -0.111 . . . . 5.36 110.701 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.24 103.62 1.43 Allowed 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.761 2.308 . . . . 2.52 109.128 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -61.41 152.82 28.67 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 108.124 -1.065 . . . . 1.3 108.124 169.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.4 t -71.25 173.51 7.64 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 119.867 -0.733 . . . . 1.77 109.564 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -65.45 -59.76 3.67 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 121.536 -0.728 . . . . 3.01 110.101 -171.937 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.6 mp -55.33 -42.26 73.55 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 121.628 -0.67 . . . . 1.47 110.188 -176.817 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -53.25 -54.35 37.5 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.733 2.013 . . . . 2.13 111.655 171.925 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.03 -49.94 70.31 Favored 'General case' 0 C--N 1.341 0.204 0 N-CA-C 108.877 -0.786 . . . . 5.4 108.877 178.927 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.1 m -65.6 -46.85 77.78 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 111.765 0.283 . . . . 1.99 111.765 -175.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 pp -65.51 -34.77 72.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 O-C-N 120.969 -1.082 . . . . 0.91 108.878 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -60.3 -55.0 38.99 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.864 0.757 . . . . 2.99 109.351 170.118 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -51.53 -40.1 58.99 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.857 0.863 . . . . 1.13 111.686 -174.48 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 m -74.8 -41.18 47.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 O-C-N 120.971 -1.081 . . . . 0.71 111.4 173.512 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 40.2 t -57.53 -48.24 83.45 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 119.588 1.085 . . . . 0.71 111.535 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -59.32 -43.1 92.73 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 119.666 1.121 . . . . 0.63 110.455 178.126 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 60.1 m -59.22 -54.71 43.78 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.179 0.514 . . . . 0.73 109.78 176.886 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.421 ' CE2' HD23 ' A' ' 33' ' ' LEU . 2.2 t80 -44.15 -52.15 7.53 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.994 1.318 . . . . 3.07 110.676 171.144 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 26.9 t80 -66.2 -49.35 67.6 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.908 1.283 . . . . 2.79 110.691 -171.486 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 t -62.91 -36.95 85.07 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 110.093 -0.336 . . . . 2.1 110.093 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -64.52 -48.17 76.11 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 118.539 0.608 . . . . 2.61 111.236 169.112 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -52.76 -35.37 56.25 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 125.235 1.414 . . . . 0.84 110.998 -171.695 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -59.16 -34.29 71.93 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 126.427 1.891 . . . . 5.53 112.818 177.602 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -46.17 -61.63 1.69 Allowed 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.451 1.023 . . . . 2.34 112.738 -167.054 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -104.92 114.02 27.97 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 128.524 2.73 . . . . 2.92 106.375 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 40.17 99.99 0.01 OUTLIER Glycine 0 CA--C 1.533 1.204 0 C-N-CA 126.36 1.933 . . . . 1.76 116.432 162.232 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 72.93 106.47 0.07 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.554 0.742 . . . . 4.87 112.899 168.744 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.0 pttt -66.59 18.78 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 115.913 1.82 . . . . 4.54 115.913 178.865 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.3 p-10 -89.16 -34.32 16.74 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.816 1.246 . . . . 4.26 109.53 162.039 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.7 p -83.86 128.6 34.65 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.471 1.109 . . . . 3.2 110.834 -171.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.421 HD23 ' CE2' ' A' ' 20' ' ' PHE . 2.7 mm? -86.09 123.6 31.58 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 107.338 -1.356 . . . . 1.98 107.338 151.402 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.1 m -109.53 176.05 5.22 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 126.318 1.847 . . . . 3.71 109.074 -171.935 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 71.4 t -63.69 -49.65 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 O-C-N 121.814 -0.554 . . . . 2.69 111.519 -167.059 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -70.12 -48.89 55.65 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.272 -1.01 . . . . 2.28 108.272 -176.612 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -42.67 -53.54 4.44 Favored 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 124.672 1.189 . . . . 1.81 112.343 173.682 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.01 -56.05 14.41 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.184 -0.673 . . . . 2.45 109.184 176.892 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 30.4 ttmt -58.61 -39.1 79.49 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 120.283 -0.567 . . . . 2.78 111.766 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -54.55 -38.85 67.11 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.615 0.643 . . . . 3.2 111.755 176.302 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -61.07 -54.03 49.77 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 107.582 -1.266 . . . . 2.48 107.582 -177.173 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 16.4 m -68.98 -40.88 81.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 114.581 -1.19 . . . . 1.14 109.852 -170.245 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 98.1 m -59.99 -51.91 67.65 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 124.197 0.999 . . . . 1.9 110.61 174.811 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -74.16 -57.18 4.13 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.425 0.29 . . . . 3.23 110.976 -170.375 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -136.43 68.11 1.44 Allowed 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.669 0.387 . . . . 4.07 111.907 -177.001 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.3 tp -155.9 56.32 1.28 Allowed Pre-proline 0 CA--C 1.54 0.562 0 O-C-N 121.538 -0.727 . . . . 1.8 111.062 161.217 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -63.34 -61.12 0.14 Allowed 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 123.835 3.023 . . . . 1.85 112.715 -170.526 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -84.64 -51.62 6.71 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 119.351 0.978 . . . . 3.91 110.38 -172.261 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -31.9 -62.3 0.21 Allowed 'General case' 0 C--O 1.234 0.28 0 C-N-CA 126.402 1.881 . . . . 1.54 113.506 -172.469 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.5 mt -125.59 54.5 1.48 Allowed 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.047 1.339 . . . . 2.06 108.399 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.75 3.6 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 116.913 2.19 . . . . 5.14 116.913 -175.145 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -109.04 46.3 0.99 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.543 1.537 . . . . 4.8 107.331 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.9 m -55.85 -17.52 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 C-N-CA 125.766 1.627 . . . . 2.07 112.567 -176.361 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -44.43 -44.91 8.22 Favored Glycine 0 CA--C 1.532 1.135 0 N-CA-C 110.912 -0.875 . . . . 1.43 110.912 167.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.7 t -91.84 31.55 1.22 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 117.213 0.507 . . . . 2.25 112.088 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.402 HD13 ' C ' ' A' ' 56' ' ' LEU . 3.0 tm? -52.61 -43.75 65.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 121.419 -0.801 . . . . 1.34 109.21 168.118 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -39.9 -57.35 1.61 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.982 1.313 . . . . 3.55 111.565 170.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.2 tp10 -60.12 -51.33 70.05 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 116.485 -0.325 . . . . 5.26 110.253 -178.103 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.92 -39.88 75.28 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 118.92 -1.112 . . . . 6.36 110.628 -179.259 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -57.3 -57.4 12.81 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 122.848 0.459 . . . . 1.51 110.673 176.277 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.13 -33.48 74.56 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 120.394 -0.522 . . . . 4.0 111.218 -176.502 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.3 t -59.45 -50.93 72.03 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.289 1.436 . . . . 1.79 110.997 172.102 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.8 mp -63.76 -50.09 70.4 Favored 'General case' 0 C--O 1.239 0.547 0 O-C-N 121.385 -0.822 . . . . 1.75 111.562 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -80.07 71.5 6.8 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 121.0 -0.28 . . . . 1.72 110.478 -167.369 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.8 m -49.53 -40.36 14.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.644 1.177 . . . . 2.06 113.525 -174.274 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -82.5 -8.64 59.61 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 123.519 0.728 . . . . 1.9 112.504 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 55.92 50.39 14.03 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.766 1.626 . . . . 3.42 110.426 168.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.5 p30 -100.49 -12.46 19.3 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.766 1.626 . . . . 2.01 110.96 179.217 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 20.7 m 72.43 17.41 4.76 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 125.893 1.677 . . . . 1.57 111.864 -179.05 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -116.06 113.26 22.94 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 106.11 -1.811 . . . . 3.96 106.11 163.792 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.82 89.07 7.12 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 104.543 -2.391 . . . . 1.05 104.543 173.38 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.9 tttp -75.87 158.04 32.58 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.921 -0.77 . . . . 4.83 108.921 -176.15 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -38.63 -61.07 0.75 Allowed 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.099 1.148 . . . . 4.76 114.099 -163.551 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -69.23 -26.55 64.85 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.684 -0.635 . . . . 2.26 112.209 -177.156 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -68.52 -59.69 2.97 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.639 -0.874 . . . . 2.07 108.639 171.602 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -56.37 -38.84 71.99 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 118.786 -0.626 . . . . 3.28 111.057 -175.855 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.495 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 0.1 OUTLIER -38.19 -45.19 0.92 Allowed 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 116.609 -1.662 . . . . 5.56 107.85 174.75 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 48.3 mtm-85 -38.55 -44.96 1.01 Allowed 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.85 1.659 . . . . 5.9 112.529 -179.036 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 23.5 tp -52.05 -56.97 11.01 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 120.593 1.542 . . . . 0.99 111.75 174.344 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 19.1 mm -59.44 -38.97 77.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 C-N-CA 126.403 1.881 . . . . 1.87 108.245 -179.172 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.58 -56.88 11.7 Favored Glycine 0 N--CA 1.437 -1.245 0 N-CA-C 108.497 -1.841 . . . . 1.93 108.497 172.394 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -63.51 -49.67 72.62 Favored 'General case' 0 N--CA 1.438 -1.056 0 C-N-CA 125.804 1.642 . . . . 2.65 108.617 -171.906 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 21.5 mt -42.34 -53.53 4.14 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 119.451 1.023 . . . . 2.0 112.12 -173.061 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.32 -35.18 62.4 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.97 1.308 . . . . 1.29 112.665 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.4 ttpp -77.7 -51.25 10.88 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.461 -0.774 . . . . 1.79 110.233 172.958 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.6 mm-40 -60.99 -30.74 70.46 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.059 0.943 . . . . 4.17 112.243 -171.563 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 5.2 tt -56.61 -40.21 67.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 119.046 0.839 . . . . 1.29 110.736 170.473 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.92 -55.52 5.69 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.422 -0.955 . . . . 4.98 108.422 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 3.8 tttm . . . . . 0 N--CA 1.441 -0.904 0 C-N-CA 126.617 1.967 . . . . 3.59 109.897 -170.74 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 53.2 mt . . . . . 0 CA--C 1.536 0.442 0 N-CA-C 110.474 -0.195 . . . . 2.71 110.474 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 14.0 t -94.39 -167.98 1.76 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 124.642 1.177 . . . . 1.82 108.971 164.389 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -71.83 -63.74 1.07 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.598 0.759 . . . . 2.53 112.765 -169.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 28.0 mt -50.77 -51.32 51.49 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 120.62 1.554 . . . . 1.16 111.26 173.481 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -51.98 -41.37 62.08 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.897 2.479 . . . . 3.39 110.416 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -64.73 -58.57 5.9 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.203 1.401 . . . . 4.35 110.437 171.162 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 86.0 p -53.89 -36.07 62.28 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.409 -0.807 . . . . 1.35 112.292 -172.447 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.9 -32.95 46.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 O-C-N 121.952 -0.467 . . . . 1.07 112.185 174.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.97 -54.11 43.52 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 119.261 0.937 . . . . 3.63 109.047 170.503 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.2 m -38.75 -51.69 1.7 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.498 1.119 . . . . 2.31 111.663 -178.64 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 34.2 m -70.57 -39.46 76.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 121.098 -1.002 . . . . 0.86 111.99 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 55.6 t -57.1 -54.11 34.52 Favored 'Isoleucine or valine' 0 C--N 1.339 0.114 0 CA-C-N 118.655 0.661 . . . . 1.16 109.859 174.842 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -59.24 -46.42 88.53 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.47 0.577 . . . . 1.09 110.798 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 96.7 m -55.26 -51.52 66.37 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.014 -1.054 . . . . 1.17 110.627 174.784 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -51.47 -47.2 63.25 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.67 -0.644 . . . . 6.89 111.442 173.795 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -57.68 -48.36 79.76 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.586 1.154 . . . . 2.61 111.227 -179.235 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 81.4 p -57.27 -37.44 72.37 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.767 -0.583 . . . . 2.09 111.143 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -72.44 -40.67 66.89 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 118.145 0.43 . . . . 3.18 110.568 173.026 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -51.73 -37.56 51.54 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 125.868 1.667 . . . . 1.09 110.025 -176.43 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -55.18 -29.72 58.44 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 118.081 -0.962 . . . . 4.03 112.088 -178.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.431 ' HB2' ' HG2' ' B' ' 37' ' ' GLU . 0.0 OUTLIER -51.73 -65.61 0.53 Allowed 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 114.786 1.402 . . . . 1.86 114.786 -151.921 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -91.02 -77.35 0.42 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 119.082 -1.047 . . . . 3.98 113.521 -166.024 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.71 159.27 24.68 Favored Glycine 0 C--N 1.337 0.593 0 C-N-CA 127.279 2.371 . . . . 1.89 109.86 153.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 80.4 mtt-85 49.51 102.91 0.01 OUTLIER 'General case' 0 C--O 1.242 0.706 0 N-CA-C 115.127 1.529 . . . . 3.76 115.127 142.043 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -67.99 32.62 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.775 2.03 . . . . 3.16 114.473 173.444 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -144.41 -58.47 0.37 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 106.911 -1.515 . . . . 4.12 106.911 -164.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 32.4 p -79.18 111.68 15.64 Favored 'General case' 0 N--CA 1.438 -1.042 0 N-CA-C 107.345 -1.354 . . . . 2.02 107.345 168.6 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -57.55 135.16 56.62 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 106.993 -1.484 . . . . 1.96 106.993 162.061 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 13.0 m -109.65 152.36 25.68 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.84 1.256 . . . . 3.47 108.952 -174.21 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 10.4 p -87.6 49.15 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 O-C-N 120.254 -1.529 . . . . 2.4 110.83 -179.084 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -157.75 52.71 0.46 Allowed 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 106.08 -1.822 . . . . 2.18 106.08 138.639 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.431 ' HG2' ' HB2' ' B' ' 26' ' ' GLN . 70.2 mt-10 -131.74 -49.32 0.96 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 130.963 3.705 . . . . 1.73 105.233 161.958 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -50.28 -57.16 8.47 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 120.506 -0.478 . . . . 2.91 110.09 171.587 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . 0.292 15.7 ttmt -59.73 -41.81 91.75 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-O 117.94 -1.029 . . . . 2.73 111.522 -178.413 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -50.5 -48.71 56.81 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 119.461 1.028 . . . . 3.26 110.267 173.365 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.97 -46.58 77.55 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.507 -0.923 . . . . 1.73 108.507 -169.997 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.0 m -68.93 -44.41 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 C-N-CA 120.728 -0.389 . . . . 0.78 110.294 -176.637 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 86.1 m -58.63 -50.27 74.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.567 0.747 . . . . 1.26 110.466 178.047 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -80.14 -59.65 2.63 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 123.585 0.754 . . . . 2.01 110.981 -169.286 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -75.54 -50.58 15.22 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 113.143 0.794 . . . . 3.23 113.143 -169.056 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.08 -27.91 3.57 Favored Pre-proline 0 CA--C 1.539 0.523 0 N-CA-C 115.248 1.574 . . . . 1.79 115.248 -151.266 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -63.56 -12.1 29.4 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 121.824 -2.157 . . . . 2.39 111.046 -68.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 35.2 t60 -113.64 -32.44 6.17 Favored 'General case' 0 C--N 1.344 0.347 0 C-N-CA 125.736 1.614 . . . . 2.57 111.373 -174.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 23.3 tp -50.77 -51.99 45.09 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.399 0.545 . . . . 1.37 110.22 -175.298 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 98.1 mt -99.89 140.77 33.62 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 105.694 -1.965 . . . . 2.1 105.694 153.943 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.0 28.29 2.13 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 126.756 2.022 . . . . 4.98 108.273 -167.192 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -142.47 32.22 1.48 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 125.858 1.663 . . . . 6.1 108.562 -156.646 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 11.4 m -74.7 -10.58 13.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 C-N-CA 125.599 1.56 . . . . 1.7 112.711 -173.759 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.91 -65.32 3.48 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 107.165 -2.374 . . . . 2.45 107.165 162.279 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 2.4 p -72.01 40.01 0.07 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.016 2.126 . . . . 3.69 112.724 175.986 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -64.26 -30.01 71.08 Favored 'General case' 0 N--CA 1.441 -0.887 0 O-C-N 120.986 -1.071 . . . . 1.23 108.205 165.876 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.1 -52.78 32.04 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.942 -0.551 . . . . 4.5 110.302 173.823 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -47.17 -59.5 3.11 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 124.023 0.929 . . . . 3.3 109.351 175.376 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 7.6 mmpt? -60.75 -51.38 69.57 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.047 -0.524 . . . . 4.69 109.752 -172.234 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.5 ttp -56.0 -47.05 78.46 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 123.259 0.624 . . . . 2.08 110.419 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -60.62 -40.8 93.2 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.738 1.215 . . . . 4.13 110.355 179.257 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 20.0 m -71.43 -31.21 66.95 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.868 0.867 . . . . 1.48 112.269 175.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 22.2 mt -73.04 -55.33 6.67 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.988 0.915 . . . . 1.52 109.54 179.032 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 64' ' ' ASP . . . . . 0.411 ' O ' ' N ' ' B' ' 66' ' ' ASN . 23.8 t70 -71.04 -10.45 59.77 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.628 2.371 . . . . 1.55 116.892 -161.162 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 24.7 m -33.26 -17.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 131.626 3.971 . . . . 1.69 119.36 -142.222 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 66' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' B' ' 64' ' ' ASP . 2.3 m120 -40.63 -43.69 1.97 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.831 1.196 . . . . 2.27 110.559 151.366 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 65.53 61.16 0.7 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.324 1.45 . . . . 2.86 109.677 -170.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 18.0 p30 -119.63 -16.45 8.83 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.059 2.144 . . . . 2.27 113.0 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 8.2 t 74.44 5.24 4.55 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.384 1.874 . . . . 3.4 114.47 -178.7 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -106.21 109.72 21.74 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 124.991 1.316 . . . . 3.52 107.791 166.54 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -90.63 89.36 7.5 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.681 0.792 . . . . 1.27 108.918 -179.015 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 3.3 ttpp -84.79 177.48 7.99 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 128.082 2.553 . . . . 3.53 112.08 -171.552 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -82.03 53.42 2.21 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.493 -1.38 . . . . 4.48 113.869 -168.314 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -168.19 51.62 0.05 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 124.841 2.258 . . . . 2.6 106.12 122.624 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -95.6 -63.25 1.18 Allowed 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 126.93 2.092 . . . . 2.07 108.815 150.576 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -68.8 -26.34 65.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.308 -1.315 . . . . 6.51 112.824 -165.409 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.504 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 0.0 OUTLIER -45.13 -50.1 11.46 Favored 'General case' 0 C--N 1.347 0.472 0 N-CA-C 107.58 -1.267 . . . . 4.78 107.58 170.7 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 75.5 mtm-85 -48.12 -36.41 13.27 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-O 117.203 -1.379 . . . . 6.02 113.402 -165.054 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 5.4 tp -53.63 -51.42 63.16 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 120.923 1.692 . . . . 0.99 111.299 174.733 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 24.5 mt -63.74 -40.18 88.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 126.045 1.738 . . . . 1.42 107.587 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -45.27 -54.79 7.04 Favored Glycine 0 N--CA 1.443 -0.85 0 N-CA-C 108.891 -1.683 . . . . 1.94 108.891 171.51 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 82' ' ' GLU . . . . . 0.411 ' OE2' ' NZ ' ' B' ' 85' ' ' LYS . 1.1 mm-40 -68.0 -53.71 23.97 Favored 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 125.964 1.706 . . . . 2.18 109.004 -172.812 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 18.3 mt -40.31 -49.18 2.74 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.18 1.392 . . . . 2.24 111.401 -177.104 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -47.1 -45.17 21.89 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.489 0.716 . . . . 1.66 111.687 177.241 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 85' ' ' LYS . . . . . 0.411 ' NZ ' ' OE2' ' B' ' 82' ' ' GLU . 0.7 OUTLIER -81.06 -37.98 28.14 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.651 0.612 . . . . 1.39 112.651 172.324 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -65.68 -21.14 66.52 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.388 0.994 . . . . 3.3 112.508 -172.388 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 1.9 tp -45.33 -45.31 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 O-C-N 120.92 -1.113 . . . . 1.28 109.217 165.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.4 -54.29 5.59 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.191 0.996 . . . . 6.01 111.035 174.609 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 68.1 mttt . . . . . 0 C--O 1.219 -0.509 0 C-N-CA 125.454 1.502 . . . . 4.73 112.072 -171.563 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 . . . . . 0 CA--C 1.538 0.489 0 N-CA-C 108.747 -0.834 . . . . 4.35 108.747 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.77 105.48 2.09 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.407 2.071 . . . . 3.03 110.0 -173.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.72 160.71 26.14 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 108.206 -1.035 . . . . 2.82 108.206 168.427 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.456 HG23 ' H ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -64.15 154.99 32.99 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 121.056 -1.027 . . . . 2.87 110.388 -174.812 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -33.47 -48.29 0.25 Allowed 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 125.287 1.435 . . . . 2.11 112.297 160.666 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.2 mt -67.15 -45.01 78.35 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 118.257 -0.878 . . . . 1.27 110.223 -175.068 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.456 ' H ' HG23 ' A' ' 7' ' ' THR . 63.6 mt-10 -58.12 -53.35 59.24 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.519 1.527 . . . . 2.46 111.013 172.486 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -47.29 -60.35 2.55 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.366 1.066 . . . . 3.36 109.017 176.334 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.4 p -60.67 -49.12 78.79 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.732 0.642 . . . . 1.4 112.732 -177.347 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.254 2.4 pp -62.38 -38.79 82.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 O-C-N 120.854 -1.154 . . . . 0.59 109.99 -177.074 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -62.32 -48.79 78.28 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 119.736 -0.785 . . . . 3.36 110.699 173.226 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -55.98 -40.66 73.63 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.755 0.788 . . . . 1.22 111.652 -176.953 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.8 m -75.2 -36.94 38.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 O-C-N 120.573 -1.329 . . . . 0.78 111.088 176.417 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.4 t -56.42 -46.69 82.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 119.592 1.087 . . . . 0.61 110.648 174.233 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.3 t -64.76 -43.08 94.47 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.565 -0.709 . . . . 0.79 110.877 178.435 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.8 m -57.55 -51.99 67.25 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.487 0.585 . . . . 0.93 110.068 176.88 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -45.74 -56.6 5.1 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 124.052 0.941 . . . . 3.19 109.883 170.456 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -53.14 -51.61 61.4 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 123.441 0.696 . . . . 3.51 111.543 -175.042 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.9 t -60.38 -36.72 78.72 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 120.1 -0.64 . . . . 2.4 111.571 -178.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -69.92 -39.91 75.86 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 119.901 1.228 . . . . 2.5 111.096 171.22 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.02 -31.7 71.32 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 121.072 -1.017 . . . . 1.14 111.525 -168.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -80.02 -18.33 50.49 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 117.494 -1.241 . . . . 4.12 113.537 -178.6 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -45.24 -60.97 1.84 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.848 1.204 . . . . 1.69 113.787 -170.732 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -111.42 92.09 3.91 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 127.408 2.283 . . . . 2.93 106.116 -177.848 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 46.14 -168.21 0.05 OUTLIER Glycine 0 CA--C 1.527 0.821 0 C-N-CA 125.697 1.618 . . . . 1.59 112.693 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 48.7 mtm-85 27.65 91.79 0.01 OUTLIER 'General case' 0 C--O 1.24 0.574 0 C-N-CA 126.456 1.902 . . . . 6.16 112.525 166.282 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -79.6 53.28 1.55 Allowed 'General case' 0 C--O 1.232 0.142 0 C-N-CA 128.483 2.713 . . . . 4.48 108.662 -172.683 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -175.51 -60.79 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 106.945 -1.502 . . . . 4.02 106.945 -156.404 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.2 p -84.52 134.12 34.44 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-O 122.34 1.066 . . . . 2.15 112.141 170.671 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 71' ' ' LEU . 1.5 mm? -95.55 124.59 39.65 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.857 1.263 . . . . 2.47 108.506 176.803 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.6 t -82.61 173.83 11.59 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.355 1.462 . . . . 2.33 109.058 173.252 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 32.9 m -70.21 -42.86 79.07 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 O-C-N 122.014 -0.429 . . . . 2.93 110.82 -175.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -67.45 -49.05 65.37 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 118.272 -0.871 . . . . 1.82 109.643 176.224 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -39.77 -50.64 2.37 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.119 1.367 . . . . 2.22 110.307 168.506 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -57.67 -59.11 5.69 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.861 -0.609 . . . . 2.67 110.95 175.21 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -52.09 -42.17 63.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.522 -0.308 . . . . 3.49 111.18 -176.095 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -51.89 -42.37 62.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 123.256 0.622 . . . . 3.17 111.459 177.941 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -63.08 -50.14 71.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 119.303 0.956 . . . . 2.95 108.788 -176.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.2 m -72.48 -32.24 41.08 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.168 0 CA-C-N 115.804 -0.635 . . . . 1.34 110.3 -172.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 92.7 m -75.42 -38.71 59.67 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.169 0.987 . . . . 1.41 110.735 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -79.86 -55.67 4.81 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.285 0.634 . . . . 2.18 110.239 -173.127 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -92.47 -126.74 0.09 Allowed 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.446 -0.946 . . . . 4.33 108.446 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.447 HD22 ' H ' ' A' ' 46' ' ' LEU . 2.9 mm? 29.5 63.46 0.82 Allowed Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 127.578 2.351 . . . . 2.5 114.499 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -71.58 -44.59 1.0 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.602 2.202 . . . . 1.74 112.298 -179.274 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -146.05 61.36 1.25 Allowed 'General case' 0 C--N 1.341 0.233 0 CA-C-N 118.907 0.776 . . . . 3.37 109.956 -172.856 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.497 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 3.8 tp -144.33 -113.67 0.1 Allowed 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 107.726 -1.213 . . . . 1.36 107.726 -176.483 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 76.9 mt -59.0 162.12 4.49 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.776 0.716 . . . . 2.22 109.186 162.056 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.38 -159.13 0.56 Allowed 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.889 0.875 . . . . 6.42 109.211 -166.018 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 55.07 37.15 28.45 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.828 1.251 . . . . 3.77 108.866 -175.178 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.43 -24.42 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 C-N-CA 126.124 1.77 . . . . 3.12 112.505 -167.679 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.93 -53.72 40.79 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 110.298 -1.121 . . . . 1.77 110.298 171.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 34.0 t -84.17 46.63 1.22 Allowed 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.554 0.742 . . . . 2.29 110.098 -174.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -53.68 -32.54 52.12 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.07 0.948 . . . . 1.44 110.116 -176.494 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -38.04 -47.72 1.13 Allowed 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 127.321 2.248 . . . . 3.71 113.158 175.329 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -64.21 -46.24 84.72 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.861 -0.524 . . . . 4.02 109.992 -175.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.29 -52.66 63.78 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.037 -1.097 . . . . 3.47 108.037 175.417 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -46.52 -56.72 5.57 Favored 'General case' 0 C--O 1.225 -0.196 0 C-N-CA 123.406 0.683 . . . . 1.83 111.061 177.759 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -66.19 -37.57 85.92 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.103 0.411 . . . . 3.35 111.329 -176.017 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.7 t -58.64 -45.17 89.86 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.982 -0.449 . . . . 1.97 110.602 173.711 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 19.2 mt -70.2 -58.93 3.23 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.726 0.81 . . . . 1.58 110.417 -176.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -78.61 75.64 5.12 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 124.074 0.949 . . . . 1.88 109.057 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.5 m -51.32 -28.16 7.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 123.417 0.687 . . . . 2.31 112.184 176.606 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -70.08 -33.6 72.1 Favored 'General case' 0 CA--C 1.529 0.156 0 O-C-N 121.989 -0.444 . . . . 3.11 110.91 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 53.15 53.67 11.54 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.739 1.215 . . . . 4.04 109.29 -161.149 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -102.35 -13.18 17.42 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.429 1.891 . . . . 1.86 111.525 176.1 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.9 m 66.17 17.57 10.77 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.073 1.349 . . . . 1.96 112.837 -177.0 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -111.56 112.12 23.62 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.751 -1.574 . . . . 3.12 106.751 158.351 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 33' ' ' LEU . 2.6 mm? -82.97 93.7 7.6 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 104.256 -2.498 . . . . 1.17 104.256 166.227 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.14 161.96 25.81 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.346 -0.983 . . . . 3.18 108.346 176.383 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.63 -60.54 0.95 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.57 1.148 . . . . 5.59 112.955 -169.073 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -69.15 -22.3 63.95 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.666 0.786 . . . . 1.92 111.68 -175.242 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -72.69 -56.67 4.95 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 118.448 0.567 . . . . 2.4 109.597 173.017 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -52.72 -48.77 66.44 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.301 -0.629 . . . . 2.7 109.301 178.097 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.669 ' HZ2' HG23 ' B' ' 80' ' ' ILE . 58.8 t-105 -46.66 -35.87 6.45 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.693 -1.139 . . . . 5.18 111.257 -179.02 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 77.9 mtt-85 -41.47 -45.86 3.31 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 120.182 1.356 . . . . 4.62 111.568 176.308 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 7.9 tp -49.94 -40.8 44.76 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 122.764 0.426 . . . . 0.93 110.408 -177.586 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.487 HG21 ' HZ3' ' A' ' 77' ' ' TRP . 25.7 mt -74.79 -26.14 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 N-CA-C 109.09 -0.707 . . . . 1.32 109.09 -174.915 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.434 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -56.37 -43.69 89.89 Favored Glycine 0 CA--C 1.501 -0.786 0 N-CA-C 109.83 -1.308 . . . . 1.17 109.83 164.453 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.411 ' OE2' ' NZ ' ' A' ' 85' ' ' LYS . 24.8 mm-40 -80.6 -30.77 36.83 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 117.687 -1.149 . . . . 3.11 110.546 -178.201 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.497 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 8.6 mp -54.38 -59.86 4.12 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 122.189 2.268 . . . . 2.42 108.391 167.756 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.58 -53.66 51.65 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.978 0.894 . . . . 1.35 110.6 -178.766 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 89' ' ' LYS . 4.6 ttpp -63.36 -40.71 98.02 Favored 'General case' 0 C--O 1.211 -0.954 0 CA-C-O 116.683 -1.627 . . . . 1.68 110.746 -178.261 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -51.09 -51.15 56.19 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 122.233 2.288 . . . . 3.23 108.834 178.091 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.8 mt -52.57 -47.39 48.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 N-CA-C 111.417 0.154 . . . . 2.01 111.417 171.529 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . 2.144 41.6 mtt85 -38.98 -58.38 1.12 Allowed 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 115.462 1.653 . . . . 7.6 115.462 161.393 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 75.3 tttt . . . . . 0 N--CA 1.467 0.412 0 C-N-CA 127.374 2.27 . . . . 4.23 113.737 -127.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.538 0.482 0 CA-C-O 118.595 -0.717 . . . . 5.04 109.398 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.427 HG22 ' CD ' ' B' ' 10' ' ' GLU . 13.4 t -82.49 -165.45 1.04 Allowed 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 119.306 0.957 . . . . 1.72 111.016 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -72.62 -60.76 2.08 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 123.633 0.773 . . . . 2.13 111.41 -167.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 10.6 mt -56.68 -37.74 71.27 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 120.492 -1.38 . . . . 1.05 110.617 177.028 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 10' ' ' GLU . . . . . 0.427 ' CD ' HG22 ' B' ' 7' ' ' THR . 89.1 mt-10 -59.5 -43.48 93.34 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.757 0.823 . . . . 2.94 111.848 174.325 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.01 -46.06 86.2 Favored 'General case' 0 C--N 1.339 0.146 0 O-C-N 120.79 -1.194 . . . . 5.11 108.917 177.531 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -59.03 -46.29 88.58 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.742 -0.663 . . . . 1.72 110.816 -176.877 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.2 pp -66.98 -40.49 85.74 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 O-C-N 121.529 -0.732 . . . . 0.79 110.997 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.51 -55.14 37.07 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.179 0.899 . . . . 3.2 110.541 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.8 t -52.84 -36.56 58.99 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.103 0.865 . . . . 1.15 111.593 -173.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 24.3 m -78.01 -38.29 24.1 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 O-C-N 121.237 -0.914 . . . . 0.78 111.746 175.046 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 26.0 t -56.5 -51.0 70.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 119.395 0.998 . . . . 0.82 110.466 173.333 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 15.3 t -61.36 -40.09 93.02 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.421 1.009 . . . . 1.07 110.85 178.918 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 68.1 m -57.23 -54.63 44.65 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.421 -0.799 . . . . 0.87 110.278 173.491 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -45.53 -53.3 9.16 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 123.814 0.846 . . . . 4.01 109.654 172.663 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -58.73 -52.33 66.14 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.194 1.398 . . . . 2.55 110.721 -174.485 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 4.6 t -66.41 -26.57 67.3 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.995 -0.526 . . . . 2.63 111.684 -177.476 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -80.15 -36.95 34.43 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 120.033 1.288 . . . . 2.76 111.422 168.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.32 -32.17 72.89 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 120.833 -1.167 . . . . 1.18 109.927 -173.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -19.54 65.27 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 117.421 -1.276 . . . . 4.32 113.44 178.936 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.455 ' HB3' ' HG3' ' B' ' 37' ' ' GLU . 0.8 OUTLIER -51.1 -64.7 0.73 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 115.168 1.544 . . . . 1.69 115.168 -158.909 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -91.27 -77.37 0.42 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 119.757 -0.777 . . . . 2.83 112.581 -169.902 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.99 156.92 23.15 Favored Glycine 0 C--N 1.338 0.652 0 C-N-CA 127.77 2.605 . . . . 2.04 110.368 158.146 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 48.3 101.32 0.01 OUTLIER 'General case' 0 C--O 1.244 0.81 0 N-CA-C 115.772 1.767 . . . . 3.71 115.772 142.131 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 7.1 pttt -67.73 55.44 0.06 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 128.113 2.565 . . . . 3.55 112.121 172.952 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -155.86 -49.05 0.08 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 126.465 1.906 . . . . 3.51 107.156 -157.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 49.0 p -99.75 149.22 23.56 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 125.524 1.53 . . . . 2.22 111.203 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -93.08 117.68 30.34 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 107.168 -1.419 . . . . 2.26 107.168 139.067 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 4.6 t -83.2 -170.65 3.15 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 126.054 1.741 . . . . 2.52 108.648 161.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.454 ' C ' ' H ' ' B' ' 37' ' ' GLU . 0.1 OUTLIER -64.83 -103.83 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.362 0 C-N-CA 130.252 3.421 . . . . 3.16 102.475 -166.798 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -75.5 55.96 0.85 Allowed 'General case' 0 CA--C 1.551 0.995 0 O-C-N 118.918 -2.364 . . . . 2.76 111.45 -178.206 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.455 ' HG3' ' HB3' ' B' ' 26' ' ' GLN . 2.3 tt0 -116.43 -56.89 2.25 Favored 'General case' 0 N--CA 1.448 -0.561 1 C-N-CA 132.68 4.392 . . . . 2.0 103.716 158.404 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.58 -48.58 66.13 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.757 0.823 . . . . 2.45 109.221 173.762 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -51.18 -42.53 60.91 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 120.635 -0.426 . . . . 3.72 111.118 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -59.26 -37.87 78.68 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 118.111 0.414 . . . . 2.91 111.778 177.463 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 tt -68.76 -48.96 62.38 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.939 0.79 . . . . 1.98 109.639 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 2.4 m -66.57 -39.5 84.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 120.877 0.37 . . . . 0.72 110.039 -175.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 97.0 m -63.43 -56.5 15.71 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.455 0.702 . . . . 0.89 110.727 174.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -80.36 -57.4 3.62 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.749 0.419 . . . . 1.78 111.617 -164.794 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -79.46 -46.78 16.82 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 111.826 0.306 . . . . 3.1 111.826 -164.178 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 46' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' B' ' 46' ' ' LEU . 4.5 mm? -59.25 -37.55 53.48 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 113.505 0.928 . . . . 2.21 113.505 -166.102 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -60.11 -33.82 94.89 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 121.706 -2.206 . . . . 1.99 110.083 -62.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -84.64 -46.41 11.53 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.254 1.021 . . . . 3.52 112.871 -164.523 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.412 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 3.5 tp -42.02 -59.15 1.83 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.085 1.354 . . . . 1.23 111.428 -176.99 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 29.7 mt -79.74 66.09 5.1 Favored 'General case' 0 C--N 1.34 0.165 0 CA-C-O 122.111 0.958 . . . . 1.76 110.867 172.108 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -30.32 137.05 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 125.647 1.579 . . . . 5.69 112.257 152.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 27.1 t0 56.2 71.25 0.57 Allowed 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.924 1.689 . . . . 3.52 110.121 -167.262 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 24.8 m -72.4 -1.37 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-N 112.262 -2.245 . . . . 1.57 111.462 159.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -80.7 -56.65 3.07 Favored Glycine 0 C--N 1.342 0.898 0 N-CA-C 109.389 -1.485 . . . . 2.35 109.389 -174.171 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.29 52.04 0.73 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 122.362 1.077 . . . . 2.4 110.618 179.348 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -61.3 -40.18 93.22 Favored 'General case' 0 N--CA 1.439 -0.992 0 O-C-N 120.891 -1.13 . . . . 1.38 108.933 179.251 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -54.09 -53.17 56.88 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.398 1.079 . . . . 3.48 111.547 175.542 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -50.13 -60.16 3.22 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.862 1.265 . . . . 2.41 109.226 176.426 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.42 -57.31 13.51 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.427 -0.583 . . . . 4.28 109.427 -175.581 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -43.52 -54.89 4.57 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.912 1.685 . . . . 2.06 110.733 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 16.1 mtpp -56.61 -47.13 80.32 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.767 0.427 . . . . 3.61 111.454 175.429 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.2 t -60.71 -31.9 71.16 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 118.979 -0.534 . . . . 1.64 112.253 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 7.0 mp -75.54 -53.73 8.15 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.06 0.845 . . . . 2.01 110.061 174.458 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -53.65 -9.29 0.2 Allowed 'General case' 0 C--O 1.222 -0.374 0 N-CA-C 117.462 2.393 . . . . 2.19 117.462 -167.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.6 m -35.54 -23.04 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 129.649 3.18 . . . . 1.92 119.119 -127.674 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -51.38 -32.36 25.78 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.429 1.468 . . . . 3.44 111.544 159.072 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 64.01 55.05 1.61 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.579 0.751 . . . . 2.69 109.155 177.342 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 51.7 p30 -91.83 -17.67 24.96 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.519 1.128 . . . . 2.17 110.562 173.836 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 79.95 13.11 1.01 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.455 1.502 . . . . 2.2 112.544 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -124.33 101.81 7.37 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 106.857 -1.534 . . . . 3.0 106.857 167.117 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.13 106.6 7.82 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 106.684 -1.598 . . . . 1.46 106.684 175.854 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 48.9 tttt -83.78 178.84 7.76 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.506 1.522 . . . . 3.57 110.652 -162.652 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -83.53 80.19 9.19 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.994 1.318 . . . . 4.81 110.553 177.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . 0.363 28.4 t-20 123.9 -164.79 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 113.37 -3.205 . . . . 4.84 103.915 -110.082 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -31.86 -37.7 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 124.519 3.327 . . . . 2.39 116.798 -148.762 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -40.53 -53.97 2.59 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 121.112 1.778 . . . . 3.88 111.503 166.307 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.47 ' CH2' ' CD1' ' A' ' 77' ' ' TRP . 58.6 t90 -40.1 -32.03 0.15 Allowed 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 126.768 2.027 . . . . 3.73 114.838 173.542 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -46.54 -45.22 18.51 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 121.114 1.779 . . . . 6.8 110.276 170.532 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.7 tp -44.82 -49.74 10.61 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 124.725 1.21 . . . . 1.07 111.497 177.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 80' ' ' ILE . . . . . 0.669 HG23 ' HZ2' ' A' ' 77' ' ' TRP 0.322 8.7 tt -75.35 -21.84 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 N-CA-C 106.569 -1.641 . . . . 2.6 106.569 -166.789 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.56 ' HA2' ' CE2' ' A' ' 77' ' ' TRP . . . -59.03 -50.62 65.88 Favored Glycine 0 CA--C 1.491 -1.408 0 C-N-CA 125.003 1.287 . . . . 1.49 110.46 167.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -67.62 -47.39 69.75 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 106.871 -1.529 . . . . 2.19 106.871 -176.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.412 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 10.6 mp -44.0 -61.06 1.58 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 120.678 1.581 . . . . 2.02 111.803 171.296 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.31 -44.42 84.12 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.84 0.856 . . . . 1.2 111.561 -177.152 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -65.3 -54.04 35.03 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.977 1.311 . . . . 1.51 110.227 -177.756 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -57.01 -38.91 73.79 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.582 1.553 . . . . 2.46 110.931 -173.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 2.0 tt -51.38 -36.46 17.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 118.814 0.733 . . . . 1.08 111.082 175.293 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.45 -49.82 10.17 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.736 0.815 . . . . 5.78 109.754 174.615 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 67.1 mttt . . . . . 0 C--O 1.223 -0.296 0 C-N-CA 126.264 1.826 . . . . 5.9 111.927 -160.168 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.2 mp0 . . . . . 0 N--CA 1.448 -0.557 0 CA-C-O 119.449 -0.31 . . . . 4.24 110.26 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.52 104.81 1.64 Allowed 'Trans proline' 0 N--CA 1.45 -1.032 0 C-N-CA 122.313 2.009 . . . . 2.52 109.564 -179.208 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 64.5 mt -59.28 152.11 21.7 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 108.951 -0.759 . . . . 1.33 108.951 170.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.3 t -70.17 171.76 9.19 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 120.436 -0.505 . . . . 1.76 110.188 -178.938 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -63.77 -55.58 22.06 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 121.109 -0.995 . . . . 2.89 110.914 -172.634 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.1 mp -57.13 -41.33 78.86 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 118.833 -1.147 . . . . 1.64 110.148 -176.686 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -57.59 -51.15 70.68 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 127.835 2.454 . . . . 2.01 111.284 175.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -52.87 63.83 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 108.665 -0.865 . . . . 5.12 108.665 177.887 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.9 m -61.09 -46.93 88.65 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 111.805 0.298 . . . . 2.03 111.805 -175.595 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.42 ' CD1' HG13 ' B' ' 87' ' ' ILE . 2.3 pp -64.1 -41.72 93.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 O-C-N 120.822 -1.174 . . . . 0.76 109.923 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -59.47 -49.25 78.51 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.402 1.001 . . . . 3.58 110.494 177.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.2 -40.52 74.15 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.597 0.713 . . . . 1.35 111.032 -175.785 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.4 m -75.45 -36.33 35.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 O-C-N 120.696 -1.252 . . . . 0.62 111.413 175.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 45.7 t -58.56 -46.56 89.93 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 CA-C-N 119.684 1.129 . . . . 0.76 110.064 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -63.43 -44.07 95.61 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.54 -0.743 . . . . 1.04 110.47 177.397 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 76.6 m -54.75 -48.32 72.74 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-N 119.01 0.823 . . . . 0.77 110.262 177.03 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -54.92 -61.19 2.47 Favored 'General case' 0 C--O 1.226 -0.148 0 N-CA-C 109.818 -0.438 . . . . 3.36 109.818 172.243 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -60.88 -48.76 80.32 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.261 0.624 . . . . 3.2 110.996 -163.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -62.64 -25.4 68.1 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 119.333 -0.365 . . . . 2.55 111.154 179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -82.7 -58.97 2.67 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 123.407 0.683 . . . . 2.89 111.114 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -45.12 -24.28 0.23 Allowed 'General case' 0 C--O 1.238 0.472 1 C-N-CA 132.647 4.379 . . . . 0.92 115.55 178.776 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.53 -23.62 51.38 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 123.918 0.761 . . . . 3.87 112.082 169.261 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -38.49 -66.76 0.24 Allowed 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 127.231 2.213 . . . . 1.66 113.435 -163.7 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -99.99 34.25 2.36 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 108.755 -0.831 . . . . 3.11 108.755 -174.357 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 65.0 -168.04 29.72 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-O 122.374 0.985 . . . . 1.88 110.707 -164.202 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? 53.66 72.96 0.4 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.194 -1.039 . . . . 9.87 108.194 -178.078 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.2 pttt -61.81 -34.9 76.74 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 123.491 0.717 . . . . 4.45 111.876 -170.424 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -83.93 14.1 4.37 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 118.494 -0.765 . . . . 3.54 111.669 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.3 p -125.69 145.45 50.17 Favored 'General case' 0 C--N 1.348 0.542 0 C-N-CA 124.279 1.032 . . . . 2.72 111.601 175.851 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mt -102.75 123.41 46.37 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 108.769 -0.826 . . . . 2.57 108.769 149.412 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.33 177.74 8.37 Favored 'General case' 0 C--O 1.225 -0.231 0 O-C-N 121.223 -0.923 . . . . 2.49 110.15 167.574 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 93.2 t -46.44 -59.31 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 C-N-CA 123.754 0.822 . . . . 2.24 111.167 178.855 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -58.19 -59.17 5.71 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 118.757 -0.639 . . . . 2.23 109.687 -177.23 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -39.19 -47.94 1.69 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.777 1.231 . . . . 2.23 111.998 171.555 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PHE . . . . . 0.4 ' CE2' ' HG ' ' A' ' 71' ' ' LEU . 0.2 OUTLIER -58.86 -58.06 10.28 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.707 0.803 . . . . 3.47 110.492 177.813 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.409 ' O ' HG22 ' A' ' 42' ' ' VAL . 21.6 ttmt -61.03 -38.66 86.92 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.874 -0.33 . . . . 2.96 110.691 -174.546 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -51.86 -35.05 43.51 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 118.687 -0.673 . . . . 2.58 111.367 173.574 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.82 -43.33 75.77 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 119.978 1.263 . . . . 2.19 108.352 -176.475 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' VAL . . . . . 0.409 HG22 ' O ' ' A' ' 39' ' ' LYS . 13.8 m -65.57 -42.97 94.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 N-CA-C 109.542 -0.54 . . . . 1.59 109.542 -175.595 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.0 m -57.7 -49.34 76.86 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.807 0.843 . . . . 2.02 111.261 170.743 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -56.46 12.66 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.769 1.228 . . . . 4.34 111.933 -171.046 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -152.48 70.85 0.92 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 119.02 0.827 . . . . 3.74 111.278 -175.719 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.414 ' N ' ' CD ' ' A' ' 47' ' ' PRO . 2.7 tp -156.5 31.41 0.04 OUTLIER Pre-proline 0 CA--C 1.542 0.668 0 N-CA-C 114.855 1.428 . . . . 1.79 114.855 174.372 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.414 ' CD ' ' N ' ' A' ' 46' ' ' LEU . 39.0 Cg_endo -63.03 -64.99 0.06 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 121.916 1.744 . . . . 2.18 113.586 -172.074 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -87.04 41.63 0.98 Allowed 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.096 -1.003 . . . . 3.78 111.611 -160.2 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.492 HD23 HD22 ' A' ' 83' ' ' LEU . 1.5 tp -141.95 -82.5 0.2 Allowed 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.172 0.989 . . . . 1.31 110.844 -172.85 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 32.0 mt -87.96 75.39 8.8 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 107.736 -1.209 . . . . 1.95 107.736 -178.006 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LYS . . . . . 0.407 ' NZ ' ' OE1' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -43.13 143.61 0.77 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.568 -1.196 . . . . 6.98 110.33 160.437 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.1 t0 65.31 81.5 0.2 Allowed 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.537 1.535 . . . . 4.4 110.042 -159.985 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -88.57 3.7 5.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-N 113.539 -1.664 . . . . 2.39 110.681 163.972 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -94.77 -57.78 1.22 Allowed Glycine 0 C--N 1.342 0.897 0 N-CA-C 109.777 -1.329 . . . . 1.86 109.777 -170.013 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.5 t -90.9 30.19 1.24 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.096 1.359 . . . . 2.56 110.007 173.212 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -40.59 -38.25 0.84 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 126.244 1.818 . . . . 1.83 110.963 166.507 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -42.44 -41.92 3.08 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.328 2.251 . . . . 4.51 111.157 175.906 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -56.42 -54.65 43.09 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.548 1.139 . . . . 2.79 111.089 173.569 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.433 ' HE3' ' H ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -58.1 -53.79 54.24 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 106.735 -1.58 . . . . 3.18 106.735 -179.291 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -45.62 -52.12 11.14 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.081 0.953 . . . . 1.82 111.147 178.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -64.52 -29.86 70.89 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.611 -0.68 . . . . 3.87 112.493 178.189 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.8 t -67.83 -48.14 67.05 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.373 0.533 . . . . 1.79 110.438 173.917 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.1 mp -57.97 -48.45 79.95 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.729 -0.607 . . . . 1.97 110.167 177.294 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -71.8 81.65 0.88 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.515 -0.311 . . . . 2.72 110.272 -172.702 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.1 m -47.8 -36.57 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 124.032 0.933 . . . . 1.78 113.499 -174.119 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.0 p-10 -98.52 -0.12 43.95 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.295 0.85 . . . . 2.31 113.295 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 44.2 58.6 3.64 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 126.985 2.114 . . . . 4.3 112.517 178.004 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 45.4 p30 -100.14 -3.48 31.66 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.888 1.275 . . . . 1.69 112.317 178.271 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 28.1 m 65.17 21.92 12.18 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.977 1.311 . . . . 1.83 113.144 -174.466 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -129.43 100.6 5.62 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 105.329 -2.1 . . . . 4.09 105.329 171.652 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' LEU . . . . . 0.4 ' HG ' ' CE2' ' A' ' 38' ' ' PHE . 0.2 OUTLIER -81.62 88.16 6.24 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 103.151 -2.907 . . . . 1.09 103.151 176.142 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -54.2 155.59 3.61 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.746 -1.205 . . . . 4.25 107.746 176.577 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -37.18 -55.77 0.96 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.239 1.016 . . . . 5.08 112.815 -173.095 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -76.31 -18.27 59.03 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.191 0.812 . . . . 4.04 113.191 -175.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -73.79 -60.05 2.43 Favored 'General case' 0 CA--C 1.529 0.161 0 O-C-N 121.364 -0.835 . . . . 2.07 108.905 166.471 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -43.09 -47.79 6.11 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 124.387 1.075 . . . . 3.5 110.435 176.587 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.626 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 39.8 t90 -39.77 -41.14 1.06 Allowed 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 124.641 1.176 . . . . 4.42 112.613 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -46.45 -38.33 8.98 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 117.976 -1.012 . . . . 5.57 112.557 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.0 tp -53.2 -48.11 68.35 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 120.082 1.31 . . . . 0.8 110.346 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 53.0 mt -59.14 -30.02 42.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 N-CA-C 108.161 -1.051 . . . . 1.64 108.161 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.569 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -67.13 -50.81 43.09 Favored Glycine 0 CA--C 1.491 -1.444 0 C-N-CA 125.922 1.725 . . . . 1.26 111.399 177.012 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -67.9 -23.84 65.15 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 107.651 -1.24 . . . . 2.21 107.651 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.492 HD22 HD23 ' A' ' 49' ' ' LEU . 13.4 mt -68.01 -54.11 20.88 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 120.636 1.562 . . . . 1.94 111.647 166.237 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.95 -28.4 62.15 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.906 0.883 . . . . 1.1 111.527 -178.386 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -79.87 -52.67 7.59 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.727 1.611 . . . . 1.72 107.459 173.787 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' GLU . . . . . 0.407 ' OE1' ' NZ ' ' A' ' 51' ' ' LYS 2.099 11.0 pt-20 -31.79 -61.05 0.24 Allowed 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 129.414 3.085 . . . . 2.49 113.42 171.916 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 8.3 tt -56.27 -32.33 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 CA-C-N 115.748 -0.66 . . . . 1.26 112.277 -172.465 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.33 -57.15 2.88 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.737 0.815 . . . . 4.65 109.506 176.097 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 56.8 tttp . . . . . 0 CA--C 1.53 0.188 0 C-N-CA 128.866 2.866 . . . . 2.74 113.065 -179.818 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.592 0 CA-C-O 120.035 -0.031 . . . . 3.24 110.99 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.555 HG22 ' HG3' ' B' ' 10' ' ' GLU . 4.7 t -74.17 -168.35 0.63 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.107 1.363 . . . . 1.86 111.286 174.452 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.516 ' HA ' ' HG2' ' B' ' 11' ' ' GLU . 62.0 tt0 -67.5 -59.99 2.93 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 122.176 0.989 . . . . 2.44 111.989 -173.799 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -53.47 -40.73 65.54 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 120.552 -1.342 . . . . 1.04 110.676 176.49 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 10' ' ' GLU . . . . . 0.555 ' HG3' HG22 ' B' ' 7' ' ' THR . 42.1 mt-10 -57.81 -49.83 75.31 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.365 0.666 . . . . 2.88 112.208 173.528 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 11' ' ' GLU . . . . . 0.516 ' HG2' ' HA ' ' B' ' 8' ' ' GLU . 13.6 pt-20 -61.44 -38.0 85.56 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 120.463 -1.398 . . . . 3.98 110.552 177.433 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 9.4 t -59.73 -49.29 78.33 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.066 0.546 . . . . 1.76 110.981 177.385 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.268 2.4 pp -62.49 -35.2 68.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 O-C-N 121.035 -1.041 . . . . 0.88 111.069 173.121 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -54.79 -59.93 4.06 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.077 -0.963 . . . . 2.81 111.063 174.027 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 12.8 t -50.65 -43.33 57.15 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.758 1.163 . . . . 1.36 112.052 -171.676 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.3 m -69.74 -43.81 79.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 O-C-N 120.967 -1.083 . . . . 0.89 110.887 177.115 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 41.1 t -55.06 -53.4 34.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-O 118.669 -0.682 . . . . 1.02 110.465 175.933 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 9.3 t -58.86 -45.97 88.87 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.334 0.97 . . . . 1.09 110.801 178.732 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 94.6 m -52.95 -55.29 24.48 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.71 0.686 . . . . 0.98 110.266 177.011 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -54.54 -44.04 72.5 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.751 -0.593 . . . . 7.1 111.482 174.762 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -64.95 -26.9 68.5 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.621 1.168 . . . . 2.36 112.299 -177.454 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 67.2 p -69.88 -61.29 1.84 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.366 0.985 . . . . 2.37 108.644 167.775 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -54.45 -29.55 49.94 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 113.105 0.78 . . . . 2.96 113.105 -177.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -51.0 -33.02 23.03 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 126.209 1.804 . . . . 1.22 111.017 176.114 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -37.95 76.03 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 117.337 -1.316 . . . . 5.36 110.825 178.616 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.556 ' CB ' ' HG2' ' B' ' 37' ' ' GLU . 1.5 tp60 -39.69 -65.82 0.35 Allowed 'General case' 0 C--O 1.24 0.582 0 O-C-N 124.962 1.414 . . . . 2.59 111.974 -143.542 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -95.24 -73.47 0.58 Allowed 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 125.531 1.769 . . . . 3.72 113.473 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.11 123.43 7.48 Favored Glycine 0 C--N 1.338 0.67 0 CA-C-O 115.584 -2.787 . . . . 2.34 112.811 178.137 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 53.2 ttt85 52.44 102.83 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 121.752 2.776 . . . . 4.89 115.08 149.694 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.61 50.32 0.18 Allowed 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 116.231 1.937 . . . . 6.15 116.231 -172.604 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -137.08 -54.09 0.7 Allowed 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 126.243 1.817 . . . . 3.33 107.618 177.006 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 56.4 p -73.38 145.84 45.59 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.834 1.253 . . . . 2.16 110.568 175.001 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.04 -173.3 4.65 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 108.496 -0.927 . . . . 2.04 108.496 157.029 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . 0.273 3.9 t -157.4 -167.98 2.46 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 122.771 1.272 . . . . 2.42 113.581 -158.351 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 15.9 t -68.17 -131.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.651 1 N-CA-C 98.204 -4.739 . . . . 3.3 98.204 151.319 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 15.2 t30 -75.26 56.1 0.8 Allowed 'General case' 0 CA--C 1.557 1.217 0 O-C-N 118.062 -2.899 . . . . 2.87 112.323 -160.356 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.556 ' HG2' ' CB ' ' B' ' 26' ' ' GLN . 58.0 mt-10 -102.85 -50.81 3.43 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 128.971 2.908 . . . . 1.77 107.688 139.966 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -56.07 -52.16 65.27 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.223 -1.028 . . . . 2.86 108.223 174.023 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 39' ' ' LYS . . . . . 0.433 ' HA ' HG22 ' B' ' 42' ' ' VAL 0.266 53.5 tttm -54.28 -45.7 72.54 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 118.602 -1.239 . . . . 3.95 110.24 -175.113 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -57.93 -39.62 78.48 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 119.116 -0.468 . . . . 2.83 112.219 176.873 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 4.7 tt -66.87 -46.01 76.33 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 119.626 1.103 . . . . 1.68 109.699 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 42' ' ' VAL . . . . . 0.433 HG22 ' HA ' ' B' ' 39' ' ' LYS . 27.4 m -69.94 -44.27 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-O 121.551 0.691 . . . . 0.66 109.219 -173.566 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 86.8 m -66.0 -49.98 65.88 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.262 1.025 . . . . 1.22 109.855 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -80.52 -62.46 1.67 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.256 0.222 . . . . 1.98 111.173 -171.471 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -83.9 -44.12 14.59 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 122.897 0.479 . . . . 2.7 112.14 -167.867 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.8 tp -82.71 -18.79 0.26 Allowed Pre-proline 0 CA--C 1.548 0.869 0 N-CA-C 118.768 2.877 . . . . 1.78 118.768 -167.54 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -46.2 -44.6 19.53 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 124.091 3.194 . . . . 2.47 117.158 -133.813 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -62.47 -44.26 96.82 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.182 0.808 . . . . 2.2 113.182 -172.222 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.5 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 12.0 tp -57.34 -77.04 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.604 1.162 . . . . 1.18 112.6 -163.654 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 5.8 mt -67.06 -40.75 87.17 Favored 'General case' 0 C--N 1.339 0.144 0 O-C-N 121.728 -0.608 . . . . 3.97 110.336 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 12.1 tptp 62.82 171.28 0.14 Allowed 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.194 0.998 . . . . 7.6 111.611 -174.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 12.9 t0 46.66 62.41 2.34 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 123.812 1.768 . . . . 3.7 108.623 -160.418 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 26.9 m -84.19 28.17 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 112.446 -2.161 . . . . 2.22 109.933 162.941 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -104.61 -63.75 0.66 Allowed Glycine 0 C--N 1.341 0.821 0 N-CA-C 107.654 -2.178 . . . . 2.57 107.654 172.093 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.75 54.4 1.82 Allowed 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.851 1.261 . . . . 3.34 110.315 -174.73 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -61.26 -35.68 77.94 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 125.134 1.373 . . . . 1.18 110.224 -172.443 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -29.26 -57.88 0.15 Allowed 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 126.367 1.867 . . . . 4.0 114.125 171.178 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -49.09 -60.29 2.91 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.053 0.941 . . . . 2.32 109.528 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 2.9 mtmt -61.1 -49.04 78.91 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.893 -1.049 . . . . 4.53 109.672 -176.948 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -51.8 -51.96 52.61 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.953 0.797 . . . . 2.14 110.83 178.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -64.94 -34.73 79.11 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 122.729 0.412 . . . . 3.83 110.978 -178.593 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 5.3 t -67.72 -37.17 81.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.387 0.675 . . . . 1.64 111.774 174.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 79.5 mt -69.13 -58.81 3.57 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.019 0.928 . . . . 1.44 109.482 177.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 64' ' ' ASP . . . . . 0.417 ' O ' ' N ' ' B' ' 66' ' ' ASN 0.314 2.1 t70 -55.8 -9.51 0.57 Allowed 'General case' 0 C--O 1.221 -0.407 0 N-CA-C 117.461 2.393 . . . . 2.84 117.461 -165.638 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 28.1 m -34.54 -24.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 129.172 2.989 . . . . 1.44 118.717 -127.627 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 66' ' ' ASN . . . . . 0.417 ' N ' ' O ' ' B' ' 64' ' ' ASP . 0.3 OUTLIER -53.2 -34.56 57.54 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.816 1.189 . . . . 3.65 111.232 160.784 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 66.07 56.12 0.86 Allowed 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.751 1.621 . . . . 4.1 111.727 171.078 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -89.96 -33.05 16.53 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 114.651 -1.159 . . . . 3.55 109.374 158.666 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 4.1 m 101.3 -4.27 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 128.154 2.581 . . . . 2.4 114.005 175.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -101.22 132.54 46.67 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 106.401 -1.703 . . . . 5.28 106.401 164.905 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -99.79 118.5 36.39 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 106.61 -1.626 . . . . 1.15 106.61 -167.75 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 6.9 tptm -79.74 176.37 9.78 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.841 0.856 . . . . 3.12 109.104 -171.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -80.4 76.1 7.23 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 107.911 -1.144 . . . . 4.42 107.911 -174.817 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 97.91 53.98 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.304 1 C-N-CA 133.589 4.756 . . . . 2.15 108.922 -164.812 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -87.89 -61.84 1.63 Allowed 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 121.092 -1.005 . . . . 1.73 108.6 107.655 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -45.11 -43.64 9.84 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.651 1.18 . . . . 6.01 114.076 -162.176 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.626 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 16.9 t-105 -39.94 -36.62 0.48 Allowed 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.416 1.487 . . . . 4.77 112.495 177.232 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 10.4 mtt180 -38.36 -51.06 1.52 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.434 1.016 . . . . 4.63 111.601 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 2.7 tp -53.36 -38.77 63.6 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 123.099 0.25 . . . . 1.13 110.627 -175.356 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 70.7 mt -63.42 -25.47 38.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-O 121.729 0.776 . . . . 1.55 109.604 -174.063 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.552 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -74.48 -40.88 38.24 Favored Glycine 0 CA--C 1.49 -1.531 0 N-CA-C 109.674 -1.37 . . . . 1.33 109.674 179.076 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.94 -52.93 53.67 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 105.559 -2.015 . . . . 2.34 105.559 178.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.5 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 9.5 mp -42.22 -61.56 1.14 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.646 1.112 . . . . 2.1 111.709 172.232 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.44 -44.38 92.95 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.771 0.796 . . . . 1.16 111.805 -175.614 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 28.8 ttmt -62.69 -55.0 30.87 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.246 1.419 . . . . 1.62 110.426 -179.061 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -57.62 -44.62 85.65 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.056 0.942 . . . . 2.4 109.834 -170.922 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 87' ' ' ILE . . . . . 0.42 HG13 ' CD1' ' A' ' 13' ' ' ILE . 0.2 OUTLIER -39.89 -48.34 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 125.433 1.493 . . . . 1.57 112.67 166.149 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.54 -34.05 31.38 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.234 1.014 . . . . 3.93 110.606 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 43.4 mttm . . . . . 0 C--O 1.223 -0.305 0 C-N-CA 126.353 1.861 . . . . 5.89 110.731 -163.554 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 . . . . . 0 N--CA 1.443 -0.822 0 CA-C-O 118.939 -0.553 . . . . 6.22 109.967 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.97 96.85 0.79 Allowed 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 122.575 2.183 . . . . 2.75 110.308 179.206 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 93.4 mt -57.83 157.52 7.44 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.574 0.75 . . . . 1.71 111.033 173.614 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 10' ' ' GLU . 4.4 t -75.24 159.79 31.13 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 108.806 -0.813 . . . . 2.49 108.806 176.426 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 68.2 tt0 -51.1 -45.95 61.68 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 123.481 0.712 . . . . 4.28 110.803 -177.001 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.4 mt -64.74 -55.97 16.56 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.396 -0.811 . . . . 1.59 111.028 -177.929 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.407 ' H ' HG23 ' A' ' 7' ' ' THR . 97.9 mt-10 -49.24 -54.29 17.44 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.155 1.382 . . . . 2.19 110.678 176.846 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -50.26 -59.89 3.51 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 124.377 1.071 . . . . 3.9 109.609 174.997 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.1 p -56.61 -43.75 80.49 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.558 -0.714 . . . . 1.56 111.296 -174.494 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.308 2.7 pp -66.81 -42.94 89.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-O 118.743 -0.646 . . . . 0.69 110.44 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -61.04 -49.95 75.3 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 119.435 -0.906 . . . . 3.41 109.912 175.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 m -46.02 -51.38 13.69 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.005 1.722 . . . . 1.7 112.64 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 30.1 m -71.64 -40.33 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 O-C-N 120.335 -1.478 . . . . 0.74 110.163 178.634 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 36.2 t -55.07 -43.03 68.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 123.024 0.53 . . . . 0.73 110.586 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.7 t -61.99 -52.61 63.3 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.276 0.944 . . . . 0.92 110.716 178.027 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.9 m -57.69 -50.71 72.29 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.584 1.084 . . . . 1.12 110.529 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -45.21 -55.59 5.66 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 124.965 1.306 . . . . 2.99 110.517 171.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -58.16 -51.93 67.69 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.953 0.901 . . . . 3.95 110.58 -177.527 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 12.4 p -56.69 -38.74 72.69 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 119.41 -0.329 . . . . 2.31 111.306 -179.448 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -65.32 -52.88 51.01 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 121.386 0.612 . . . . 2.52 110.983 171.011 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.2 -19.88 65.64 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.143 1.377 . . . . 0.86 112.062 -170.247 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.31 -33.32 75.57 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 117.977 -1.011 . . . . 6.02 110.148 173.463 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.421 ' HB3' ' HG3' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -38.99 -77.17 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.86 0.864 . . . . 2.52 112.411 -173.11 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 27' ' ' GLU . . . . . 0.421 ' HG3' ' HB3' ' A' ' 26' ' ' GLN . 71.9 mt-10 -100.96 173.38 6.51 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 127.203 2.201 . . . . 2.49 106.663 -174.777 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -33.42 141.29 0.08 OUTLIER Glycine 0 CA--C 1.538 1.49 0 C-N-CA 125.978 1.752 . . . . 1.49 115.214 -173.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? 62.2 105.32 0.03 OUTLIER 'General case' 0 C--O 1.237 0.438 0 C-N-CA 125.22 1.408 . . . . 4.65 111.753 -177.996 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -73.34 50.6 0.31 Allowed 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.281 0.845 . . . . 3.6 113.281 176.457 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.7 p-10 -172.31 -32.6 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 127.429 2.292 . . . . 3.47 109.346 171.644 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.7 m -78.11 130.08 35.96 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.755 -0.831 . . . . 2.3 108.755 170.85 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -83.54 154.12 24.0 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 106.449 -1.686 . . . . 2.07 106.449 162.659 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.4 m -122.46 170.88 9.53 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 107.204 -1.406 . . . . 2.98 107.204 161.843 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.1 p -48.48 -52.1 9.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 N-CA-C 112.804 0.668 . . . . 2.09 112.804 -165.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -62.82 -57.74 9.83 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.555 -0.736 . . . . 2.53 109.798 -178.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -38.47 -51.1 1.57 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.08 1.352 . . . . 1.66 111.413 174.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.77 -49.02 78.03 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 114.966 -1.016 . . . . 3.15 109.716 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -59.95 -39.57 86.03 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 118.671 -0.68 . . . . 4.01 110.33 -176.574 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -53.66 -44.05 69.33 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 118.259 0.481 . . . . 3.68 110.753 171.755 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.12 -49.61 73.75 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 108.523 -0.917 . . . . 3.21 108.523 -173.154 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.5 m -68.95 -52.21 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 N-CA-C 108.852 -0.796 . . . . 1.24 108.852 -175.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.9 m -52.79 -51.56 60.25 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.5 1.12 . . . . 1.69 111.199 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -72.43 -50.89 23.05 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 122.543 0.337 . . . . 3.59 110.268 -175.041 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -94.69 -26.63 16.23 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.094 0.776 . . . . 4.12 113.094 -161.225 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.8 mp -107.96 93.42 10.76 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 119.167 0.894 . . . . 2.26 110.11 -175.879 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -72.07 -44.34 0.91 Allowed 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.24 1.96 . . . . 2.36 111.453 -177.97 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.2 t-160 -150.63 44.33 0.84 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.161 0.505 . . . . 3.84 110.692 -174.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 19.8 tp -95.48 -80.98 0.41 Allowed 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.01 -1.478 . . . . 1.95 107.01 167.298 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.3 mt -75.73 84.24 2.72 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.279 -0.637 . . . . 2.3 109.279 172.829 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.01 143.48 1.12 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.664 -0.698 . . . . 5.73 110.718 163.38 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 67.43 39.11 3.0 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 125.774 1.63 . . . . 4.19 110.475 177.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -49.83 -25.59 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 125.96 1.704 . . . . 3.15 113.991 -177.941 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.53 -44.08 21.85 Favored Glycine 0 CA--C 1.532 1.143 0 N-CA-C 111.183 -0.767 . . . . 1.91 111.183 170.449 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 47.1 t -74.66 45.79 0.26 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.113 1.765 . . . . 2.85 111.038 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -66.04 -49.92 66.0 Favored 'General case' 0 N--CA 1.445 -0.725 0 O-C-N 120.846 -1.159 . . . . 1.57 108.347 174.585 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.12 -38.15 56.49 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.797 1.639 . . . . 4.11 111.904 -167.429 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -55.41 -53.69 53.03 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.755 -0.591 . . . . 3.26 110.925 170.993 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.45 -46.06 89.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.974 -0.75 . . . . 2.75 108.974 175.789 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 60' ' ' MET . . . . . 0.432 ' HA ' HD12 ' A' ' 63' ' ' LEU . 18.7 tmm? -44.91 -52.72 8.38 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 123.875 0.87 . . . . 1.88 109.158 179.584 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -68.82 -39.89 79.79 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.843 -0.617 . . . . 4.66 111.423 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.1 t -58.73 -30.04 67.17 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.895 0.702 . . . . 2.59 112.895 175.644 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.542 HD23 ' HB2' ' A' ' 78' ' ' ARG . 0.1 OUTLIER -88.43 -45.26 10.11 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.536 -0.727 . . . . 1.96 109.431 175.717 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -75.2 61.25 1.13 Allowed 'General case' 0 C--N 1.342 0.256 0 C-N-CA 124.775 1.23 . . . . 1.64 111.012 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 25.7 m -58.67 -34.11 50.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.934 0.894 . . . . 1.79 112.281 -174.558 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -82.74 -8.4 59.59 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.347 0.499 . . . . 2.49 112.347 177.189 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . 0.266 2.9 tp60 50.93 66.55 1.14 Allowed 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.878 2.071 . . . . 4.41 113.407 178.25 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.8 p30 -113.17 -4.98 13.69 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.685 1.194 . . . . 2.45 111.774 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.4 m 62.53 15.38 7.84 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.304 1.041 . . . . 1.98 113.454 -171.995 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -112.11 109.6 19.42 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.602 1.561 . . . . 3.47 107.066 165.046 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -88.35 74.86 8.58 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 105.472 -2.047 . . . . 1.36 105.472 170.68 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.68 159.91 33.57 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.008 0.433 . . . . 3.32 110.886 177.488 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 15.5 p90 -37.59 -55.96 1.07 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.888 1.675 . . . . 5.41 114.057 -162.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.11 -40.27 90.59 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.85 0.75 . . . . 2.31 111.721 -177.046 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -76.46 -44.0 37.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 120.087 1.312 . . . . 2.12 109.686 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -44.55 -50.16 9.73 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 118.551 0.614 . . . . 3.35 109.961 167.784 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.634 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 1.2 t-105 -46.51 -32.23 3.23 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 116.938 -1.506 . . . . 4.03 112.418 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.542 ' HB2' HD23 ' A' ' 63' ' ' LEU . 0.5 OUTLIER -38.69 -49.08 1.55 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 120.694 1.588 . . . . 4.68 109.939 172.621 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.8 tp -48.42 -46.04 37.0 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.834 0.854 . . . . 0.82 110.251 -176.545 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 91.3 mt -62.99 -31.77 53.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 109.12 -0.696 . . . . 1.74 109.12 -171.137 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.556 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -67.99 -45.71 71.19 Favored Glycine 0 CA--C 1.488 -1.624 0 N-CA-C 109.656 -1.378 . . . . 1.23 109.656 178.046 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -69.33 -49.03 59.51 Favored 'General case' 0 N--CA 1.422 -1.873 0 N-CA-C 105.825 -1.917 . . . . 2.39 105.825 -173.595 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 9.5 mt -41.26 -59.1 1.62 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 120.881 1.673 . . . . 2.45 111.631 166.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.36 -30.74 63.05 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.513 0.725 . . . . 1.29 111.716 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 -57.23 4.93 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 123.228 0.611 . . . . 1.8 110.439 171.001 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -50.25 -48.05 54.86 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 128.689 2.796 . . . . 2.22 108.968 -174.06 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.8 tt -61.6 -21.22 24.97 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 113.849 1.055 . . . . 1.96 113.849 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 49.8 ttt85 -96.8 -60.37 1.61 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.303 1.441 . . . . 5.31 109.129 178.861 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 40.5 pttt . . . . . 0 CA--C 1.547 0.842 0 C-N-CA 124.432 1.093 . . . . 3.92 113.799 -179.381 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 42.3 mt . . . . . 0 CA--C 1.541 0.615 0 N-CA-C 109.097 -0.705 . . . . 3.74 109.097 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 11.6 t -75.57 178.62 5.87 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 119.123 0.874 . . . . 2.34 109.94 -177.704 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -61.59 -63.09 1.38 Allowed 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.526 0.679 . . . . 3.41 110.508 -172.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 mp -56.48 -44.13 80.33 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 121.447 -0.783 . . . . 2.08 109.783 -175.613 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.41 -46.03 69.59 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.541 1.936 . . . . 3.82 112.244 173.75 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.65 -51.44 69.37 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.468 -0.77 . . . . 4.73 109.225 176.353 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 91.7 p -65.98 -41.01 91.7 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.074 -0.512 . . . . 2.07 110.721 -171.833 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.279 2.4 pp -64.16 -39.46 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 CA-C-O 118.264 -0.874 . . . . 1.26 109.299 174.482 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.0 -45.92 91.48 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 117.564 -1.655 . . . . 4.88 112.469 173.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . 0.266 1.1 t -56.43 -35.27 67.65 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 120.313 1.415 . . . . 1.42 110.98 -174.428 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 20.7 m -77.0 -34.12 21.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 O-C-N 120.684 -1.26 . . . . 1.16 112.34 171.328 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 60.2 t -53.82 -51.22 46.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 120.722 1.601 . . . . 1.27 110.496 169.835 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.3 t -65.03 -43.19 93.23 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.819 0.736 . . . . 1.21 110.348 -177.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 72.0 m -55.94 -53.47 56.42 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.512 0.596 . . . . 1.15 110.28 174.354 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -47.28 -55.34 8.88 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.975 0.91 . . . . 4.21 109.951 172.652 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -56.41 -52.89 62.95 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.764 1.626 . . . . 2.55 110.819 -173.757 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.8 t -63.99 -25.2 68.02 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 122.134 -0.354 . . . . 2.56 111.42 -175.332 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -80.95 -44.1 18.74 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 119.159 0.89 . . . . 2.92 110.921 168.18 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.52 -32.59 70.44 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.712 1.205 . . . . 1.64 110.572 -172.363 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.72 -20.05 63.08 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 117.315 -1.326 . . . . 4.43 113.366 177.721 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.98 -67.16 0.32 Allowed 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 115.462 1.653 . . . . 2.28 115.462 -155.413 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -91.92 -77.03 0.44 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 119.394 -0.922 . . . . 2.77 113.062 -168.711 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.18 169.05 31.62 Favored Glycine 0 C--N 1.336 0.575 0 C-N-CA 127.555 2.502 . . . . 2.52 110.604 160.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 48.29 98.54 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.949 1.092 . . . . 4.63 113.949 137.219 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 18.0 pttm -77.9 51.18 0.93 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.318 1.847 . . . . 4.46 112.804 -174.067 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 19.5 p30 -172.36 -51.17 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.102 1.761 . . . . 3.56 108.387 -163.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 53.7 p -74.23 150.06 40.5 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.045 0.538 . . . . 1.79 110.306 170.711 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 mp -123.71 119.73 30.63 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 123.17 0.588 . . . . 2.88 110.044 161.748 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 50.1 m -90.35 175.63 7.03 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.869 -0.789 . . . . 2.56 108.869 170.71 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 11.0 p -84.03 51.77 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 O-C-N 121.004 -1.06 . . . . 2.66 110.709 -175.58 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -159.93 55.1 0.36 Allowed 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 106.084 -1.821 . . . . 3.08 106.084 159.365 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -178.49 -56.12 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 127.9 2.48 . . . . 1.94 104.546 -166.151 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -60.1 -59.38 5.51 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.604 -0.887 . . . . 3.45 108.604 165.228 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 54.3 tttt -58.18 -35.83 72.17 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 119.903 -0.719 . . . . 2.47 111.365 -174.275 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -49.56 -42.8 45.15 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 119.302 -0.38 . . . . 4.27 111.9 172.694 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 tp -66.42 -49.15 67.73 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.773 -0.825 . . . . 1.92 108.773 -172.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 42' ' ' VAL . . . . . 0.424 ' HA ' HD23 ' B' ' 46' ' ' LEU . 9.4 m -69.09 -38.16 77.79 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.163 0 CA-C-N 116.083 -0.508 . . . . 0.73 110.016 -174.182 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 94.1 m -61.1 -54.86 39.41 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.124 -0.489 . . . . 1.26 110.134 173.717 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -82.01 -60.35 2.26 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.686 0.794 . . . . 2.03 112.884 -167.724 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -81.23 -38.95 26.12 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 114.276 1.213 . . . . 2.89 114.276 -160.773 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 46' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' B' ' 42' ' ' VAL . 1.4 mm? -48.93 -44.3 70.23 Favored Pre-proline 0 CA--C 1.532 0.271 0 N-CA-C 114.922 1.453 . . . . 2.12 114.922 -155.287 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -77.51 -36.13 1.35 Allowed 'Trans proline' 0 N--CA 1.448 -1.177 0 N-CA-C 108.92 -1.223 . . . . 2.47 108.92 -44.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -88.79 -35.74 16.47 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 125.231 1.412 . . . . 2.62 110.373 -173.375 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.544 HD23 ' HB2' ' B' ' 83' ' ' LEU . 15.9 tp -42.14 -63.53 0.73 Allowed 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 114.043 1.127 . . . . 1.19 114.043 -172.593 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 35.4 mt -83.39 162.57 21.0 Favored 'General case' 0 C--N 1.338 0.107 0 CA-C-O 121.459 0.647 . . . . 2.04 109.4 175.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 51' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' B' ' 86' ' ' GLU . 0.0 OUTLIER -142.44 154.03 44.21 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 124.762 1.225 . . . . 5.59 108.002 178.315 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 30.2 t0 66.68 82.11 0.19 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 126.486 1.914 . . . . 3.75 109.461 -164.557 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 34.7 m -93.93 11.5 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 CA-C-N 113.735 -1.575 . . . . 1.93 109.485 162.96 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.57 -71.17 1.3 Allowed Glycine 0 C--N 1.339 0.738 0 N-CA-C 106.703 -2.559 . . . . 2.51 106.703 174.807 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.33 55.11 2.16 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 123.13 1.443 . . . . 3.06 109.652 -179.154 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.66 -34.33 74.15 Favored 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 124.235 1.014 . . . . 1.18 108.774 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -44.69 -46.28 10.23 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.4 1.48 . . . . 4.24 112.075 171.841 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -55.49 -48.54 74.42 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.635 0.652 . . . . 2.67 110.215 177.309 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -59.15 -51.67 69.0 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 107.36 -1.348 . . . . 3.38 107.36 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 9.9 tmm? -50.26 -60.57 2.85 Favored 'General case' 0 C--O 1.227 -0.081 0 C-N-CA 124.841 1.256 . . . . 2.89 110.233 -174.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt -59.19 -36.85 76.07 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.591 -0.242 . . . . 4.98 111.6 -175.647 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -68.93 -38.2 79.36 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.943 0.897 . . . . 1.7 111.348 178.53 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 24.0 mt -73.4 -54.26 8.74 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.28 1.032 . . . . 1.53 109.992 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -62.88 -10.2 12.45 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 128.009 2.524 . . . . 2.53 116.244 -166.291 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 21.4 m -33.73 -24.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 119.384 3.105 . . . . 1.67 119.384 -134.08 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -55.17 -27.43 45.66 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 120.894 1.679 . . . . 2.85 111.106 165.063 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 74.35 61.15 0.08 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.557 1.143 . . . . 3.61 110.548 164.678 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 46.8 p30 -117.92 -16.29 9.92 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.053 1.741 . . . . 1.91 112.587 -177.323 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 1.3 t 69.57 21.33 6.74 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.715 1.143 . . . . 2.58 112.209 -173.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -122.14 99.7 6.57 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 106.124 -1.806 . . . . 3.12 106.124 158.844 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.41 98.09 1.74 Allowed 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.99 -1.856 . . . . 1.21 105.99 172.089 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -84.65 174.99 9.52 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 118.412 0.551 . . . . 4.62 110.484 -179.648 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -92.45 58.8 3.26 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.306 0.642 . . . . 5.62 111.768 -173.701 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -158.28 51.02 0.41 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 108.008 -1.108 . . . . 2.3 108.008 101.248 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -91.04 -62.47 1.44 Allowed 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.043 -1.465 . . . . 2.32 107.043 145.869 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -52.17 -46.98 65.71 Favored 'General case' 0 CA--C 1.512 -0.509 0 C-N-CA 124.595 1.158 . . . . 4.46 111.163 -167.681 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.634 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 56.2 t90 -45.08 -37.54 4.32 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 114.437 -1.256 . . . . 3.9 111.724 -175.341 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -39.69 -45.19 1.65 Allowed 'General case' 0 C--N 1.344 0.33 0 C-N-CA 124.031 0.933 . . . . 4.15 112.483 173.595 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 17.4 tp -49.59 -45.83 48.44 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.017 0.927 . . . . 1.23 111.551 -178.859 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 70.3 mt -64.53 -26.18 39.66 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.625 0 N-CA-C 108.052 -1.092 . . . . 1.43 108.052 -177.426 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.528 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -70.14 -45.28 56.9 Favored Glycine 0 CA--C 1.503 -0.691 0 C-N-CA 127.066 2.269 . . . . 1.47 112.44 177.549 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -68.53 -53.41 23.27 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 106.73 -1.581 . . . . 2.01 106.73 -177.637 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.544 ' HB2' HD23 ' B' ' 49' ' ' LEU 0.254 3.8 pp -58.22 -37.19 74.38 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 119.962 -0.695 . . . . 1.76 111.585 174.614 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.78 -57.91 10.95 Favored 'General case' 0 C--N 1.34 0.155 0 O-C-N 121.119 -0.988 . . . . 1.5 111.655 175.675 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 4.5 ptpt -63.08 -36.71 84.48 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.407 -0.806 . . . . 1.9 110.504 -178.449 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' B' ' 51' ' ' LYS . 2.2 mm-40 -44.22 -39.26 4.29 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 124.716 1.206 . . . . 4.9 111.908 -173.449 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 5.2 tt -47.1 -45.32 8.4 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 123.118 0.567 . . . . 1.07 111.677 178.589 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -84.34 -50.63 7.65 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.034 0.534 . . . . 5.13 111.957 166.247 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 27.8 mttp . . . . . 0 N--CA 1.452 -0.356 0 O-C-N 121.263 -0.898 . . . . 5.16 111.638 -169.816 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 . . . . . 0 N--CA 1.448 -0.537 0 N-CA-C 110.111 -0.329 . . . . 4.56 110.111 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.65 107.65 2.36 Favored 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 122.467 2.111 . . . . 2.44 109.511 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 77.8 mt -65.47 159.71 23.78 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.554 0.742 . . . . 1.31 110.25 175.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.634 HG22 ' CD ' ' A' ' 10' ' ' GLU . 6.1 t -76.85 170.0 17.29 Favored 'General case' 0 N--CA 1.458 -0.037 0 N-CA-C 109.271 -0.64 . . . . 2.13 109.271 -179.466 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -64.49 -42.85 95.62 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 108.477 -0.934 . . . . 2.86 108.477 -171.058 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.8 mp -63.99 -57.52 9.48 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 118.422 -0.799 . . . . 2.0 111.522 176.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.634 ' CD ' HG22 ' A' ' 7' ' ' THR . 67.4 mt-10 -48.61 -52.6 22.21 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.4 1.48 . . . . 2.76 109.943 178.192 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -51.99 -59.62 4.14 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.794 1.238 . . . . 3.17 109.527 175.011 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.0 p -55.38 -43.35 75.06 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.489 -0.757 . . . . 1.6 111.771 -175.278 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.311 2.7 pp -65.37 -44.23 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 CA-C-O 118.687 -0.673 . . . . 0.63 110.57 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -60.57 -48.79 80.22 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.484 1.038 . . . . 3.87 110.104 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 m -45.65 -46.26 14.51 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.836 1.654 . . . . 2.0 112.613 175.026 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 23.7 m -80.46 -33.55 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 O-C-N 120.817 -1.177 . . . . 0.75 111.712 177.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.5 t -57.7 -39.32 69.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 121.467 -0.77 . . . . 0.77 110.434 175.386 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.1 t -64.81 -43.14 94.11 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.975 0.807 . . . . 0.64 111.15 175.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.0 m -55.48 -51.55 66.6 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 120.925 -1.109 . . . . 1.14 110.161 173.41 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -48.23 -60.17 2.86 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 109.698 -0.482 . . . . 3.85 109.698 173.221 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -54.16 -53.31 55.2 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.636 0.774 . . . . 3.89 111.225 -173.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 22.0 p -57.08 -60.39 3.66 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 122.551 0.341 . . . . 2.38 110.451 -178.578 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -56.15 -40.58 74.06 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-O 121.178 0.513 . . . . 2.67 111.231 178.346 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.2 -26.92 68.35 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 121.093 -1.005 . . . . 0.85 110.735 -174.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 52.6 ttp180 -79.62 -19.21 49.78 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 117.724 -1.131 . . . . 6.64 112.448 -177.616 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -41.16 -67.34 0.26 Allowed 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.505 1.048 . . . . 1.94 113.623 -173.867 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -98.43 79.81 2.55 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 104.138 -2.541 . . . . 2.56 104.138 178.474 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 38.86 -155.51 0.02 OUTLIER Glycine 0 CA--C 1.525 0.709 0 C-N-CA 127.01 2.243 . . . . 2.78 112.586 -176.364 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 74.9 mtp85 31.66 87.37 0.01 OUTLIER 'General case' 0 C--O 1.24 0.558 0 C-N-CA 126.681 1.992 . . . . 4.87 110.716 165.549 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' LYS . . . . . 0.55 ' H ' ' HD3' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -82.21 43.87 0.83 Allowed 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 127.517 2.327 . . . . 4.96 109.025 -168.603 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -155.51 -52.84 0.09 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 105.521 -2.029 . . . . 4.06 105.521 -142.322 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 16.5 p -106.72 136.78 45.93 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 125.732 1.613 . . . . 1.97 109.917 169.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -83.82 130.31 34.93 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 105.98 -1.859 . . . . 1.91 105.98 157.816 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 21.2 t -81.32 177.39 9.02 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.332 1.453 . . . . 2.47 107.62 169.069 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 76.5 t -62.2 -52.1 64.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 121.728 -0.607 . . . . 2.64 110.03 -174.894 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -60.67 -55.74 29.58 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 118.701 -0.666 . . . . 2.16 109.62 177.056 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -39.0 -54.24 1.69 Allowed 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 126.028 1.731 . . . . 1.99 111.968 173.601 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -57.0 -54.18 49.63 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.434 0.693 . . . . 2.9 109.291 177.516 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 48.4 tttt -56.81 -39.19 73.71 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.258 0.466 . . . . 2.57 112.258 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -49.9 -33.07 16.16 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 119.41 1.005 . . . . 3.0 111.882 177.568 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -63.38 -46.13 87.88 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 108.256 -1.016 . . . . 2.21 108.256 -178.549 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.4 m -75.77 -38.9 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-N 115.771 -0.65 . . . . 1.32 109.913 -174.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 50.0 m -61.45 -44.47 97.05 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.875 0.87 . . . . 1.83 111.378 174.994 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -76.44 -57.88 3.61 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.88 -0.415 . . . . 2.97 109.88 -170.262 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -100.81 -124.65 0.17 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.074 -0.713 . . . . 3.52 109.074 -175.852 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.4 mp 24.22 64.21 0.41 Allowed Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 127.625 2.37 . . . . 1.99 113.762 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -78.59 -49.49 0.08 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.221 1.947 . . . . 1.77 111.331 -171.655 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -112.48 -28.68 7.77 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.277 1.431 . . . . 3.33 111.335 -173.998 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.684 HD13 ' HG2' ' B' ' 10' ' ' GLU . 6.5 tp -65.03 -79.52 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.061 1.344 . . . . 1.23 110.997 -171.95 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.1 mt -78.46 165.34 23.88 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 108.345 -0.983 . . . . 2.74 108.345 165.236 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.74 161.1 9.09 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 105.816 -1.92 . . . . 6.51 105.816 -166.635 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 46.7 t0 60.11 78.27 0.28 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 123.057 1.408 . . . . 5.01 108.82 -163.492 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.1 m -85.3 12.42 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 113.552 -1.658 . . . . 2.66 110.089 166.373 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.97 -66.48 1.66 Allowed Glycine 0 C--N 1.34 0.779 0 N-CA-C 106.444 -2.662 . . . . 2.02 106.444 167.426 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.3 t -78.23 61.0 2.62 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 122.291 1.043 . . . . 2.59 110.841 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -79.77 -39.68 30.42 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 125.471 1.508 . . . . 1.36 108.513 169.728 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -40.7 -53.2 2.84 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.853 1.661 . . . . 4.88 112.167 171.045 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -48.81 -56.61 8.18 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.193 1.397 . . . . 3.02 111.094 174.258 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.56 -51.94 65.4 Favored 'General case' 0 C--O 1.225 -0.235 0 N-CA-C 108.406 -0.961 . . . . 3.03 108.406 177.016 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -47.75 -52.24 19.3 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 123.941 0.896 . . . . 1.67 110.12 -176.151 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -62.95 -39.4 94.51 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 118.08 0.4 . . . . 2.93 111.685 178.183 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.4 t -60.13 -37.06 78.92 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.934 -0.479 . . . . 1.77 111.567 175.762 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.6 mp -77.42 -55.56 5.29 Favored 'General case' 0 CA--C 1.528 0.103 0 O-C-N 121.141 -0.975 . . . . 1.94 110.93 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -76.45 69.72 2.94 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.076 0.95 . . . . 1.78 110.035 -174.963 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 20.5 m -49.36 -33.09 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 124.534 1.134 . . . . 1.72 112.827 -176.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -96.44 0.78 50.91 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.196 0.813 . . . . 2.75 113.196 -176.752 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 44.93 65.49 1.08 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.885 1.674 . . . . 5.11 112.541 176.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 30.6 p30 -107.48 -8.34 16.28 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.614 1.166 . . . . 2.09 111.089 171.49 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 44.0 m 61.08 23.82 13.97 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.523 1.129 . . . . 1.57 112.438 -171.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -120.39 108.94 14.74 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 106.691 -1.596 . . . . 3.25 106.691 163.703 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -80.53 89.16 5.64 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 103.686 -2.709 . . . . 1.24 103.686 177.307 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.8 ttpm? -68.49 161.17 28.35 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.734 1.214 . . . . 3.91 108.945 -174.896 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -37.7 -62.04 0.57 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.403 1.081 . . . . 5.37 113.279 -168.054 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -70.25 -33.33 71.49 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 111.701 0.26 . . . . 1.92 111.701 -176.597 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -61.84 -60.01 4.29 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 108.826 -0.805 . . . . 1.99 108.826 177.902 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -48.34 -52.92 19.41 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 124.048 0.939 . . . . 2.62 109.505 174.496 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.554 ' CE2' ' HA2' ' B' ' 81' ' ' GLY . 12.8 t-105 -51.01 -29.38 12.34 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 117.498 -1.239 . . . . 4.89 111.435 -178.195 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 36.6 ttt180 -43.75 -43.81 6.27 Favored 'General case' 0 C--N 1.351 0.659 0 CA-C-N 120.471 1.487 . . . . 5.63 110.712 171.667 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.5 tp -44.53 -45.54 9.38 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 122.851 0.46 . . . . 1.0 110.854 178.354 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' ILE . . . . . 0.404 ' N ' HD12 ' A' ' 80' ' ' ILE . 1.5 mp -69.51 -32.74 54.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 108.961 -0.755 . . . . 1.93 108.961 -175.615 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.431 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -58.74 -44.84 95.55 Favored Glycine 0 CA--C 1.506 -0.469 0 N-CA-C 110.175 -1.17 . . . . 1.51 110.175 169.346 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -76.53 -33.61 58.57 Favored 'General case' 0 N--CA 1.438 -1.029 0 N-CA-C 108.653 -0.869 . . . . 2.35 108.653 -169.698 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.414 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 9.1 mp -52.77 -54.71 30.07 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.042 0.837 . . . . 2.25 109.786 161.078 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.36 -26.88 66.94 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.889 0.475 . . . . 1.85 111.9 -178.048 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.409 ' HB2' ' HE3' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -68.63 -61.1 1.97 Allowed 'General case' 0 C--O 1.217 -0.628 0 O-C-N 121.579 -0.701 . . . . 2.29 109.628 162.894 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -53.14 -43.61 67.13 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.634 1.574 . . . . 3.51 112.062 -164.977 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' ILE . . . . . 0.428 HD12 ' OE2' ' B' ' 10' ' ' GLU . 11.7 tt -53.29 -37.12 27.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-O 121.816 0.817 . . . . 1.67 111.366 173.978 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.08 -63.51 1.27 Allowed 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 126.288 1.835 . . . . 5.51 110.167 -171.294 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 35.6 tttp . . . . . 0 N--CA 1.449 -0.522 0 C-N-CA 126.609 1.964 . . . . 4.38 113.585 -162.447 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 13.1 mt . . . . . 0 CA--C 1.544 0.733 0 CA-C-O 118.396 -0.812 . . . . 3.51 112.714 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 4.7 t -110.68 -80.83 0.58 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.619 1.34 . . . . 2.51 114.619 -161.508 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -162.58 -72.23 0.05 OUTLIER 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.935 0.894 . . . . 3.25 108.658 -173.134 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.5 mt -56.41 -50.03 72.79 Favored 'General case' 0 C--N 1.338 0.102 0 N-CA-C 109.215 -0.661 . . . . 1.18 109.215 171.554 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 10' ' ' GLU . . . . . 0.684 ' HG2' HD13 ' A' ' 49' ' ' LEU . 3.3 tm-20 -43.66 -62.6 1.04 Allowed 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 124.269 1.028 . . . . 4.72 111.092 167.2 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -48.42 -42.61 32.65 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.262 0.553 . . . . 4.0 109.768 -177.181 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 14.7 m -62.84 -36.92 84.83 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.154 0.981 . . . . 1.54 112.617 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.272 1.9 pp -75.7 -37.39 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 118.913 0.779 . . . . 1.02 111.029 171.382 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 14' ' ' GLU . . . . . 0.4 ' HG2' HD11 ' A' ' 87' ' ' ILE . 4.9 tm-20 -57.71 -59.09 5.74 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 118.895 0.77 . . . . 2.38 109.602 177.878 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.4 t -47.32 -44.84 23.9 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.005 0.821 . . . . 1.22 112.097 -174.878 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.1 m -73.03 -43.83 57.84 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 O-C-N 120.987 -1.071 . . . . 0.83 110.843 178.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 37.1 t -53.69 -51.28 45.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 O-C-N 121.405 -0.809 . . . . 1.17 110.617 175.131 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 13.7 t -60.05 -48.91 79.74 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 117.457 -1.258 . . . . 1.48 110.355 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 99.0 m -46.14 -57.67 4.3 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 120.634 1.561 . . . . 1.31 109.671 175.287 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 10.5 m-30 -55.63 -61.28 2.46 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.343 0.497 . . . . 6.8 112.343 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -69.49 -33.95 73.62 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 119.165 0.893 . . . . 4.44 112.025 -169.939 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 64.6 p -61.44 -55.53 30.31 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 108.449 -0.945 . . . . 3.57 108.449 170.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -55.44 -38.11 68.59 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.046 0.839 . . . . 2.98 112.038 -177.836 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.32 -19.7 9.44 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 127.417 2.287 . . . . 1.5 112.323 176.511 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -17.54 10.17 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.609 1.163 . . . . 3.44 112.444 170.589 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.497 ' CB ' ' HG3' ' B' ' 37' ' ' GLU . 0.0 OUTLIER -47.68 -65.62 0.54 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 115.082 1.512 . . . . 1.94 115.082 -173.925 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . 0.342 17.4 mt-10 -82.42 -17.65 44.63 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 118.621 2.823 . . . . 3.22 118.621 -161.574 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.21 -107.16 0.58 Allowed Glycine 0 C--N 1.338 0.655 1 C-N-CA 133.601 5.381 . . . . 3.49 114.093 -4.521 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.26 86.6 0.13 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 107.525 -1.287 . . . . 4.61 107.525 -175.467 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 14.6 pttm -81.95 14.47 2.74 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 115.558 1.688 . . . . 3.77 115.558 -157.881 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 21.5 p-10 -120.11 -49.19 2.3 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 124.131 0.972 . . . . 3.09 109.158 171.898 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 85.1 p -68.63 131.38 45.11 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 123.404 0.682 . . . . 1.94 110.458 -179.524 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.6 mp -94.04 112.34 24.16 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 106.675 -1.602 . . . . 3.08 106.675 164.206 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 42.0 m -81.69 -174.36 4.96 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 128.183 2.593 . . . . 3.33 107.775 178.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 75.5 t -68.15 -95.5 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.432 0 N-CA-C 103.575 -2.75 . . . . 3.03 103.575 -171.67 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -72.44 70.12 0.87 Allowed 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 120.659 1.572 . . . . 2.78 108.724 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.497 ' HG3' ' CB ' ' B' ' 26' ' ' GLN . 25.8 tt0 -159.0 -56.0 0.06 Allowed 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 131.54 3.936 . . . . 2.53 104.282 178.719 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 38' ' ' PHE . . . . . 0.405 ' CE2' ' CE2' ' B' ' 76' ' ' TYR . 0.8 OUTLIER -60.19 -51.74 68.31 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.478 -0.934 . . . . 2.37 108.478 166.996 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 50.2 tttt -59.42 -32.64 70.37 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 119.285 -0.966 . . . . 2.65 111.894 -169.9 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -55.3 -34.46 64.15 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.705 -0.622 . . . . 3.31 112.424 174.036 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.4 tt -69.73 -45.17 68.76 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.111 0.869 . . . . 1.89 109.262 -176.283 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 42' ' ' VAL . . . . . 0.428 HG11 HD23 ' B' ' 56' ' ' LEU . 30.4 m -68.12 -36.9 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 N-CA-C 109.447 -0.575 . . . . 0.98 109.447 -175.613 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 99.4 m -62.51 -60.51 3.43 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 122.639 0.376 . . . . 1.13 111.268 169.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -82.47 -59.11 2.64 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.759 0.824 . . . . 2.41 112.938 -164.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -81.67 -32.75 31.64 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.022 0.929 . . . . 3.3 112.34 -165.546 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 46' ' ' LEU . . . . . 0.416 HD11 HD21 ' B' ' 83' ' ' LEU . 13.6 tp -82.82 -14.61 0.21 Allowed Pre-proline 0 CA--C 1.545 0.753 0 N-CA-C 118.816 2.895 . . . . 1.51 118.816 -164.016 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -40.14 -62.95 0.32 Allowed 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 125.277 3.985 . . . . 2.29 117.857 -132.846 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 12.4 t-160 -88.8 54.0 2.88 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 119.975 1.261 . . . . 3.61 110.534 -156.338 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 14.2 tp -145.57 -107.24 0.1 Allowed 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 123.727 0.811 . . . . 1.84 109.981 -166.101 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 2.4 mp -69.42 92.95 0.63 Allowed 'General case' 0 CA--C 1.531 0.242 0 O-C-N 120.913 -1.117 . . . . 2.13 110.483 178.649 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.01 149.47 0.04 OUTLIER 'General case' 0 C--O 1.237 0.42 0 C-N-CA 125.443 1.497 . . . . 6.0 113.476 174.796 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 19.4 t0 54.8 41.65 31.75 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 123.205 1.479 . . . . 5.0 107.335 176.793 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 17.0 m 35.8 45.93 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 C-N-CA 127.739 2.416 . . . . 4.18 113.093 -170.437 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 68.33 8.2 54.47 Favored Glycine 0 CA--C 1.526 0.735 0 C-N-CA 125.414 1.483 . . . . 7.11 114.865 177.742 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . 0.274 0.5 OUTLIER 49.35 66.07 1.22 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 123.493 1.616 . . . . 4.23 110.044 -175.525 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 56' ' ' LEU . . . . . 0.428 HD23 HG11 ' B' ' 42' ' ' VAL . 0.2 OUTLIER -49.32 -26.49 3.14 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.11 1.764 . . . . 2.26 114.123 -178.295 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -50.03 -74.33 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.983 0.913 . . . . 4.15 112.35 166.285 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -50.28 -45.35 54.34 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 119.211 0.914 . . . . 2.58 109.585 173.89 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.23 -39.21 85.86 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 118.834 -0.603 . . . . 2.93 111.644 -172.612 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 5.0 ttt -55.3 -45.15 76.28 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 119.4 1.0 . . . . 2.1 108.744 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.48 -43.13 98.18 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.112 -0.993 . . . . 4.73 111.121 175.964 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 2.6 m -58.72 -41.67 86.9 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.859 0.754 . . . . 1.73 112.853 176.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 33.3 mt -82.68 -60.13 2.28 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.886 1.674 . . . . 1.38 111.457 -172.797 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.282 4.3 t0 -64.85 -7.21 10.35 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.662 2.385 . . . . 2.48 116.506 -157.702 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.1 m -36.61 -25.36 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 130.985 3.714 . . . . 2.16 117.841 -154.116 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 35.8 p30 -65.8 -20.69 66.35 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 120.088 1.313 . . . . 3.51 112.332 175.263 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 112.57 -43.72 0.0 OUTLIER 'General case' 0 C--N 1.344 0.354 0 C-N-CA 129.331 3.052 . . . . 4.93 111.169 164.042 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -46.56 117.82 1.76 Allowed 'General case' 0 C--O 1.232 0.183 0 C-N-CA 123.763 0.825 . . . . 3.87 109.441 173.085 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 7.8 t -70.04 63.74 0.22 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.515 1.926 . . . . 2.49 110.637 -176.245 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -161.26 118.9 2.32 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 127.769 2.427 . . . . 3.26 105.251 -171.579 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -87.96 110.77 20.82 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.082 -1.081 . . . . 1.66 108.082 174.755 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -82.33 158.76 23.28 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 107.377 -1.342 . . . . 6.64 107.377 170.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -86.04 56.89 4.18 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.171 -0.956 . . . . 4.11 111.566 169.802 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 74' ' ' ASN . . . . . 0.407 ' HB2' ' CD ' ' A' ' 85' ' ' LYS . 1.7 t-20 -152.82 49.3 0.73 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 119.987 -0.685 . . . . 2.52 109.868 111.554 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -93.28 -61.94 1.47 Allowed 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 127.437 2.295 . . . . 2.53 107.678 134.857 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.405 ' CE2' ' CE2' ' B' ' 38' ' ' PHE . 16.2 t80 -46.23 -40.79 11.97 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 127.584 2.354 . . . . 3.93 111.99 -174.306 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.554 ' CZ2' ' CE2' ' A' ' 77' ' ' TRP . 41.7 t90 -50.91 -35.41 32.93 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 112.668 0.618 . . . . 4.06 112.668 -175.348 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -45.18 -33.79 2.44 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 122.893 0.477 . . . . 4.41 111.943 174.486 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 17.7 tp -60.86 -48.12 83.26 Favored 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 124.645 1.178 . . . . 1.18 108.89 -175.156 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . 0.296 5.2 pt -71.78 -18.01 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.376 0 C-N-CA 117.6 -1.64 . . . . 2.96 108.477 -175.384 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.554 ' HA2' ' CE2' ' A' ' 77' ' ' TRP . . . -67.7 -47.49 61.27 Favored Glycine 0 N--CA 1.443 -0.857 0 C-N-CA 125.108 1.337 . . . . 1.6 110.241 172.841 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -56.66 -63.13 1.3 Allowed 'General case' 0 N--CA 1.44 -0.956 0 CA-C-O 117.089 -1.434 . . . . 3.22 107.756 168.885 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.416 HD21 HD11 ' B' ' 46' ' ' LEU . 8.6 mp -41.76 -56.24 2.74 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 121.0 1.727 . . . . 2.06 113.286 -177.707 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.87 -28.01 63.78 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 125.159 1.383 . . . . 1.24 112.198 -176.487 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.77 -60.84 2.22 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 118.145 -0.931 . . . . 1.92 109.941 164.556 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -59.3 -24.35 63.22 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.807 0.843 . . . . 2.29 112.465 -158.407 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 11.4 tt -45.85 -53.09 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 CA-C-N 118.569 0.622 . . . . 1.88 111.249 164.723 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 49.5 ttt85 -85.21 -61.47 1.76 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.407 1.883 . . . . 5.33 113.957 171.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 49.8 tttp . . . . . 0 CA--C 1.538 0.484 0 C-N-CA 124.316 1.046 . . . . 4.71 111.749 -166.803 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 N--CA 1.446 -0.64 0 CA-C-O 119.527 -0.273 . . . . 4.91 110.777 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.64 110.52 2.91 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 122.888 2.392 . . . . 2.59 110.452 -177.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.2 mt -70.58 159.72 33.82 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.141 0.976 . . . . 1.45 109.614 173.419 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.6 t -72.89 165.74 24.35 Favored 'General case' 0 N--CA 1.464 0.264 0 O-C-N 121.545 -0.722 . . . . 1.72 109.457 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -57.19 -47.12 82.06 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 118.991 0.814 . . . . 4.07 109.657 -177.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mp -57.45 -58.39 8.48 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 117.755 -1.117 . . . . 1.71 111.222 178.597 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -49.25 -56.03 10.72 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.097 1.359 . . . . 2.56 110.419 177.697 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.1 tp10 -52.55 -52.37 55.23 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.922 1.689 . . . . 3.23 110.379 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.2 p -67.05 -45.2 78.14 Favored 'General case' 0 C--O 1.234 0.245 0 O-C-N 121.762 -0.587 . . . . 1.58 111.261 -176.795 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.296 2.9 pp -62.88 -36.55 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 O-C-N 121.421 -0.8 . . . . 0.72 109.432 177.763 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -60.11 -57.83 11.12 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 118.863 0.756 . . . . 2.84 109.94 171.44 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -54.37 -36.33 63.77 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.42 1.009 . . . . 1.47 111.989 -171.75 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.3 m -73.92 -47.4 43.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 O-C-N 121.467 -0.77 . . . . 0.93 110.833 172.498 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.8 t -50.59 -50.21 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-N 119.309 0.959 . . . . 0.53 111.622 177.382 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.4 t -60.03 -44.28 94.73 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.941 0.791 . . . . 1.18 110.479 176.857 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 63.7 m -52.67 -51.89 58.26 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.641 1.109 . . . . 1.14 109.215 174.722 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -56.6 -55.67 31.03 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 122.995 0.518 . . . . 6.89 110.732 178.559 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -68.06 -44.49 76.25 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 125.298 1.439 . . . . 2.89 110.646 -166.096 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 66.4 p -56.17 -57.82 10.56 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.389 -0.967 . . . . 3.49 108.389 170.962 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -52.7 -40.91 63.41 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 122.662 0.385 . . . . 2.91 111.959 -178.368 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.89 -16.83 32.37 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 128.323 2.649 . . . . 1.31 112.802 -178.546 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.5 -28.94 67.49 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 118.24 -0.886 . . . . 3.8 111.625 169.012 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -41.92 -62.89 0.82 Allowed 'General case' 0 C--N 1.344 0.348 0 C-N-CA 124.289 1.035 . . . . 1.95 113.055 -167.967 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 63.5 mt-10 -124.11 177.49 5.79 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 126.193 1.797 . . . . 2.89 107.502 -177.002 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -15.2 125.28 0.01 OUTLIER Glycine 0 CA--C 1.533 1.176 0 C-N-CA 127.852 2.644 . . . . 1.41 115.187 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? 64.1 105.53 0.03 OUTLIER 'General case' 0 C--O 1.237 0.43 0 C-N-CA 124.482 1.113 . . . . 4.2 112.214 177.97 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -67.15 60.02 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.856 0.862 . . . . 4.05 111.18 166.437 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -164.37 -64.83 0.04 OUTLIER 'General case' 0 N--CA 1.458 -0.066 0 C-N-CA 125.593 1.557 . . . . 3.71 107.322 -177.861 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 p -85.52 159.72 19.84 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 125.157 1.383 . . . . 1.82 110.836 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -100.12 175.66 5.67 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 107.761 -1.2 . . . . 2.28 107.761 172.99 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.9 t -144.33 179.78 7.03 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 126.781 2.033 . . . . 2.12 106.277 177.752 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 67.7 t -47.81 -64.02 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 123.533 0.733 . . . . 2.17 111.467 -175.072 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -66.57 -50.76 62.05 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 119.163 -0.446 . . . . 1.99 110.267 -176.239 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -39.01 -50.67 1.8 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.169 0.988 . . . . 2.19 113.139 170.293 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -65.27 -51.63 59.52 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.953 0.901 . . . . 2.78 109.169 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 41.6 tttm -56.98 -42.25 79.87 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 120.64 -0.424 . . . . 3.5 110.171 -175.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -50.3 -42.2 52.13 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.49 0.716 . . . . 3.24 111.604 174.381 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 tp -61.47 -48.15 82.43 Favored 'General case' 0 CA--C 1.527 0.076 0 O-C-N 120.663 -1.273 . . . . 2.86 109.357 -175.995 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.5 m -72.75 -45.71 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 CA-C-O 121.681 0.753 . . . . 1.07 109.43 -172.608 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 84.2 m -64.71 -45.37 86.85 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.211 1.004 . . . . 1.17 110.035 -177.368 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -81.18 -60.33 2.32 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.109 0.964 . . . . 2.83 110.734 -174.323 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -111.97 57.11 0.64 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.853 0.861 . . . . 4.64 112.478 -175.243 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 tp -159.1 81.17 2.65 Favored Pre-proline 0 CA--C 1.542 0.647 0 O-C-N 121.057 -1.027 . . . . 1.84 109.428 167.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -75.35 -44.41 0.31 Allowed 'Trans proline' 0 N--CA 1.452 -0.943 0 C-N-CA 123.302 2.668 . . . . 2.14 112.048 -167.385 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 35.8 t-80 -109.79 -74.88 0.64 Allowed 'General case' 0 C--N 1.343 0.319 0 CA-C-N 118.499 0.591 . . . . 3.19 110.523 176.919 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.547 HD23 HD22 ' A' ' 83' ' ' LEU . 7.2 tp 8.45 -91.78 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.969 2.508 . . . . 1.47 116.972 -166.265 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.4 mt -79.67 -27.66 40.79 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.382 1.073 . . . . 3.06 111.707 -178.668 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 42.5 mmtt 53.33 -166.42 0.07 Allowed 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 125.092 1.357 . . . . 8.54 110.073 -156.712 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.413 ' OD2' ' NZ ' ' A' ' 59' ' ' LYS . 15.4 t0 58.7 52.08 7.11 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-O 125.021 2.343 . . . . 3.85 109.705 172.458 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.57 -1.17 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 CA-C-N 111.529 -2.578 . . . . 3.26 110.318 163.776 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.87 -66.37 1.45 Allowed Glycine 0 C--N 1.342 0.888 0 C-N-CA 125.527 1.536 . . . . 1.71 110.747 171.29 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 t -78.1 68.22 4.09 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.486 1.143 . . . . 1.99 108.964 -176.005 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -81.29 -36.08 30.26 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 125.118 1.367 . . . . 1.31 110.98 -172.811 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -53.96 -44.04 70.39 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.693 -0.629 . . . . 3.97 112.014 -175.511 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -57.53 -42.64 83.3 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.36 -0.838 . . . . 3.85 111.912 174.676 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.413 ' NZ ' ' OD2' ' A' ' 52' ' ' ASP . 0.2 OUTLIER -61.82 -49.41 76.4 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.217 -0.927 . . . . 3.41 109.043 172.383 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 10.3 ttt -49.66 -45.83 49.07 Favored 'General case' 0 C--O 1.22 -0.453 0 N-CA-C 110.055 -0.35 . . . . 2.26 110.055 178.109 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -62.68 -37.69 87.42 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.251 0.62 . . . . 3.31 111.224 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.8 t -58.15 -40.69 82.01 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 118.667 0.667 . . . . 2.91 110.358 170.737 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.7 mt -73.94 -78.84 0.09 Allowed 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.671 -0.643 . . . . 2.59 111.003 178.011 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -77.77 67.87 3.73 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.803 2.041 . . . . 2.14 110.006 -174.215 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 15.5 m -57.26 -19.65 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 113.349 0.87 . . . . 3.15 113.349 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -92.54 -9.69 40.33 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.898 1.279 . . . . 2.82 113.259 176.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 48.81 56.6 7.44 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.644 1.111 . . . . 3.28 111.624 -176.929 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 56.8 p-10 -95.36 -9.87 31.68 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.004 0.522 . . . . 2.25 110.265 170.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.2 m 63.61 20.73 12.39 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.595 1.158 . . . . 1.99 111.912 -173.815 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.63 111.49 16.28 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 105.346 -2.094 . . . . 3.25 105.346 171.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -84.84 93.64 8.55 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.025 -1.842 . . . . 1.43 106.025 173.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.22 155.6 4.79 Favored 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 123.565 0.746 . . . . 4.23 109.225 174.087 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -46.27 -55.54 7.05 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 119.099 0.863 . . . . 4.98 112.916 -172.364 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -60.09 -42.34 94.44 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.126 0.965 . . . . 1.77 111.472 176.757 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -59.89 -42.52 93.98 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.025 1.73 . . . . 2.04 110.066 -176.801 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -66.73 -52.59 42.64 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 124.956 1.302 . . . . 2.67 109.63 172.084 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.506 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 1.7 t-105 -42.99 -42.95 3.97 Favored 'General case' 0 C--N 1.344 0.365 0 O-C-N 123.735 0.647 . . . . 4.76 109.819 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 44.0 mtt180 -37.0 -50.3 0.88 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.302 1.041 . . . . 4.48 111.447 -174.381 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.2 tp -45.36 -48.92 13.32 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 123.611 0.764 . . . . 0.74 110.941 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.0 mp -69.02 -34.2 62.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 C-N-CA 124.91 1.284 . . . . 1.87 109.055 -173.935 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.425 ' HA2' ' CD1' ' B' ' 77' ' ' TRP . . . -63.55 -43.97 97.27 Favored Glycine 0 N--CA 1.442 -0.902 0 N-CA-C 110.733 -0.947 . . . . 1.31 110.733 172.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -59.89 -49.32 78.16 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 118.796 -0.621 . . . . 3.02 109.692 173.658 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.547 HD22 HD23 ' A' ' 49' ' ' LEU . 29.3 mt -49.25 -48.42 45.75 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.789 1.177 . . . . 2.47 112.448 -179.472 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.18 -25.92 35.69 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.416 0.686 . . . . 1.22 112.217 177.486 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -81.25 -58.26 3.13 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.292 1.837 . . . . 2.35 109.848 168.383 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -49.71 -38.89 35.09 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.662 1.585 . . . . 2.54 113.048 -172.64 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.6 tt -49.42 -37.03 10.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 112.223 0.453 . . . . 1.21 112.223 176.225 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -98.43 -44.85 6.35 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.961 1.304 . . . . 5.95 110.451 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 35.8 tttp . . . . . 0 CA--C 1.535 0.376 0 C-N-CA 126.114 1.766 . . . . 2.86 109.792 178.278 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 38.9 mt . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 111.717 0.265 . . . . 2.53 111.717 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.5 HG23 ' N ' ' B' ' 8' ' ' GLU . 6.5 t -90.9 -66.6 0.91 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.39 2.276 . . . . 2.6 115.07 -173.534 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.5 ' N ' HG23 ' B' ' 7' ' ' THR . 37.5 tt0 -169.9 -75.66 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.92 0.888 . . . . 2.18 108.69 -162.348 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mt -56.83 -45.44 82.35 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 120.828 -1.17 . . . . 1.13 109.774 165.792 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 10' ' ' GLU . . . . . 0.484 ' HB2' ' H ' ' B' ' 7' ' ' THR . 72.1 mt-10 -50.77 -48.78 59.25 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.932 0.893 . . . . 3.13 110.768 170.751 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -58.18 -45.74 87.0 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.085 -1.009 . . . . 3.64 110.791 176.386 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -60.24 -47.68 84.96 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 124.255 1.022 . . . . 1.7 110.752 -177.381 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.285 2.9 pp -61.68 -33.21 56.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 120.322 -0.551 . . . . 0.95 110.319 174.58 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.7 -58.97 5.96 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 118.687 0.676 . . . . 2.64 111.404 172.351 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 t -51.02 -40.1 57.39 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.386 0.994 . . . . 1.18 111.559 -168.483 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.16 -43.58 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 O-C-N 121.366 -0.834 . . . . 0.94 111.802 174.729 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 37.9 t -54.31 -58.37 3.91 Favored 'Isoleucine or valine' 0 C--N 1.341 0.21 0 CA-C-N 118.572 0.624 . . . . 1.1 110.334 174.17 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 13.8 t -56.23 -47.22 78.88 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 118.667 -0.682 . . . . 1.17 110.562 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 98.3 m -58.49 -44.34 89.36 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 119.651 1.114 . . . . 1.3 111.82 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -66.06 -43.82 86.32 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 117.952 -1.499 . . . . 4.17 110.131 175.029 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -57.81 -46.49 84.59 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.119 0.968 . . . . 2.9 111.824 -174.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 31.4 p -62.28 -25.43 67.85 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.392 -0.817 . . . . 2.24 111.654 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -80.52 -46.17 16.26 Favored 'General case' 0 C--O 1.224 -0.254 0 O-C-N 121.978 -0.451 . . . . 3.41 110.491 170.123 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.03 -25.41 58.57 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 127.787 2.435 . . . . 0.94 111.938 -178.064 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -45.09 -37.37 4.22 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.783 1.233 . . . . 4.42 111.021 171.267 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.463 ' HB2' ' HG2' ' B' ' 37' ' ' GLU . 0.5 OUTLIER -60.93 -70.02 0.2 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 116.708 2.114 . . . . 2.68 116.708 -142.032 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -92.53 -74.3 0.52 Allowed 'General case' 0 C--N 1.34 0.185 0 C-N-CA 119.089 -1.044 . . . . 3.59 113.463 -166.825 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.38 152.86 22.95 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 126.384 1.945 . . . . 1.77 109.17 164.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 29.9 ttt180 43.37 100.64 0.0 OUTLIER 'General case' 0 C--O 1.241 0.63 0 C-N-CA 125.158 1.383 . . . . 4.05 113.992 146.807 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 59.9 pttt -61.06 -22.32 64.49 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 114.538 1.31 . . . . 3.41 114.538 -168.96 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -77.59 -25.52 50.0 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.488 0.551 . . . . 4.09 112.488 177.131 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 96.4 p -83.84 141.78 31.09 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 117.88 -1.057 . . . . 2.7 110.836 -172.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -93.31 115.34 27.92 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 106.124 -1.806 . . . . 2.09 106.124 149.366 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 9.1 t -99.92 177.67 5.04 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.047 0.539 . . . . 2.16 109.671 161.464 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 11.5 p -85.76 50.81 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 O-C-N 120.724 -1.235 . . . . 2.55 111.423 -173.554 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -159.75 53.28 0.36 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 107.38 -1.341 . . . . 2.54 107.38 147.909 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.463 ' HG2' ' HB2' ' B' ' 26' ' ' GLN . 73.8 mt-10 -160.48 -55.39 0.05 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 130.08 3.352 . . . . 1.63 103.444 -174.05 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.3 -50.58 73.43 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.401 -1.272 . . . . 2.21 109.643 169.006 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -62.65 -47.59 83.04 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 120.215 -0.594 . . . . 2.81 109.546 -171.235 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -39.91 -48.35 2.32 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.233 0.613 . . . . 4.26 112.078 167.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.8 tp -58.63 -49.27 78.13 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.906 -0.775 . . . . 1.95 108.906 -172.837 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 42' ' ' VAL . . . . . 0.472 ' HA ' HD23 ' B' ' 46' ' ' LEU . 4.6 m -74.25 -54.56 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-N 115.703 -0.68 . . . . 0.64 109.933 -173.742 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 63.5 m -53.03 -46.12 68.3 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.599 1.16 . . . . 0.97 110.878 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -80.84 -62.39 1.68 Allowed 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 122.989 0.516 . . . . 1.91 111.156 -173.924 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -84.28 -42.28 16.0 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 115.633 1.716 . . . . 3.47 115.633 -163.208 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 46' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' B' ' 42' ' ' VAL . 0.6 OUTLIER -44.31 -46.2 23.15 Favored Pre-proline 0 N--CA 1.474 0.736 0 N-CA-C 115.576 1.695 . . . . 1.97 115.576 -155.282 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -77.74 -29.45 4.48 Favored 'Trans proline' 0 N--CA 1.449 -1.13 0 CA-C-N 120.827 1.331 . . . . 2.31 109.477 -42.878 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 19.6 t60 -89.02 -49.69 6.62 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 125.224 1.41 . . . . 2.49 110.844 -168.724 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.473 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 6.3 tp -34.24 -60.27 0.41 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.853 2.061 . . . . 1.2 113.852 -171.042 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 54.9 mt -96.16 111.82 23.74 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 108.239 -1.023 . . . . 1.46 108.239 172.244 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -64.49 154.46 35.82 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 120.237 -0.585 . . . . 5.52 109.582 165.599 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 17.0 t0 61.17 82.94 0.16 Allowed 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.425 1.49 . . . . 4.6 109.684 -168.534 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 29.5 m -96.78 21.94 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.786 0 CA-C-N 113.542 -1.663 . . . . 2.9 109.601 166.224 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -110.79 -65.93 0.53 Allowed Glycine 0 C--N 1.343 0.954 0 N-CA-C 109.605 -1.398 . . . . 3.67 109.605 -174.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -81.67 46.3 0.96 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.131 0.972 . . . . 4.49 109.803 -179.01 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -55.09 -42.28 72.67 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.189 0.996 . . . . 2.05 109.519 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -25.78 -51.26 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.348 1.859 . . . . 4.37 113.69 164.963 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -52.88 -56.51 15.32 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.986 0.812 . . . . 3.28 111.448 174.898 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -53.79 51.65 Favored 'General case' 0 C--O 1.224 -0.262 0 N-CA-C 108.236 -1.024 . . . . 4.61 108.236 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -50.67 -53.21 32.98 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 125.386 1.474 . . . . 3.06 111.015 -178.166 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -61.07 -30.8 70.55 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.366 0.666 . . . . 3.94 111.235 -178.543 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.2 t -71.82 -55.22 7.98 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 109.831 -0.433 . . . . 2.63 109.831 173.48 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 33.6 mt -51.9 -44.13 63.64 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.599 1.56 . . . . 1.51 111.446 -179.404 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.271 22.9 t0 -50.23 -8.7 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 118.105 2.631 . . . . 1.88 118.105 -173.696 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 23.3 m -32.92 -20.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.755 1 C-N-CA 132.074 4.15 . . . . 2.24 119.14 -133.74 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -50.02 -39.81 42.66 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 119.792 1.178 . . . . 2.46 109.544 156.964 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 62.3 63.43 1.05 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.633 1.573 . . . . 3.02 109.021 -171.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -116.93 -8.57 11.27 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.333 2.253 . . . . 2.7 112.754 -175.284 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 2.1 t 92.19 -7.42 0.2 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.068 2.147 . . . . 3.53 113.239 178.342 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -129.65 119.56 23.75 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 119.207 0.912 . . . . 4.42 110.736 -175.739 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.59 105.72 14.74 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 107.634 -1.247 . . . . 1.4 107.634 176.729 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -84.0 175.06 9.81 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.852 1.661 . . . . 3.55 110.971 -175.161 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -81.61 56.7 3.08 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.668 0.787 . . . . 4.47 110.643 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -168.83 45.89 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.855 0.836 . . . . 2.67 110.178 110.635 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -90.73 -61.36 1.69 Allowed 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 127.006 2.122 . . . . 2.21 107.779 153.484 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -50.87 -38.17 47.79 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 114.648 -1.16 . . . . 3.92 111.224 -170.101 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.464 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 5.1 t90 -38.86 -48.17 1.51 Allowed 'General case' 0 CA--C 1.541 0.604 0 O-C-N 124.562 1.164 . . . . 4.62 109.906 177.365 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 14.1 mmt-85 -42.02 -39.12 1.82 Allowed 'General case' 0 C--O 1.223 -0.311 0 CA-C-O 118.317 -0.849 . . . . 6.39 112.959 -176.133 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.45 ' O ' HD13 ' B' ' 83' ' ' LEU . 6.5 tp -55.5 -47.68 75.81 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.091 1.314 . . . . 0.85 111.732 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 1.4 mt -69.93 -34.88 62.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 O-C-N 120.92 -1.113 . . . . 1.75 108.701 178.0 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -41.32 -52.31 4.32 Favored Glycine 0 C--N 1.345 1.029 0 C-N-CA 126.075 1.798 . . . . 1.76 110.216 168.596 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -76.67 -60.31 2.4 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 112.031 -2.085 . . . . 2.71 108.842 -175.931 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.473 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 6.5 mp -37.44 -58.46 0.85 Allowed 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 120.767 1.621 . . . . 2.13 112.688 -172.884 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.91 -28.62 69.65 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.347 1.059 . . . . 1.61 112.67 -176.553 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -80.32 -51.79 8.47 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.668 0.787 . . . . 1.8 110.092 172.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -51.48 -44.47 62.48 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.292 1.037 . . . . 3.52 112.028 -176.932 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 8.9 tt -52.92 -38.59 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 118.926 0.785 . . . . 1.2 111.722 175.291 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.75 -30.75 26.42 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.827 1.651 . . . . 3.54 113.892 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 53.2 tttp . . . . . 0 CA--C 1.536 0.43 0 C-N-CA 125.785 1.634 . . . . 4.79 111.936 -163.469 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 . . . . . 0 N--CA 1.442 -0.869 0 CA-C-O 118.316 -0.849 . . . . 5.39 109.117 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -70.04 140.77 42.43 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 121.96 1.773 . . . . 2.26 108.769 175.014 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.0 mt -99.3 176.03 5.67 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.394 -0.965 . . . . 1.39 108.394 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.412 HG22 ' CG ' ' A' ' 10' ' ' GLU . 2.5 t -70.47 162.74 28.19 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 120.952 -1.092 . . . . 1.78 109.749 178.631 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -56.44 -50.19 72.4 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.649 0.738 . . . . 2.02 110.474 -170.991 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.6 mt -60.74 -46.55 90.0 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 117.251 -1.357 . . . . 1.49 111.945 176.38 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.412 ' CG ' HG22 ' A' ' 7' ' ' THR . 71.0 mt-10 -49.65 -55.13 14.83 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 120.656 1.571 . . . . 2.24 112.171 172.335 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -50.55 -52.53 38.0 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.663 0.744 . . . . 4.04 109.299 176.787 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.4 t -57.6 -50.86 71.75 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.285 -0.87 . . . . 1.64 111.441 -176.724 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.451 HG21 HD12 ' B' ' 83' ' ' LEU . 2.2 pp -66.37 -39.05 83.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 CA-C-O 118.169 -0.92 . . . . 0.7 111.07 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -58.89 -55.61 32.85 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 119.619 1.1 . . . . 2.98 109.93 178.959 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 15.0 t -54.13 -38.84 65.9 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.625 0.648 . . . . 1.29 112.456 -174.129 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 m -75.03 -40.54 45.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 O-C-N 120.714 -1.241 . . . . 0.64 111.148 175.225 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.2 t -57.83 -49.54 80.65 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 CA-C-N 119.196 0.907 . . . . 0.57 110.461 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.2 t -60.12 -44.94 94.5 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.828 0.74 . . . . 0.76 110.538 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 62.0 m -58.02 -56.47 21.56 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.759 -0.588 . . . . 0.78 110.192 177.096 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -43.63 -56.3 3.81 Favored 'General case' 0 N--CA 1.458 -0.065 0 C-N-CA 125.009 1.324 . . . . 3.18 110.299 172.626 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -58.1 -52.86 63.77 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.076 0.95 . . . . 2.81 110.261 -174.681 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.5 t -65.15 -33.22 75.51 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.195 -0.602 . . . . 2.17 111.538 -177.296 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -61.47 -50.94 70.72 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.842 0.746 . . . . 2.69 110.473 168.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.01 -19.68 63.11 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.712 1.605 . . . . 0.87 112.26 -175.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.68 -18.96 58.24 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.557 1.543 . . . . 3.82 112.054 176.67 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.71 -69.39 0.13 Allowed 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.953 0.797 . . . . 2.68 112.171 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -111.26 171.25 7.59 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 125.73 1.612 . . . . 2.61 107.082 -172.656 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -20.75 131.57 0.01 OUTLIER Glycine 0 CA--C 1.53 1.019 0 C-N-CA 127.338 2.399 . . . . 1.58 114.333 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.3 mmm-85 64.92 103.25 0.04 OUTLIER 'General case' 0 C--O 1.237 0.438 0 C-N-CA 124.699 1.2 . . . . 6.66 111.502 178.508 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.9 pttm -73.21 56.2 0.46 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.85 0.86 . . . . 3.59 111.439 173.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -163.38 -54.62 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.309 1.443 . . . . 3.64 108.229 -176.556 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 97.8 p -83.91 150.29 25.79 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-O 121.213 0.53 . . . . 1.8 111.295 175.588 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -96.51 126.27 41.58 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 107.611 -1.255 . . . . 1.82 107.611 168.594 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 t -83.37 177.42 8.5 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 109.554 -0.536 . . . . 2.32 109.554 164.087 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.7 p -61.42 -49.62 83.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 O-C-N 121.963 -0.46 . . . . 2.08 111.517 -171.37 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -63.49 -54.2 40.05 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 108.333 -0.988 . . . . 2.32 108.333 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -36.97 -51.83 0.93 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 125.238 1.415 . . . . 1.93 111.53 172.512 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -61.87 -53.97 48.54 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.511 -0.768 . . . . 2.34 110.791 177.53 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.6 ttmm -56.32 -41.8 76.61 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.944 -0.472 . . . . 2.51 110.219 -176.183 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -55.41 -36.31 66.31 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 122.768 0.427 . . . . 3.3 111.145 178.274 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.1 tt -68.17 -48.26 65.8 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 119.403 1.001 . . . . 2.5 109.737 -178.046 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.1 m -67.15 -39.94 84.18 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 N-CA-C 109.507 -0.553 . . . . 0.92 109.507 -176.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 95.0 m -63.37 -52.94 59.62 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 124.011 0.924 . . . . 1.16 110.69 176.554 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -78.34 -54.78 5.82 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.505 0.722 . . . . 2.04 111.257 -167.684 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -120.32 43.11 2.8 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.498 0.719 . . . . 3.57 111.045 -163.74 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 tp -153.18 61.07 3.48 Favored Pre-proline 0 CA--C 1.542 0.671 0 O-C-N 121.885 -0.509 . . . . 1.57 111.013 177.32 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -66.72 -43.82 6.77 Favored 'Trans proline' 0 N--CA 1.453 -0.858 0 C-N-CA 124.169 3.246 . . . . 2.02 115.385 -165.858 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -132.27 26.98 4.49 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 120.008 1.276 . . . . 3.46 112.281 -166.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.419 HD23 HD22 ' A' ' 83' ' ' LEU . 11.5 tp -99.93 -75.99 0.56 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 122.566 0.347 . . . . 1.58 110.796 -168.734 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.0 mp -91.74 -175.94 4.31 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.639 1.175 . . . . 3.0 108.604 166.928 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -134.74 -160.76 1.08 Allowed 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 106.93 -1.507 . . . . 5.73 106.93 159.904 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 69.15 26.94 5.38 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.639 1.575 . . . . 3.78 111.291 171.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -68.38 -8.97 10.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.939 1.295 . . . . 2.02 112.962 -174.64 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.65 -64.28 4.24 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 108.792 -1.723 . . . . 1.78 108.792 166.924 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.89 53.65 0.12 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 129.191 2.996 . . . . 2.52 111.646 178.384 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -74.31 -26.36 60.12 Favored 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 124.985 1.314 . . . . 1.36 109.33 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -54.14 -46.36 72.22 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.663 1.185 . . . . 4.23 111.224 176.504 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -50.12 -54.85 17.78 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.788 0.804 . . . . 2.87 109.7 174.208 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.02 -47.93 83.44 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.412 -0.813 . . . . 4.91 109.966 -177.534 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 7.4 tmm? -51.12 -58.42 6.16 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.965 1.306 . . . . 2.04 109.455 176.586 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.9 mttt -52.83 -44.18 66.51 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.422 1.089 . . . . 3.34 110.983 178.739 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.1 m -65.68 -38.99 90.8 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.173 0.589 . . . . 2.21 111.839 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 34.8 mt -77.9 -47.09 19.53 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.501 1.12 . . . . 1.72 111.708 -175.49 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -72.47 91.46 1.38 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 123.455 0.702 . . . . 2.34 110.194 -170.35 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.2 m -55.38 -37.55 45.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 C-N-CA 122.796 0.438 . . . . 2.39 112.143 -167.349 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -97.26 -0.88 45.9 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.762 0.653 . . . . 2.19 112.762 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 46.21 48.74 13.02 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.489 1.515 . . . . 4.53 111.806 -178.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.4 p30 -90.84 -12.62 35.76 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.207 1.003 . . . . 1.78 110.685 168.895 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 35.4 p 70.47 7.05 6.07 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 127.52 2.328 . . . . 1.97 114.074 -176.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -95.06 112.82 24.48 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 104.741 -2.318 . . . . 2.93 104.741 160.028 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -80.74 96.67 7.01 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 103.766 -2.679 . . . . 1.01 103.766 171.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.15 158.32 2.27 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.481 -0.933 . . . . 3.9 108.481 171.837 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.1 p90 -38.94 -52.41 1.78 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.879 1.271 . . . . 6.01 111.915 -179.132 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -70.36 -35.17 73.39 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.181 0.592 . . . . 1.63 112.494 -179.108 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -65.13 -51.73 59.52 Favored 'General case' 0 C--O 1.227 -0.129 0 O-C-N 121.643 -0.661 . . . . 2.15 109.257 176.46 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -56.1 -49.86 72.68 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.788 0.435 . . . . 2.99 110.058 178.018 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 0.7 OUTLIER -40.02 -44.0 1.66 Allowed 'General case' 0 CA--C 1.535 0.402 0 O-C-N 124.164 0.915 . . . . 4.24 110.691 179.169 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -42.58 -40.49 2.7 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 114.176 1.176 . . . . 3.74 114.176 178.203 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 60.4 tp -46.19 -51.23 14.59 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 119.252 0.933 . . . . 0.91 111.107 175.401 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 78.1 mt -57.38 -28.94 31.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 124.656 1.182 . . . . 1.43 107.824 -175.315 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.524 ' HA3' ' CE2' ' B' ' 77' ' ' TRP . . . -76.99 -48.89 8.03 Favored Glycine 0 N--CA 1.44 -1.071 0 N-CA-C 109.607 -1.397 . . . . 1.15 109.607 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -48.61 -52.61 22.16 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-O 117.752 -1.118 . . . . 4.14 108.291 169.865 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.419 HD22 HD23 ' A' ' 49' ' ' LEU . 11.6 mt -49.48 -52.78 26.98 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 120.077 1.308 . . . . 2.47 111.712 178.599 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.4 -21.32 24.3 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.9 0.88 . . . . 1.22 112.386 176.073 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.62 -61.5 1.95 Allowed 'General case' 0 C--O 1.221 -0.437 0 CA-C-O 117.434 -1.27 . . . . 2.27 112.956 162.349 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -54.91 -33.83 62.5 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 125.834 1.654 . . . . 2.93 112.119 -166.103 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.7 tp -38.39 -44.3 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 124.808 1.243 . . . . 1.34 111.465 167.247 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 51.4 mtt85 -104.67 -58.47 1.88 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 127.044 2.138 . . . . 7.62 110.665 178.265 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 3.3 ttpm? . . . . . 0 CA--C 1.543 0.695 0 C-N-CA 125.717 1.607 . . . . 3.49 112.784 -175.075 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.0 mt . . . . . 0 CA--C 1.53 0.205 0 N-CA-C 108.68 -0.859 . . . . 2.65 108.68 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.456 HG23 ' N ' ' B' ' 8' ' ' GLU . 6.4 t -69.15 -65.59 0.69 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.062 0.764 . . . . 2.53 113.062 -174.869 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.456 ' N ' HG23 ' B' ' 7' ' ' THR . 43.9 tt0 -168.82 -75.97 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 108.78 -0.822 . . . . 1.96 108.78 -162.318 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 mt -57.3 -45.29 84.32 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 120.98 -1.075 . . . . 1.01 109.366 167.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -56.06 -39.11 71.54 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.867 1.267 . . . . 3.46 110.52 174.218 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -50.89 28.05 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 108.852 -0.795 . . . . 4.46 108.852 -176.47 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 5.4 p -61.3 -35.48 77.45 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.445 -0.798 . . . . 1.51 110.747 -172.319 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 13' ' ' ILE . . . . . 0.493 ' O ' HG23 ' B' ' 17' ' ' VAL 0.332 2.9 pp -62.38 -42.41 95.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-O 118.395 -0.812 . . . . 1.07 111.311 173.901 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -67.2 -42.94 83.29 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-N 120.763 1.62 . . . . 3.75 110.419 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 16.9 m -43.77 -47.68 8.01 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 119.261 0.937 . . . . 2.41 112.304 175.151 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 35.2 m -74.02 -37.16 46.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 O-C-N 120.777 -1.202 . . . . 1.0 111.431 177.604 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 17' ' ' VAL . . . . . 0.493 HG23 ' O ' ' B' ' 13' ' ' ILE . 95.6 t -54.85 -49.68 67.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 119.308 0.958 . . . . 1.22 110.242 173.973 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -64.24 -39.26 93.59 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.494 -0.754 . . . . 1.24 110.656 179.059 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 34.6 m -58.9 -38.72 79.54 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.78 0.718 . . . . 1.57 111.076 174.152 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 20' ' ' PHE . . . . . 0.45 ' CE1' ' HB2' ' B' ' 24' ' ' ALA . 0.0 OUTLIER -60.28 -52.57 64.7 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.183 -0.948 . . . . 4.39 109.165 169.325 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -55.01 -41.04 70.79 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.499 0.72 . . . . 3.03 112.672 -172.383 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 16.6 p -57.93 -30.26 65.8 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 118.722 -0.656 . . . . 2.95 112.197 177.522 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -82.07 -34.62 29.3 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 119.376 0.989 . . . . 2.83 112.514 167.007 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 24' ' ' ALA . . . . . 0.45 ' HB2' ' CE1' ' B' ' 20' ' ' PHE . . . -51.05 -44.6 61.13 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 124.167 0.987 . . . . 1.15 109.949 -174.905 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -51.49 -38.55 54.5 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 124.545 1.153 . . . . 3.34 112.96 178.487 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.47 -69.17 0.14 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 116.89 2.181 . . . . 1.79 116.89 -136.574 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -93.15 -76.91 0.46 Allowed 'General case' 0 C--N 1.341 0.204 0 CA-C-O 122.216 1.008 . . . . 3.73 113.652 -173.718 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.06 153.53 22.37 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 127.593 2.521 . . . . 2.21 109.767 167.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.6 ttt85 45.06 101.63 0.0 OUTLIER 'General case' 0 C--O 1.245 0.824 0 C-N-CA 125.706 1.602 . . . . 4.09 114.028 153.117 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 58.7 pttt -73.09 59.6 0.53 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.712 1.205 . . . . 3.97 112.113 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -160.98 -61.19 0.06 Allowed 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.173 1.389 . . . . 3.71 108.501 -168.318 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 55.2 p -97.44 158.71 15.33 Favored 'General case' 0 C--O 1.245 0.842 0 C-N-CA 123.418 0.687 . . . . 1.96 109.648 -173.588 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 62.6 mt -107.91 157.06 18.51 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 124.491 1.12 . . . . 2.58 109.187 164.285 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 7.9 t -152.26 178.62 9.31 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 106.684 -1.599 . . . . 3.68 106.684 167.354 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 3.2 t -83.85 56.84 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 118.743 0.701 . . . . 2.8 112.008 -161.986 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -156.5 56.4 0.56 Allowed 'General case' 0 C--O 1.225 -0.211 0 N-CA-C 106.782 -1.562 . . . . 2.25 106.782 141.317 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -173.87 -52.09 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 125.842 1.657 . . . . 1.74 106.703 -166.191 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -61.6 -53.06 61.34 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.461 -0.79 . . . . 2.17 108.968 168.298 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 38.4 tttt -57.93 -37.06 73.42 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.57 -0.286 . . . . 2.8 111.08 -174.476 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -47.35 -36.86 10.09 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.806 0.669 . . . . 3.49 112.806 173.092 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 6.6 tt -66.45 -51.28 58.56 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 107.799 -1.185 . . . . 2.48 107.799 -175.579 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 14.3 m -67.4 -46.14 84.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 109.802 -0.444 . . . . 0.72 109.802 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 99.0 m -55.73 -50.73 69.57 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 123.93 0.892 . . . . 0.86 111.517 176.525 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -76.1 -61.62 1.88 Allowed 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 118.302 0.501 . . . . 3.28 111.111 -174.558 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 40.4 mm-40 -81.36 -46.44 14.66 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 112.833 0.679 . . . . 3.42 112.833 -157.507 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -57.77 -36.71 48.17 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 122.874 0.469 . . . . 2.09 111.893 -162.294 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -45.1 -57.25 2.19 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 119.767 -3.014 . . . . 1.7 108.871 -83.271 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -55.13 -42.74 73.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 125.251 1.42 . . . . 2.26 112.55 -175.907 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 35.7 tp -52.09 -47.4 65.24 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 120.951 0.405 . . . . 0.96 110.69 -169.593 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 92.6 mt -114.96 69.58 0.72 Allowed 'General case' 0 C--O 1.228 -0.067 0 C-N-CA 125.341 1.456 . . . . 1.64 109.067 163.917 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.94 8.59 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 115.752 1.76 . . . . 4.97 115.752 178.157 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -105.05 89.82 3.25 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 104.733 -2.321 . . . . 3.33 104.733 163.669 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 19.7 m -93.52 14.81 2.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 114.991 -1.004 . . . . 1.66 108.944 166.814 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -83.36 -73.49 1.24 Allowed Glycine 0 N--CA 1.443 -0.892 0 N-CA-C 107.345 -2.302 . . . . 2.32 107.345 176.791 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 55.6 m -80.06 54.33 1.9 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.516 1.127 . . . . 2.64 112.076 -169.089 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.09 -40.89 87.01 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 124.811 1.245 . . . . 1.16 109.143 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -29.43 -66.52 0.09 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 127.164 2.186 . . . . 4.25 114.208 165.534 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -47.66 -53.11 15.87 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.854 0.835 . . . . 2.86 110.007 177.024 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -38.28 78.19 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-O 118.427 -0.796 . . . . 4.35 111.12 178.714 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.7 ttp -60.59 -45.64 93.22 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 119.881 1.218 . . . . 2.99 109.843 178.113 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -61.71 -42.81 99.44 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 120.56 -0.456 . . . . 4.26 110.278 174.292 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 11.4 m -62.67 -30.47 71.41 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 122.86 0.464 . . . . 1.7 112.029 176.617 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.566 HD23 ' HB2' ' B' ' 78' ' ' ARG . 8.4 mt -76.45 -59.52 2.73 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.928 1.691 . . . . 1.22 109.627 -178.436 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 64' ' ' ASP . . . . . 0.419 ' HA ' ' HG2' ' B' ' 75' ' ' GLU 0.344 2.7 t70 -57.18 -14.42 4.11 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 116.571 2.063 . . . . 2.92 116.571 -159.233 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 28.8 m -34.61 -19.92 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 130.635 3.574 . . . . 2.69 118.951 -132.066 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -48.98 -42.78 38.87 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 120.531 1.514 . . . . 3.91 110.092 151.848 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 70.98 55.01 0.23 Allowed 'General case' 0 C--N 1.34 0.189 0 CA-C-O 122.14 0.971 . . . . 4.18 109.23 168.727 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 16.7 p30 -87.15 -133.21 0.07 Allowed 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 104.636 -2.357 . . . . 4.17 104.636 158.961 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 61.8 m -146.14 29.11 1.09 Allowed 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.123 -1.611 . . . . 3.0 110.945 165.178 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -129.94 110.78 11.95 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 127.49 2.316 . . . . 6.28 105.646 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.24 108.39 7.0 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 104.421 -2.437 . . . . 1.27 104.421 177.919 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.12 175.11 6.9 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.257 1.423 . . . . 3.66 108.947 -178.658 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 18.9 p90 -86.9 53.05 2.69 Favored 'General case' 0 C--O 1.224 -0.281 0 O-C-N 120.434 -1.417 . . . . 5.35 113.793 -169.169 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.57 51.64 0.45 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 105.325 -2.102 . . . . 2.41 105.325 127.442 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 75' ' ' GLU . . . . . 0.419 ' HG2' ' HA ' ' B' ' 64' ' ' ASP . 0.7 OUTLIER -89.2 -63.94 1.22 Allowed 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.776 -0.824 . . . . 2.82 108.776 152.624 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.406 ' CE2' ' CE1' ' B' ' 20' ' ' PHE . 0.0 OUTLIER -53.55 -35.79 61.13 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.684 0.394 . . . . 7.87 110.865 -170.32 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 67.3 t-105 -38.62 -51.72 1.64 Allowed 'General case' 0 N--CA 1.439 -1.018 0 O-C-N 124.646 1.216 . . . . 4.58 110.744 173.612 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 78' ' ' ARG . . . . . 0.566 ' HB2' HD23 ' B' ' 63' ' ' LEU . 11.0 mmm180 -45.99 -48.09 16.64 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.623 -0.673 . . . . 4.2 111.429 177.751 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.419 ' HB2' HD21 ' B' ' 63' ' ' LEU . 6.7 tp -58.03 -41.28 82.86 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.197 0.599 . . . . 0.87 111.104 -179.652 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 55.9 mt -64.8 -35.46 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.006 0 N-CA-C 105.945 -1.872 . . . . 1.39 105.945 -176.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.575 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -66.09 -48.2 67.11 Favored Glycine 0 CA--C 1.494 -1.224 0 N-CA-C 110.209 -1.156 . . . . 1.47 110.209 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -62.44 -61.48 2.42 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-O 117.89 -1.053 . . . . 2.31 108.213 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.451 HD12 HG21 ' A' ' 13' ' ' ILE 0.262 3.8 pp -53.98 -36.22 62.68 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.949 1.25 . . . . 1.82 112.573 -178.408 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.41 -61.68 2.37 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 119.183 0.901 . . . . 1.71 110.804 170.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 18.3 ttpp -52.92 -41.16 64.16 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.356 1.863 . . . . 1.56 111.594 -175.894 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -51.08 -33.73 27.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 127.47 2.308 . . . . 3.75 111.463 178.578 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 7.1 tt -52.7 -40.43 34.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 118.607 0.639 . . . . 1.05 110.226 -176.735 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -84.85 -61.09 1.86 Allowed 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 121.431 0.634 . . . . 6.1 110.84 164.721 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 33.5 mttp . . . . . 0 CA--C 1.53 0.186 0 C-N-CA 124.047 0.939 . . . . 5.77 111.486 -168.643 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 . . . . . 0 CA--C 1.538 0.481 0 N-CA-C 108.885 -0.784 . . . . 5.57 108.885 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -76.49 158.19 36.38 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.746 2.297 . . . . 2.56 110.323 -178.424 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 72.3 mt -128.57 166.72 18.3 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.179 1.391 . . . . 1.72 107.925 179.329 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.506 HG23 ' H ' ' A' ' 10' ' ' GLU . 7.3 t -72.95 174.48 7.75 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 118.588 0.631 . . . . 2.13 110.163 -179.747 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -68.18 -43.76 77.42 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 122.535 1.159 . . . . 2.74 109.211 -177.25 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.8 mp -61.1 -41.57 96.91 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.361 -0.836 . . . . 2.16 109.962 178.571 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.506 ' H ' HG23 ' A' ' 7' ' ' THR . 78.1 mt-10 -62.53 -49.12 76.58 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.475 1.11 . . . . 2.52 111.299 175.241 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.72 -52.83 63.82 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 108.359 -0.978 . . . . 5.31 108.359 -179.816 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.4 p -61.68 -40.62 95.6 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.575 -0.284 . . . . 1.41 110.913 -170.317 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.28 2.8 pp -67.1 -39.66 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 O-C-N 121.78 -0.575 . . . . 0.61 110.209 177.974 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -60.89 -51.65 68.4 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.867 0.758 . . . . 3.69 110.018 174.513 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.5 m -44.09 -47.4 8.89 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.697 1.999 . . . . 2.12 112.354 175.625 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 30.4 m -76.33 -35.03 26.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 O-C-N 120.348 -1.47 . . . . 0.65 111.568 177.695 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.6 t -59.97 -42.79 90.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 119.484 1.038 . . . . 0.73 111.148 174.562 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.2 t -61.64 -49.07 78.02 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 120.812 -1.18 . . . . 0.71 109.532 175.201 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.1 m -52.51 -43.4 65.07 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 118.473 0.578 . . . . 0.69 110.613 176.269 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.482 ' HA ' ' CZ ' ' A' ' 23' ' ' PHE . 41.5 t80 -48.43 -57.08 6.61 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 123.683 0.793 . . . . 3.37 110.548 174.767 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -59.56 -41.78 90.93 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 119.724 -0.79 . . . . 3.39 111.388 177.468 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.9 m -53.33 -43.86 67.97 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.576 0.584 . . . . 2.61 112.576 177.876 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' PHE . . . . . 0.482 ' CZ ' ' HA ' ' A' ' 20' ' ' PHE . 22.8 p90 -81.58 -43.49 18.59 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 119.324 0.965 . . . . 6.62 113.201 176.158 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.16 -20.73 65.66 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 125.806 1.642 . . . . 1.27 112.16 -169.617 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -17.86 64.45 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 117.571 -1.205 . . . . 4.92 113.622 172.571 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -50.99 -58.18 6.71 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.925 1.239 . . . . 2.76 112.512 -172.308 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -121.6 171.12 9.06 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.286 1.834 . . . . 2.54 107.285 -179.371 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -1.59 106.57 0.01 OUTLIER Glycine 0 CA--C 1.53 0.995 0 C-N-CA 127.443 2.449 . . . . 1.65 114.268 170.973 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . 0.278 30.5 mtt85 66.11 109.45 0.04 OUTLIER 'General case' 0 C--O 1.239 0.544 0 N-CA-C 114.732 1.382 . . . . 5.11 114.732 167.244 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -62.22 59.95 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.936 0.894 . . . . 5.47 112.051 163.28 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -165.38 -57.82 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 127.048 2.139 . . . . 3.26 106.725 -171.587 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.8 p -84.92 122.75 29.64 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 125.079 1.352 . . . . 2.37 109.382 177.137 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -90.83 156.59 17.92 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 107.715 -1.217 . . . . 2.14 107.715 160.312 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.7 t -152.42 177.91 10.1 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.912 0.885 . . . . 3.67 108.784 172.021 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -39.93 -64.74 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 125.487 1.515 . . . . 2.98 112.955 -168.474 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -60.49 -60.19 4.2 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.195 0.452 . . . . 2.1 110.416 -175.767 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -38.77 -52.28 1.71 Allowed 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.601 1.56 . . . . 1.84 112.296 175.472 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -63.99 -51.74 62.86 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 114.803 -1.09 . . . . 2.59 108.726 -179.416 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.426 ' HE2' ' HB3' ' A' ' 56' ' ' LEU . 32.2 ttmt -52.56 -44.95 66.2 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.898 0.479 . . . . 3.58 111.185 178.017 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -54.26 -41.44 68.79 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.626 0.648 . . . . 2.23 111.448 175.416 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 41' ' ' LEU . . . . . 0.441 HD13 ' CD2' ' A' ' 23' ' ' PHE . 45.4 tp -64.67 -49.73 69.8 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.632 -0.877 . . . . 2.61 108.632 -176.445 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.8 m -65.8 -52.88 44.61 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 108.528 -0.915 . . . . 1.0 108.528 -174.661 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 96.5 m -52.18 -53.18 46.34 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.936 1.294 . . . . 1.68 111.511 178.669 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -75.62 -53.37 8.69 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.42 0.288 . . . . 2.7 110.285 -171.545 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -85.4 -33.66 21.91 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 117.717 -1.135 . . . . 4.64 112.446 -169.789 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.0 mt -103.17 98.3 11.63 Favored Pre-proline 0 CA--C 1.538 0.494 0 CA-C-N 120.368 1.44 . . . . 2.87 111.633 -171.914 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -71.38 -39.15 3.97 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 121.911 1.741 . . . . 1.81 111.918 -178.025 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -141.81 -12.29 0.87 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.477 1.288 . . . . 4.89 114.477 -170.8 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.48 HD21 ' HG ' ' A' ' 83' ' ' LEU . 28.0 tp -66.32 -68.79 0.34 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 119.032 0.833 . . . . 1.33 110.728 -171.353 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 36.9 mt -93.01 100.39 12.83 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 106.252 -1.759 . . . . 2.31 106.252 163.63 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 62.4 mttt -69.12 174.99 4.08 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 120.213 -0.595 . . . . 5.49 109.962 165.405 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 25.4 t0 59.49 50.48 7.46 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 124.593 2.14 . . . . 4.13 108.963 177.913 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.7 m -58.47 -35.69 55.57 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 CA-C-N 112.338 -2.21 . . . . 1.99 108.414 161.551 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -40.75 -61.69 1.84 Allowed Glycine 0 C--N 1.342 0.91 0 C-N-CA 125.937 1.732 . . . . 1.54 111.783 174.519 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 52.5 m -103.76 43.49 1.08 Allowed 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.755 0.822 . . . . 2.44 111.602 177.397 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.426 ' HB3' ' HE2' ' A' ' 39' ' ' LYS . 0.9 OUTLIER -41.05 -43.74 2.25 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 124.252 1.021 . . . . 1.82 109.608 162.611 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -39.41 -41.49 0.96 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 127.88 2.472 . . . . 3.72 112.231 179.083 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -62.09 -54.36 42.43 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 121.686 -0.633 . . . . 5.06 110.561 175.955 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.95 -50.33 66.72 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 108.304 -0.999 . . . . 2.87 108.304 176.54 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -47.29 -58.16 4.43 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.064 1.745 . . . . 2.29 110.188 -176.766 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.53 -35.16 69.93 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.514 -0.312 . . . . 4.8 111.58 -179.49 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.4 t -73.17 -46.81 48.64 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.864 0.866 . . . . 2.38 111.468 -178.528 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.5 mp -59.26 -48.37 81.87 Favored 'General case' 0 C--O 1.232 0.173 0 O-C-N 121.843 -0.536 . . . . 2.07 109.629 176.584 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -71.21 83.41 0.74 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 120.802 0.334 . . . . 1.86 110.786 -171.549 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.3 m -45.97 -41.32 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 C-N-CA 125.761 1.624 . . . . 2.6 113.941 -173.547 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -96.19 -9.06 31.41 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.26 1.024 . . . . 2.64 111.845 -179.869 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 53.02 35.34 19.2 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.356 1.462 . . . . 3.92 111.67 177.206 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 57.6 p30 -65.96 -16.64 64.05 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.277 1.031 . . . . 1.96 110.765 170.903 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m 83.73 11.3 0.43 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.616 2.366 . . . . 2.55 112.472 -179.064 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -111.06 132.34 54.32 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 106.884 -1.524 . . . . 3.05 106.884 164.908 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -95.68 102.46 14.26 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 104.563 -2.384 . . . . 1.38 104.563 163.042 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -100.12 171.36 7.86 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 118.96 0.8 . . . . 3.44 109.88 170.929 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -38.68 -60.33 0.84 Allowed 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.267 1.581 . . . . 4.86 115.267 -155.033 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -70.01 -26.95 64.31 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.567 0.621 . . . . 1.83 112.09 -174.876 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -73.14 -57.53 3.96 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 107.746 -1.205 . . . . 2.26 107.746 176.24 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -50.88 -42.52 59.15 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 124.18 0.992 . . . . 3.3 110.827 177.423 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.433 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 3.1 t90 -40.03 -44.79 1.81 Allowed 'General case' 0 CA--C 1.538 0.509 0 O-C-N 124.131 0.894 . . . . 5.25 109.815 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.4 mtt-85 -43.58 -33.96 1.29 Allowed 'General case' 0 C--O 1.226 -0.169 0 N-CA-C 113.227 0.825 . . . . 4.57 113.227 -178.917 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.3 tp -51.92 -49.62 62.71 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-O 117.616 -1.183 . . . . 0.99 111.388 174.767 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.4 mt -71.31 -36.5 61.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 C-N-CA 124.96 1.304 . . . . 2.23 108.826 179.059 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.431 ' HA2' ' CE2' ' B' ' 77' ' ' TRP . . . -39.22 -56.78 2.24 Favored Glycine 0 C--N 1.344 1.02 0 C-N-CA 126.01 1.767 . . . . 1.74 111.214 170.057 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -74.17 -52.86 11.19 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-N 110.723 -2.738 . . . . 2.72 109.344 179.386 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.48 ' HG ' HD21 ' A' ' 49' ' ' LEU . 2.6 tp -39.25 -56.12 1.57 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.024 1.729 . . . . 2.95 112.517 -172.934 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.65 -33.24 71.28 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.129 0.571 . . . . 1.34 112.504 179.003 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.505 ' CE ' ' HB2' ' B' ' 74' ' ' ASN . 0.7 OUTLIER -73.36 -44.86 57.87 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.868 1.267 . . . . 2.08 110.451 173.782 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -67.42 -16.16 64.08 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 125.173 1.389 . . . . 3.28 113.089 -174.021 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 5.3 tt -58.94 -36.73 63.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 O-C-N 121.435 -0.79 . . . . 1.44 111.076 165.73 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.97 -52.68 3.36 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 126.72 2.008 . . . . 4.5 109.678 -170.404 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.9 tttm . . . . . 0 CA--C 1.53 0.211 0 C-N-CA 125.908 1.683 . . . . 3.76 106.962 163.541 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 6' ' ' LEU . . . . . 0.573 HD12 ' HG3' ' B' ' 10' ' ' GLU . 25.6 mt . . . . . 0 CA--C 1.542 0.638 0 CA-C-O 120.305 0.097 . . . . 3.8 111.234 . . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 9.3 t -95.78 163.75 13.04 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 125.173 1.389 . . . . 2.23 110.457 -176.016 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -48.07 -55.73 9.49 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.568 1.147 . . . . 2.16 112.471 -171.701 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 11.4 mt -58.53 -38.23 77.32 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.419 -0.355 . . . . 1.03 111.358 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 10' ' ' GLU . . . . . 0.573 ' HG3' HD12 ' B' ' 6' ' ' LEU . 1.4 tm-20 -59.92 -60.18 4.24 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 119.056 -0.497 . . . . 5.71 110.474 169.169 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -45.23 -42.16 9.11 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 119.752 1.16 . . . . 4.26 110.645 -176.75 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 22.3 p -64.01 -31.64 72.89 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.12 1.526 . . . . 1.4 115.12 177.082 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 12.6 pt -76.04 -41.28 38.2 Favored 'Isoleucine or valine' 0 C--N 1.344 0.366 0 CA-C-N 121.95 2.159 . . . . 1.44 109.955 164.107 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -47.11 -56.11 7.16 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 121.045 1.748 . . . . 2.88 109.981 -174.004 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 15.3 t -48.22 -43.37 32.06 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.485 1.136 . . . . 1.29 111.733 178.234 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 16' ' ' VAL . . . . . 0.464 HG13 ' CE2' ' B' ' 20' ' ' PHE . 0.5 OUTLIER -72.99 -38.31 55.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 C-N-CA 124.271 1.028 . . . . 1.53 110.126 -177.923 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 69.2 t -61.92 -50.61 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 123.831 0.852 . . . . 1.29 109.303 175.455 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.1 t -61.59 -43.67 98.43 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.839 0.745 . . . . 1.46 110.665 178.486 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 98.7 m -47.95 -58.16 4.77 Favored 'General case' 0 C--N 1.346 0.449 0 CA-C-N 118.595 0.634 . . . . 1.44 109.482 170.354 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 20' ' ' PHE . . . . . 0.464 ' CE2' HG13 ' B' ' 16' ' ' VAL . 16.8 m-30 -55.02 -44.64 74.79 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 112.786 0.662 . . . . 6.31 112.786 178.514 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -60.26 -53.54 56.4 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 119.716 1.144 . . . . 4.42 110.12 -176.815 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 6.7 t -65.87 -40.74 91.92 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 119.52 -0.872 . . . . 3.5 110.08 -179.439 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -62.8 -61.73 2.21 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 121.517 -0.74 . . . . 5.25 111.55 -179.754 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.14 -19.72 65.48 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 125.808 1.643 . . . . 1.0 111.951 -172.409 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.07 -26.86 11.99 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 118.431 -0.795 . . . . 4.17 111.167 169.192 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -39.28 -69.05 0.14 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 115.994 1.85 . . . . 1.86 115.994 -156.742 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -92.14 -77.7 0.43 Allowed 'General case' 0 C--N 1.341 0.206 0 C-N-CA 118.889 -1.125 . . . . 2.85 112.688 -171.289 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.04 161.16 25.39 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 127.929 2.68 . . . . 1.72 110.614 152.959 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.0 ttm180 55.96 102.34 0.01 OUTLIER 'General case' 0 C--O 1.24 0.601 0 N-CA-C 115.116 1.525 . . . . 4.17 115.116 135.719 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.47 6.6 5.49 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 115.135 1.531 . . . . 6.58 115.135 -174.256 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -123.77 11.44 9.07 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.231 0.923 . . . . 4.08 110.961 178.957 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 29.0 p -142.57 142.4 32.17 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 109.321 -0.622 . . . . 1.57 109.321 172.87 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -101.29 154.18 19.0 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.303 -0.999 . . . . 2.24 108.303 167.361 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 68.6 m -136.46 168.72 18.93 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 107.003 -1.48 . . . . 2.41 107.003 173.908 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 10.8 p -84.04 53.9 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 121.725 0.774 . . . . 2.8 111.202 -172.454 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 38.2 t30 -157.21 51.08 0.47 Allowed 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 105.881 -1.896 . . . . 3.07 105.881 150.038 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -168.41 -62.41 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 104.583 -2.377 . . . . 2.08 104.583 -166.897 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -48.61 -49.19 38.0 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.689 0.796 . . . . 2.71 111.036 178.32 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 31.3 tttt -57.44 -29.27 64.05 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.081 0.552 . . . . 2.65 111.586 -177.992 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -70.17 -25.6 63.52 Favored 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 121.535 -0.728 . . . . 4.59 110.587 -174.696 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 14.8 tp -70.16 -43.2 71.34 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 119.015 0.825 . . . . 1.95 109.716 178.016 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 6.0 m -69.89 -41.27 79.57 Favored 'Isoleucine or valine' 0 C--N 1.339 0.147 0 N-CA-C 109.099 -0.704 . . . . 0.64 109.099 -178.501 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 87.6 m -67.42 -60.78 2.3 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 116.029 -0.532 . . . . 0.81 111.071 -178.782 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -82.82 -62.81 1.5 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.839 0.456 . . . . 2.11 111.897 -170.821 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -70.61 -48.2 56.32 Favored 'General case' 0 CA--C 1.528 0.096 0 O-C-N 122.16 -0.338 . . . . 3.89 111.782 -169.651 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 tp -71.58 -19.89 0.44 Allowed Pre-proline 0 CA--C 1.536 0.429 0 N-CA-C 114.666 1.358 . . . . 1.86 114.666 -161.627 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -34.42 -65.92 0.11 Allowed 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 121.895 1.73 . . . . 2.01 114.806 -110.593 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -73.65 -59.6 2.64 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 113.358 0.873 . . . . 2.38 113.358 -158.544 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.673 ' HG ' HD23 ' B' ' 50' ' ' LEU . 29.5 tp 0.53 -85.04 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 127.949 2.499 . . . . 1.43 115.613 176.238 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.673 HD23 ' HG ' ' B' ' 49' ' ' LEU . 0.4 OUTLIER -125.88 64.52 1.21 Allowed 'General case' 0 CA--C 1.522 -0.122 0 N-CA-C 108.05 -1.092 . . . . 2.65 108.05 166.82 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.28 123.31 7.22 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.573 -0.899 . . . . 6.33 108.573 166.995 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -165.96 51.43 0.09 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 105.999 -1.852 . . . . 5.13 105.999 -169.02 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 34.4 m -88.5 -12.25 10.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 113.698 -1.592 . . . . 2.37 111.102 -173.679 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -71.42 -77.19 0.53 Allowed Glycine 0 C--N 1.338 0.669 0 N-CA-C 107.416 -2.274 . . . . 2.68 107.416 165.654 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.1 43.72 0.37 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.863 1.665 . . . . 3.22 112.65 -177.765 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -67.82 -28.48 67.61 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 108.549 -0.908 . . . . 1.17 108.549 169.18 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.9 -53.17 61.42 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.097 0.862 . . . . 4.48 110.044 173.521 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -47.22 -56.06 7.41 Favored 'General case' 0 C--N 1.342 0.259 0 C-N-CA 124.003 0.921 . . . . 2.48 109.508 173.002 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -56.61 -61.46 2.4 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 120.812 -0.355 . . . . 4.65 110.193 -176.999 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -45.03 -55.25 5.74 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 125.242 1.417 . . . . 1.61 110.271 179.766 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -60.98 -41.1 95.79 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 125.168 1.387 . . . . 3.5 110.528 -177.178 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 50.5 m -64.96 -31.7 73.07 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.017 0.527 . . . . 1.85 111.82 175.43 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 mp -74.42 -52.83 10.94 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.809 0.731 . . . . 1.54 111.133 173.357 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.256 19.8 t0 -57.88 -8.62 1.02 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.969 2.907 . . . . 1.66 117.635 -164.451 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 8.8 m -33.6 -18.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.472 1 C-N-CA 132.776 4.431 . . . . 1.4 119.344 -139.8 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.6 -37.75 58.74 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 120.145 1.339 . . . . 2.72 109.616 158.114 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 67.44 68.12 0.38 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 126.744 2.018 . . . . 3.3 108.95 -171.87 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 28.4 p30 -128.03 -10.47 5.38 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.373 1.869 . . . . 1.89 113.494 -172.652 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 17.9 m 72.14 4.04 4.88 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.311 1.444 . . . . 1.86 114.589 -178.578 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 70' ' ' GLU . . . . . 0.407 ' OE1' ' NZ ' ' B' ' 72' ' ' LYS . 1.8 mt-10 -99.12 103.35 15.25 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 106.321 -1.733 . . . . 3.79 106.321 156.245 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.26 94.43 1.19 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 104.331 -2.47 . . . . 1.17 104.331 158.975 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 72' ' ' LYS . . . . . 0.407 ' NZ ' ' OE1' ' B' ' 70' ' ' GLU . 20.6 ttmm -81.78 172.48 13.31 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.973 0.909 . . . . 3.27 110.429 -170.272 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -87.83 56.06 3.73 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.0 -1.063 . . . . 4.61 111.257 177.178 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 74' ' ' ASN . . . . . 0.505 ' HB2' ' CE ' ' A' ' 85' ' ' LYS . 0.5 OUTLIER -161.35 55.72 0.28 Allowed 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 107.32 -1.363 . . . . 2.57 107.32 100.263 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -90.9 -60.97 1.77 Allowed 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 124.741 1.216 . . . . 2.09 108.808 139.562 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -56.77 -37.05 70.55 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 124.09 0.956 . . . . 5.77 112.177 -161.95 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.566 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 1.6 t-105 -45.46 -39.74 7.52 Favored 'General case' 0 C--O 1.219 -0.512 0 O-C-N 123.565 0.541 . . . . 5.5 109.987 175.727 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -39.62 -48.46 2.1 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 120.965 -1.084 . . . . 4.28 112.038 -169.105 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 13.1 tp -49.53 -46.71 48.88 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.421 0.688 . . . . 1.02 111.244 177.445 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 8.5 mm -58.37 -42.25 83.5 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.103 0 C-N-CA 127.284 2.233 . . . . 2.8 108.169 -178.824 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -64.5 -51.18 54.5 Favored Glycine 0 N--CA 1.441 -1.019 0 N-CA-C 109.971 -1.252 . . . . 1.58 109.971 178.166 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -50.89 -47.47 60.59 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 118.235 -0.888 . . . . 2.17 110.712 178.166 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.434 HD23 HD21 ' B' ' 50' ' ' LEU . 22.1 mt -39.14 -54.5 1.75 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.598 1.09 . . . . 1.94 113.214 -178.25 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.78 -26.25 68.62 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.917 1.287 . . . . 1.32 112.143 -176.55 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -80.72 -53.42 6.53 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.131 0.973 . . . . 1.96 109.526 171.648 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 86' ' ' GLU . . . . . 0.451 ' CG ' HD22 ' B' ' 50' ' ' LEU . 4.2 mm-40 -57.6 -40.42 79.03 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.993 0.917 . . . . 2.55 111.718 -171.113 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 10.8 tt -50.01 -36.68 12.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 118.568 0.622 . . . . 1.03 111.885 174.758 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -49.11 11.23 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.518 0.727 . . . . 5.36 109.726 174.774 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 32.2 mttm . . . . . 0 CA--C 1.536 0.442 0 C-N-CA 125.886 1.674 . . . . 5.14 112.144 -166.16 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 . . . . . 0 N--CA 1.451 -0.391 0 N-CA-C 109.093 -0.706 . . . . 4.82 109.093 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -70.54 146.94 56.72 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 121.859 1.706 . . . . 2.73 108.385 175.373 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 51.9 mt -101.15 173.14 6.6 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.256 -1.016 . . . . 1.44 108.256 -176.178 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' THR . . . . . 0.605 HG22 ' OE1' ' A' ' 10' ' ' GLU . 8.9 t -71.14 161.47 31.05 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 120.573 -1.329 . . . . 2.51 110.001 178.548 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -48.34 -43.77 33.72 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 124.072 0.949 . . . . 2.61 111.382 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.424 ' H ' HD12 ' A' ' 9' ' ' LEU . 5.6 mp -63.29 -54.46 36.84 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 109.308 -0.627 . . . . 1.96 109.308 -177.265 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 10' ' ' GLU . . . . . 0.605 ' OE1' HG22 ' A' ' 7' ' ' THR . 81.6 mt-10 -49.64 -57.71 6.67 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.586 1.554 . . . . 2.7 110.898 174.975 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -49.93 -51.13 43.36 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.889 0.876 . . . . 3.59 109.94 177.966 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.8 p -64.3 -47.86 77.86 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.543 -0.723 . . . . 1.61 112.21 -178.124 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.276 2.6 pp -63.13 -31.57 53.15 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 O-C-N 121.131 -0.981 . . . . 1.1 110.283 -179.577 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -65.73 -57.07 8.89 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 120.026 -0.669 . . . . 3.14 109.404 169.281 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -48.38 -43.52 33.92 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.983 0.81 . . . . 1.4 111.616 -171.764 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.4 m -69.75 -39.39 77.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 121.402 -0.811 . . . . 1.03 111.568 177.413 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.8 t -63.73 -48.17 87.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.729 0.812 . . . . 0.99 110.572 177.614 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.7 t -60.89 -44.04 97.66 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 120.981 -1.075 . . . . 0.85 110.741 174.398 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 61.1 m -57.34 -45.08 84.68 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.327 0.967 . . . . 0.77 110.264 176.433 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -53.33 -60.07 3.76 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.178 0.591 . . . . 3.37 110.235 172.4 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -58.76 -48.0 82.74 Favored 'General case' 0 C--O 1.232 0.169 0 O-C-N 121.693 -0.63 . . . . 4.25 112.185 -174.125 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -63.47 -23.11 67.26 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 118.639 -0.696 . . . . 1.92 111.243 -178.186 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -80.05 -42.03 24.54 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 118.462 0.574 . . . . 2.95 111.185 167.78 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.93 -32.19 65.72 Favored 'General case' 0 C--O 1.238 0.474 0 O-C-N 120.68 -1.263 . . . . 1.28 112.579 -175.539 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.255 0.0 OUTLIER -77.14 -15.17 59.64 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.804 1.641 . . . . 3.82 113.971 179.546 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.04 -65.08 0.4 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.457 1.026 . . . . 1.9 112.03 177.248 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -141.21 -175.31 4.29 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 125.72 1.608 . . . . 5.46 109.226 -170.999 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 25.12 92.76 0.01 OUTLIER Glycine 0 C--N 1.341 0.858 0 C-N-CA 127.197 2.332 . . . . 2.39 113.179 157.841 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 62.44 102.01 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.55 1.14 . . . . 5.45 110.35 178.854 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.9 pttt -79.03 50.99 1.09 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.115 1.366 . . . . 6.49 112.074 -166.404 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -172.01 -55.15 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 107.815 -1.18 . . . . 5.6 107.815 -156.839 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.7 p -84.74 153.81 22.81 Favored 'General case' 0 C--O 1.244 0.799 0 C-N-CA 124.058 0.943 . . . . 2.42 110.886 170.486 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -94.67 119.08 32.74 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.094 -1.076 . . . . 2.06 108.094 172.843 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.4 m -82.41 166.28 19.54 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.345 -0.983 . . . . 3.07 108.345 171.778 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.0 t -60.99 -57.96 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 O-C-N 121.139 -0.976 . . . . 2.29 111.275 -171.558 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -61.33 -43.25 99.19 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.096 0.474 . . . . 3.4 110.888 -179.665 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -50.83 -50.6 56.22 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.668 1.187 . . . . 2.52 110.324 176.188 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -62.94 -44.11 96.97 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.829 -0.544 . . . . 3.65 110.933 173.71 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -49.22 -38.81 27.58 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.641 -0.695 . . . . 3.72 111.234 -178.292 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -46.06 -48.76 16.9 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 118.807 0.731 . . . . 2.87 112.085 172.754 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -59.32 -51.37 70.23 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 108.949 -0.76 . . . . 2.47 108.949 -173.167 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.99 -33.66 48.18 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 CA-C-N 115.87 -0.605 . . . . 1.34 110.012 -173.769 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 91.1 m -69.33 -32.77 72.09 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.896 0.878 . . . . 1.23 111.124 174.012 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -81.16 -58.84 2.88 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 125.002 1.321 . . . . 2.57 109.878 -174.392 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -99.95 -135.26 0.29 Allowed 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 108.898 -0.779 . . . . 3.85 108.898 176.322 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' LEU . . . . . 0.451 HD22 ' H ' ' A' ' 46' ' ' LEU . 2.8 mm? 29.98 51.75 0.46 Allowed Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 127.309 2.244 . . . . 2.08 113.949 -170.688 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -66.95 -40.08 12.74 Favored 'Trans proline' 0 N--CA 1.448 -1.201 0 C-N-CA 121.97 1.78 . . . . 1.73 111.175 178.424 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 20.6 t-160 -116.71 -28.05 6.48 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-O 119.216 -0.421 . . . . 4.13 111.636 -165.166 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 tp -64.53 -74.75 0.1 Allowed 'General case' 0 C--O 1.232 0.174 0 CA-C-N 119.481 1.037 . . . . 1.4 110.832 179.903 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 85.2 mt -119.54 83.63 2.07 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.338 1.455 . . . . 2.31 107.362 -174.406 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -178.34 0.31 Allowed 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 114.976 -1.011 . . . . 5.78 109.433 167.626 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 80.97 44.2 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 125.192 1.397 . . . . 4.0 110.053 -179.8 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -59.99 -21.5 22.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 C-N-CA 124.833 1.253 . . . . 3.47 111.188 175.873 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -56.18 -53.97 38.92 Favored Glycine 0 CA--C 1.528 0.899 0 N-CA-C 110.736 -0.945 . . . . 1.66 110.736 169.439 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 56.0 p -80.14 40.71 0.49 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.062 0.931 . . . . 2.88 111.726 -172.132 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -57.21 -36.92 71.46 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 120.811 -1.181 . . . . 1.62 110.501 -172.373 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.09 -34.95 58.9 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.689 0.996 . . . . 4.57 113.689 177.459 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -57.99 -51.97 67.45 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.571 0.701 . . . . 3.15 109.219 174.313 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.75 -51.07 70.89 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.574 -1.269 . . . . 3.68 107.574 -178.694 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -46.35 -60.88 2.06 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 123.922 0.889 . . . . 1.44 109.988 176.93 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -67.32 -28.34 67.91 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.055 0.843 . . . . 4.17 112.396 -176.645 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 49.5 m -61.74 -32.04 72.26 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.647 0.658 . . . . 2.24 111.804 169.543 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 63' ' ' LEU . . . . . 0.485 HD23 ' HB3' ' A' ' 78' ' ' ARG . 12.1 mt -91.24 -64.38 1.13 Allowed 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 124.714 1.206 . . . . 1.72 111.305 -175.52 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -74.48 71.61 1.83 Allowed 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.242 1.417 . . . . 2.15 109.96 -173.803 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -33.1 8.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 124.934 1.294 . . . . 3.39 112.766 -177.507 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -85.14 -10.2 57.0 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.214 1.006 . . . . 2.13 113.095 -179.203 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.86 39.85 26.67 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.862 1.265 . . . . 5.1 110.693 179.372 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 31.0 p30 -88.62 -14.53 37.27 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.006 0.922 . . . . 2.16 109.92 174.993 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.2 m 69.34 15.75 8.43 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.942 1.297 . . . . 1.59 112.974 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -121.66 105.61 10.58 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.609 1.563 . . . . 3.96 107.474 167.24 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.14 109.32 16.34 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 105.976 -1.861 . . . . 1.26 105.976 -175.154 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -85.06 148.54 26.1 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.435 1.094 . . . . 3.46 108.149 177.048 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -39.69 -56.37 1.72 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.012 1.325 . . . . 5.15 114.159 -173.44 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -68.06 -29.08 67.96 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.451 -0.781 . . . . 2.05 112.173 -178.609 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -66.13 -51.36 58.69 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 107.975 -1.12 . . . . 2.19 107.975 173.104 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.98 -44.44 64.02 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.315 1.046 . . . . 6.4 110.395 177.948 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.679 ' CZ2' ' CE2' ' B' ' 77' ' ' TRP . 23.5 t90 -40.63 -38.71 0.92 Allowed 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 117.705 -1.14 . . . . 5.01 113.061 -171.615 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.485 ' HB3' HD23 ' A' ' 63' ' ' LEU . 15.3 ttt180 -39.24 -49.49 1.9 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.61 1.096 . . . . 6.39 111.012 175.805 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 9.6 tp -46.97 -46.47 21.6 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 123.368 0.667 . . . . 0.87 110.27 -177.751 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 53.2 mt -66.31 -33.0 60.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 121.829 0.823 . . . . 1.94 109.319 -174.066 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.56 ' HA2' ' CE2' ' B' ' 77' ' ' TRP . . . -63.6 -48.87 73.65 Favored Glycine 0 CA--C 1.492 -1.373 0 C-N-CA 126.888 2.185 . . . . 1.43 110.073 176.728 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 4.0 mm-40 -69.89 -53.07 19.67 Favored 'General case' 0 N--CA 1.433 -1.298 0 N-CA-C 106.002 -1.851 . . . . 2.42 106.002 -173.976 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mt -40.13 -59.39 1.26 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.913 1.285 . . . . 2.52 111.375 168.835 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.72 -41.35 77.3 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.43 0.692 . . . . 1.16 110.943 -179.485 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -58.92 -52.19 66.79 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 121.896 -0.503 . . . . 1.97 110.184 174.091 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -52.42 -46.31 66.3 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.409 1.883 . . . . 2.31 110.288 -168.143 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.8 tt -53.77 -29.99 18.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 N-CA-C 112.52 0.563 . . . . 1.48 112.52 178.246 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -88.68 -45.48 9.79 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.109 0.964 . . . . 6.12 111.25 174.15 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.3 tttt . . . . . 0 CA--C 1.535 0.404 0 C-N-CA 128.233 2.613 . . . . 3.48 114.299 -165.124 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.3 mt . . . . . 0 CA--C 1.548 0.869 0 CA-C-O 119.153 -0.451 . . . . 3.06 109.821 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 7' ' ' THR . . . . . 0.485 HG23 ' N ' ' B' ' 8' ' ' GLU . 4.0 t -69.13 -70.56 0.27 Allowed 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 115.221 1.563 . . . . 2.36 115.221 -165.766 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 8' ' ' GLU . . . . . 0.485 ' N ' HG23 ' B' ' 7' ' ' THR . 28.4 tt0 -171.93 -73.45 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.411 1.484 . . . . 2.39 108.334 -168.094 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 17.4 mt -56.47 -41.24 76.23 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.574 -1.328 . . . . 1.05 110.064 167.798 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 10' ' ' GLU . . . . . 0.446 ' CG ' HG22 ' B' ' 7' ' ' THR . 78.4 mt-10 -54.59 -41.8 70.33 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.52 0.728 . . . . 3.51 111.319 171.964 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -63.42 -43.54 97.2 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 120.891 -1.131 . . . . 4.31 110.43 173.974 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.2 t -59.58 -45.42 91.92 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.305 0.642 . . . . 1.83 110.624 -178.259 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.8 pp -66.46 -38.0 80.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 118.151 0.432 . . . . 1.0 110.4 172.869 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -56.09 -60.34 3.63 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-O 117.894 -1.051 . . . . 2.73 109.764 178.929 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.1 t -56.93 -28.82 62.51 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 120.182 1.355 . . . . 1.24 113.455 -170.516 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 27.2 m -81.05 -44.66 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 O-C-N 121.426 -0.797 . . . . 0.89 109.626 -178.669 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 85.9 t -54.38 -35.46 30.95 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.407 0 N-CA-C 108.405 -0.961 . . . . 1.12 108.405 165.748 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . 2.238 1.5 t -54.59 -63.76 1.05 Allowed 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 126.543 1.937 . . . . 3.29 110.834 -178.72 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 49.8 m -51.32 -59.66 3.98 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 110.805 -2.907 . . . . 1.02 110.166 176.598 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -58.91 -54.55 45.81 Favored 'General case' 0 C--O 1.223 -0.331 0 O-C-N 122.108 -0.37 . . . . 6.89 110.815 -178.946 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -57.72 -45.76 85.32 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.895 1.278 . . . . 3.17 111.768 -176.52 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 2.7 t -65.72 -52.9 47.54 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.082 -0.71 . . . . 3.09 109.082 177.158 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -55.5 -38.95 69.84 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.696 0.76 . . . . 3.54 111.046 -179.031 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.93 -24.2 36.43 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.153 2.181 . . . . 1.14 110.6 -179.42 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -19.24 34.67 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 117.844 -1.074 . . . . 4.18 111.841 175.783 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.435 ' HB3' ' HG3' ' B' ' 37' ' ' GLU . 0.5 OUTLIER -50.57 -67.52 0.25 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.881 1.067 . . . . 2.11 113.881 -160.96 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 68.4 mt-10 -90.14 -44.48 9.75 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 125.931 1.692 . . . . 3.72 111.977 -179.091 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.5 -143.48 1.12 Allowed Glycine 0 CA--C 1.536 1.36 0 CA-C-N 115.269 -0.878 . . . . 3.75 113.546 -166.052 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 16.2 mtt-85 50.35 99.45 0.01 OUTLIER 'General case' 0 C--O 1.237 0.404 1 C-N-CA 131.755 4.022 . . . . 3.58 112.464 27.349 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 10.4 ptpp? -66.42 -177.72 0.59 Allowed 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 119.092 -1.043 . . . . 3.85 109.195 148.946 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 9.1 t70 78.31 -59.83 0.42 Allowed 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 127.593 2.357 . . . . 4.15 109.846 179.809 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 25.8 p -88.12 134.66 33.71 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.471 0.653 . . . . 1.85 110.201 175.857 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.14 141.89 32.71 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 106.84 -1.541 . . . . 2.2 106.84 167.056 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 4.5 t -92.79 -172.32 2.99 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 125.086 1.354 . . . . 2.21 109.998 165.771 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 35' ' ' VAL . . . . . 0.408 ' C ' ' H ' ' B' ' 37' ' ' GLU . 70.9 t -67.53 -112.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.431 2 N-CA-C 99.47 -4.27 . . . . 3.52 99.47 -179.354 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.75 53.78 0.75 Allowed 'General case' 0 CA--C 1.556 1.202 0 CA-C-N 123.505 2.866 . . . . 2.9 112.136 -172.171 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.435 ' HG3' ' HB3' ' B' ' 26' ' ' GLN . 3.3 tt0 -105.4 -58.0 1.96 Allowed 'General case' 0 N--CA 1.448 -0.552 1 C-N-CA 132.292 4.237 . . . . 1.66 104.099 150.38 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -57.68 -40.16 78.8 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.716 0.806 . . . . 2.17 110.161 -178.767 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.7 ttpm? -58.02 -37.06 73.6 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 119.126 -1.03 . . . . 4.63 109.981 179.647 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -73.83 -25.58 60.16 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 116.413 -0.358 . . . . 4.9 110.687 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 tt -67.57 -48.76 65.98 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.484 -0.932 . . . . 2.69 108.484 172.558 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 2.1 m -65.24 -51.09 69.51 Favored 'Isoleucine or valine' 0 C--N 1.34 0.166 0 N-CA-C 109.344 -0.613 . . . . 1.12 109.344 -177.858 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 94.6 m -51.31 -56.6 12.18 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.722 0.809 . . . . 0.89 111.576 176.557 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -80.87 -54.37 5.65 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.757 0.28 . . . . 1.77 111.757 -169.612 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 26.5 mm100 -80.11 -40.23 27.92 Favored 'General case' 0 C--O 1.227 -0.131 0 N-CA-C 113.573 0.953 . . . . 3.57 113.573 -164.64 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.62 -41.89 92.01 Favored Pre-proline 0 N--CA 1.467 0.393 0 CA-C-N 118.937 0.79 . . . . 2.08 112.47 -168.237 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -70.61 -54.4 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.926 0 N-CA-C 107.631 -1.719 . . . . 2.63 107.631 -41.91 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 50.7 t60 -66.44 -43.62 85.11 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.786 1.234 . . . . 3.48 112.046 -175.311 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 27.0 tp -33.85 -62.96 0.28 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.123 1.769 . . . . 1.36 113.257 -168.635 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 50' ' ' LEU . . . . . 0.495 ' CD1' HD11 ' B' ' 79' ' ' LEU . 35.2 mt -81.34 97.59 7.77 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 107.76 -1.2 . . . . 1.69 107.76 167.152 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -49.44 145.07 5.02 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.081 -0.711 . . . . 6.05 109.081 171.065 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 40.7 t0 63.38 60.19 1.17 Allowed 'General case' 0 C--N 1.339 0.134 0 CA-C-O 123.987 1.851 . . . . 4.31 109.191 171.29 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 33.7 m -56.07 -21.27 11.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 112.36 -2.2 . . . . 2.08 111.245 164.142 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -64.34 -60.52 7.0 Favored Glycine 0 C--N 1.341 0.82 0 C-N-CA 124.455 1.026 . . . . 2.97 111.378 178.367 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.2 t -77.21 66.68 3.04 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 122.396 1.094 . . . . 2.71 109.675 -175.846 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.09 -34.88 71.56 Favored 'General case' 0 N--CA 1.44 -0.926 0 C-N-CA 125.274 1.43 . . . . 1.3 109.917 -174.162 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -18.08 -70.35 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 127.128 2.171 . . . . 4.19 115.508 167.194 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -38.77 78.67 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.705 1.139 . . . . 3.21 111.635 -175.676 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.98 -60.08 4.35 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.203 -1.036 . . . . 3.56 108.203 172.734 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -46.16 -51.43 14.11 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-N 118.962 0.801 . . . . 2.26 110.982 -178.36 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -63.0 -42.21 99.79 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.74 -0.6 . . . . 3.55 111.954 178.827 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 24.8 t -61.16 -39.67 90.97 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.7 0.682 . . . . 2.3 111.828 174.763 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 63' ' ' LEU . . . . . 0.438 HD23 ' HB2' ' B' ' 78' ' ' ARG . 34.4 mt -80.83 -61.19 2.04 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.478 1.111 . . . . 1.64 110.669 -171.822 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -71.11 -10.12 59.22 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 128.888 2.875 . . . . 2.94 115.101 -162.636 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -37.72 -19.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 C-N-CA 131.143 3.777 . . . . 3.99 117.441 -160.698 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -61.12 -19.42 61.48 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 120.192 1.36 . . . . 2.76 111.747 171.845 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 101.16 -25.3 0.02 OUTLIER 'General case' 0 C--N 1.343 0.309 0 C-N-CA 127.605 2.362 . . . . 3.62 111.32 166.982 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -61.62 139.32 58.29 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 118.457 -1.297 . . . . 2.99 107.546 164.848 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 1.7 p -78.33 12.9 1.71 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 127.929 2.492 . . . . 3.28 112.987 -179.576 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -87.63 116.76 25.98 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 104.389 -2.449 . . . . 3.26 104.389 162.839 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.05 90.59 0.09 Allowed 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 104.924 -2.25 . . . . 1.85 104.924 157.463 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 36.6 tptt -80.02 168.45 19.17 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.331 -0.989 . . . . 4.94 108.331 -165.564 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -91.61 61.02 4.17 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.22 -0.659 . . . . 4.64 109.22 175.627 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -154.89 50.94 0.6 Allowed 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 119.096 -1.042 . . . . 3.9 112.661 87.203 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -86.42 -55.92 3.67 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.691 1.597 . . . . 2.2 108.288 153.798 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -50.62 -39.95 51.59 Favored 'General case' 0 C--N 1.344 0.354 0 C-N-CA 123.021 0.528 . . . . 5.91 110.427 -174.377 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.679 ' CE2' ' CZ2' ' A' ' 77' ' ' TRP . 27.8 t90 -47.44 -38.49 13.62 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 123.651 0.781 . . . . 4.0 111.206 -179.808 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 78' ' ' ARG . . . . . 0.438 ' HB2' HD23 ' B' ' 63' ' ' LEU . 54.5 mtp85 -43.05 -38.79 2.45 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.681 1.193 . . . . 4.31 111.716 177.079 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 79' ' ' LEU . . . . . 0.495 HD11 ' CD1' ' B' ' 50' ' ' LEU . 13.7 tp -51.62 -47.45 63.66 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 117.915 0.325 . . . . 0.86 111.05 177.686 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 65.3 mt -65.74 -26.04 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 109.133 -0.691 . . . . 1.73 109.133 -176.252 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.574 ' N ' ' CZ2' ' A' ' 77' ' ' TRP . . . -67.15 -51.64 37.43 Favored Glycine 0 CA--C 1.501 -0.829 0 C-N-CA 126.907 2.194 . . . . 1.78 108.112 176.104 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -51.99 -60.95 2.59 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.168 -1.049 . . . . 4.39 108.168 169.411 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.4 mt -48.09 -51.96 22.33 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 120.526 1.512 . . . . 2.49 113.121 -175.701 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.0 -33.93 62.99 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.26 1.024 . . . . 1.91 110.548 178.647 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.89 -56.39 5.8 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 117.284 -1.341 . . . . 1.98 111.423 165.538 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -52.73 -36.15 57.17 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 120.295 1.407 . . . . 2.54 112.894 -164.092 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 3.0 tt -55.61 -38.2 49.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 O-C-N 121.598 -0.689 . . . . 0.99 111.446 175.222 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -84.06 -61.66 1.76 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.248 1.419 . . . . 6.58 113.463 169.949 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 10.8 pttp . . . . . 0 C--O 1.223 -0.302 0 O-C-N 120.804 -1.185 . . . . 6.51 111.83 -169.555 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 . . . . . 0 N--CA 1.444 -0.728 0 N-CA-C 108.82 -0.807 . . . . 4.44 108.82 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -67.53 141.98 57.49 Favored 'Trans proline' 0 N--CA 1.45 -1.079 0 N-CA-C 107.522 -1.761 . . . . 2.25 107.522 171.028 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.6 mt -96.84 173.9 7.07 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 107.4 -1.333 . . . . 1.33 107.4 179.324 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.9 t -72.47 166.63 22.23 Favored 'General case' 0 CA--C 1.529 0.173 0 O-C-N 120.804 -1.185 . . . . 1.85 110.534 -177.824 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -52.8 -57.42 10.23 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.961 0.886 . . . . 2.19 111.39 -169.019 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 mt -66.63 -31.2 71.74 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 117.436 -1.269 . . . . 1.64 112.08 178.679 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 77.6 mt-10 -55.67 -55.97 25.95 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.84 1.654 . . . . 1.95 110.92 168.482 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -48.56 -51.44 27.7 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 122.028 0.918 . . . . 3.39 109.18 174.748 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.2 t -60.01 -53.58 56.15 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.279 -0.873 . . . . 1.83 112.42 -173.787 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.356 0.1 OUTLIER -71.29 -33.24 49.8 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 119.404 1.002 . . . . 1.45 110.415 -178.584 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -53.44 -53.3 53.25 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.081 0.855 . . . . 2.67 109.693 173.293 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.5 t -59.22 -25.38 63.96 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.953 1.094 . . . . 1.49 113.953 -173.686 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.7 m -81.24 -42.22 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 120.286 1.403 . . . . 0.65 110.776 169.498 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.1 t -56.05 -46.05 80.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 123.89 0.876 . . . . 0.74 111.018 179.62 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.3 t -60.65 -47.08 87.82 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.174 0.897 . . . . 0.76 110.632 177.309 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.3 m -58.26 -47.12 84.59 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.358 -0.839 . . . . 0.83 110.073 179.275 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.455 ' CZ ' HD23 ' A' ' 33' ' ' LEU . 7.6 t80 -52.34 -56.98 11.27 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.566 1.146 . . . . 3.01 110.696 171.171 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -68.62 -39.56 80.77 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 123.91 0.884 . . . . 2.66 110.928 -166.506 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.3 p -57.92 -60.35 3.85 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.621 -0.881 . . . . 2.46 108.621 169.762 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -49.04 -41.39 34.8 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 118.874 0.761 . . . . 3.0 113.044 -179.75 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.68 -25.75 19.57 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 127.037 2.135 . . . . 1.1 111.711 -174.774 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -34.1 70.73 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.999 1.32 . . . . 4.15 112.367 176.575 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -52.85 -52.03 58.73 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-O 121.642 0.734 . . . . 1.98 112.53 -157.323 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -119.34 165.3 14.48 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 127.839 2.456 . . . . 2.7 105.923 176.033 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 9.19 106.98 0.0 OUTLIER Glycine 0 CA--C 1.536 1.372 0 C-N-CA 126.798 2.142 . . . . 1.46 115.768 165.593 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? 66.38 105.41 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.848 1.259 . . . . 5.88 113.904 165.552 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.3 pttp -65.29 63.99 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.499 0.72 . . . . 3.53 111.245 164.529 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -171.67 -53.59 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 126.9 2.08 . . . . 3.68 106.965 -175.987 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 m -84.4 128.0 34.33 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 124.345 1.058 . . . . 2.58 109.803 174.283 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.455 HD23 ' CZ ' ' A' ' 20' ' ' PHE . 2.2 mm? -82.56 145.88 29.49 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 107.378 -1.342 . . . . 2.59 107.378 172.499 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.3 m -121.02 164.47 16.71 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 125.179 1.392 . . . . 4.23 107.815 -169.183 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.7 p -68.94 -36.16 72.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 O-C-N 120.707 -1.245 . . . . 2.63 112.193 -167.819 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -69.26 -48.84 60.65 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 107.551 -1.277 . . . . 1.99 107.551 179.648 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -44.74 -54.66 6.04 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.911 0.884 . . . . 1.95 111.021 171.396 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -51.22 -57.03 9.89 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.67 -0.695 . . . . 2.76 110.498 177.637 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.536 ' HE3' HD12 ' A' ' 56' ' ' LEU . 17.0 ttmt -59.52 -42.02 91.28 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.249 0.477 . . . . 3.82 111.874 179.785 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -56.83 -39.7 74.69 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.277 -0.89 . . . . 2.48 110.452 176.946 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -63.41 -47.33 82.41 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 108.024 -1.102 . . . . 2.09 108.024 -174.846 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.53 -54.24 27.76 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 N-CA-C 109.995 -0.372 . . . . 0.88 109.995 -179.103 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 92.3 m -50.0 -48.31 52.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.745 1.218 . . . . 1.13 110.877 -179.717 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -76.74 -45.41 29.31 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.35 0.66 . . . . 2.4 110.862 -174.643 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -135.01 10.67 3.58 Favored 'General case' 0 C--N 1.343 0.311 0 N-CA-C 116.527 2.047 . . . . 3.51 116.527 -161.214 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -120.47 69.89 16.25 Favored Pre-proline 0 N--CA 1.469 0.517 0 CA-C-N 121.133 1.788 . . . . 1.87 109.567 164.1 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.28 -39.86 9.39 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 123.242 2.628 . . . . 1.8 111.391 -178.171 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -97.95 -50.38 4.43 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 118.476 0.58 . . . . 3.83 109.749 -177.442 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.53 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 0.9 OUTLIER -55.47 -64.56 0.81 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 121.361 0.601 . . . . 1.79 111.673 -167.914 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.402 ' C ' ' H ' ' A' ' 52' ' ' ASP . 84.6 mt -116.99 56.52 0.81 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.861 1.265 . . . . 2.97 108.375 -171.326 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.3 31.94 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.262 1.425 . . . . 5.21 112.776 171.394 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 52' ' ' ASP . . . . . 0.402 ' H ' ' C ' ' A' ' 50' ' ' LEU . 33.5 t70 -110.88 29.45 7.75 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 127.899 2.48 . . . . 4.87 108.174 -175.376 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 27.7 m -56.93 -30.02 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 123.588 0.755 . . . . 2.75 111.758 -173.215 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -56.91 -38.29 83.62 Favored Glycine 0 CA--C 1.532 1.154 0 N-CA-C 111.277 -0.729 . . . . 2.39 111.277 174.058 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.8 m -110.86 46.69 1.04 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.299 1.839 . . . . 2.06 109.054 178.759 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 56' ' ' LEU . . . . . 0.536 HD12 ' HE3' ' A' ' 39' ' ' LYS . 3.0 tm? -77.39 -50.54 12.53 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.561 1.144 . . . . 1.21 110.127 171.809 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -64.6 -37.15 86.58 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.426 -0.796 . . . . 5.01 110.694 -162.999 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.59 -40.74 84.04 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.749 0.82 . . . . 4.01 111.664 167.705 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -49.66 77.02 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 107.524 -1.287 . . . . 2.95 107.524 173.789 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.57 -52.19 31.76 Favored 'General case' 0 C--O 1.226 -0.18 0 N-CA-C 109.183 -0.673 . . . . 2.34 109.183 177.996 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -55.0 -45.37 75.05 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 122.395 0.278 . . . . 3.51 110.651 177.178 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.8 t -60.57 -41.76 95.27 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 122.081 -0.387 . . . . 2.44 111.776 179.717 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.5 mp -70.43 -53.15 17.59 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 118.515 0.598 . . . . 1.69 110.042 177.959 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -73.44 75.5 1.42 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.71 0.804 . . . . 2.0 109.342 179.079 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 25.8 m -50.34 -27.67 4.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 124.211 1.004 . . . . 2.23 112.591 179.322 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -77.42 -30.74 53.6 Favored 'General case' 0 CA--C 1.529 0.16 0 O-C-N 121.933 -0.48 . . . . 2.32 111.505 179.106 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 58.39 52.86 6.79 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.868 1.267 . . . . 4.62 109.534 -163.382 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.6 p30 -108.98 -13.25 14.76 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.676 1.991 . . . . 2.57 112.617 -179.362 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.6 m 74.71 2.99 4.17 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.486 1.914 . . . . 2.27 114.161 -176.136 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -86.0 115.95 23.92 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 105.936 -1.876 . . . . 4.13 105.936 152.949 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.27 84.28 7.15 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 102.576 -3.12 . . . . 1.42 102.576 154.26 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.36 155.0 15.52 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 107.774 -1.195 . . . . 5.38 107.774 177.727 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -39.83 -54.69 2.09 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.009 0.924 . . . . 5.3 112.337 -175.685 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -65.08 -31.95 73.41 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.692 0.797 . . . . 3.0 113.041 -179.833 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -70.03 -60.95 1.98 Allowed 'General case' 0 C--O 1.233 0.191 0 N-CA-C 108.377 -0.972 . . . . 2.01 108.377 174.712 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -49.64 -44.09 47.32 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 124.864 1.266 . . . . 3.03 111.065 -178.588 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.408 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.6 OUTLIER -40.02 -40.79 1.11 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 116.235 -1.841 . . . . 5.08 110.125 178.977 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.76 -44.33 3.2 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 121.758 2.072 . . . . 6.45 111.85 -178.267 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 79' ' ' LEU . . . . . 0.478 ' O ' HD13 ' A' ' 83' ' ' LEU . 12.4 tp -53.3 -49.38 67.11 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.502 1.046 . . . . 0.86 111.371 179.663 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 60.7 mt -73.65 -37.4 49.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 125.536 1.534 . . . . 1.71 108.1 -174.925 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -42.98 -58.32 3.76 Favored Glycine 0 N--CA 1.44 -1.036 0 N-CA-C 109.66 -1.376 . . . . 1.56 109.66 165.165 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 82' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 46.3 mm-40 -79.91 -36.05 37.0 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 127.607 2.363 . . . . 2.42 110.153 -160.928 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.53 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 4.9 mp -39.19 -54.93 1.73 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.938 0.895 . . . . 2.45 110.252 170.014 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.13 -24.85 66.58 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.341 1.056 . . . . 1.04 113.449 -178.518 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' A' ' 82' ' ' GLU . 16.7 ttpp -82.76 -50.59 8.52 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.731 1.213 . . . . 1.53 110.737 173.14 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -56.4 -40.18 74.23 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 125.666 1.586 . . . . 2.76 111.852 -174.542 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 10.3 tt -44.68 -29.07 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 N-CA-C 113.291 0.849 . . . . 1.5 113.291 175.376 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -101.76 -63.01 1.19 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.546 0.739 . . . . 4.43 109.785 166.995 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.9 tttt . . . . . 0 CA--C 1.533 0.292 0 N-CA-C 113.892 1.071 . . . . 3.38 113.892 -164.356 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.549 0.922 0 CA-C-O 118.72 -0.657 . . . . 2.66 111.519 . . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 5.2 t -90.54 -174.97 4.29 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.336 1.054 . . . . 2.19 113.581 -173.65 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -46.77 -73.9 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.287 2.235 . . . . 3.22 112.67 -172.872 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 25.9 mt -55.42 -37.67 67.97 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 121.236 -0.915 . . . . 1.22 111.297 179.359 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -59.76 -36.22 76.22 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 122.779 0.432 . . . . 3.69 111.013 173.572 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -66.13 -46.99 75.58 Favored 'General case' 0 C--N 1.344 0.351 0 O-C-N 120.135 -1.603 . . . . 3.99 109.155 172.077 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -56.27 -42.8 78.03 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.099 0.559 . . . . 1.34 110.287 -175.778 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.263 2.5 pp -70.6 -42.7 78.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 O-C-N 121.622 -0.674 . . . . 0.97 111.033 171.721 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -54.71 -42.41 71.47 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.607 1.094 . . . . 4.34 112.07 179.127 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.1 t -63.18 -31.6 72.79 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.109 -0.994 . . . . 1.23 112.096 -177.919 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 m -80.15 -36.76 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 O-C-N 120.899 -1.125 . . . . 0.96 109.916 173.866 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 58.8 t -57.77 -45.0 87.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 C-N-CA 122.937 0.495 . . . . 1.14 110.343 176.235 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 14.1 t -67.85 -40.42 83.67 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.699 0.682 . . . . 1.27 110.729 177.988 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 51.5 m -55.64 -52.29 64.3 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-N 119.038 0.835 . . . . 1.13 108.891 174.076 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -48.41 -55.63 10.31 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.229 1.411 . . . . 4.52 111.318 171.887 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -56.33 -56.65 18.48 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.05 0.94 . . . . 3.09 109.554 -175.262 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 36.7 p -61.61 -44.79 96.35 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.256 0.622 . . . . 2.32 110.705 -177.576 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -57.64 -61.38 2.55 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.533 1.133 . . . . 5.43 111.008 177.376 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.8 -19.6 51.65 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.668 1.987 . . . . 1.22 111.678 176.656 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . 2.318 0.0 OUTLIER -46.68 -19.1 0.08 Allowed 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 127.956 2.502 . . . . 5.24 113.481 162.368 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -52.07 -64.06 0.94 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 114.101 1.149 . . . . 2.19 114.101 -175.838 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -73.68 -31.6 63.52 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 116.512 2.041 . . . . 5.35 116.512 -154.63 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.22 -111.35 0.43 Allowed Glycine 0 CA--C 1.53 1.013 1 C-N-CA 132.384 4.802 . . . . 3.98 116.075 9.579 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 49.5 ttt85 53.75 98.49 0.01 OUTLIER 'General case' 0 C--O 1.237 0.4 0 C-N-CA 126.512 1.925 . . . . 4.29 112.25 -175.9 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.32 -39.24 93.51 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 121.061 0.458 . . . . 5.09 111.109 177.329 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -75.06 2.33 10.9 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 113.109 0.781 . . . . 3.93 113.109 -171.02 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 1.6 m -154.93 144.21 21.15 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 118.956 0.798 . . . . 2.81 110.657 -177.309 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 33' ' ' LEU . . . . . 0.428 HD13 ' CG ' ' B' ' 76' ' ' TYR . 4.8 mp -131.64 141.31 49.59 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.164 0.985 . . . . 2.78 108.932 178.645 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 8.2 t -108.67 177.24 4.84 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.662 0.744 . . . . 3.02 109.773 168.628 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 10.3 p -84.44 53.77 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.118 0 CA-C-O 122.283 1.039 . . . . 2.51 109.878 177.044 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -155.99 54.33 0.58 Allowed 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 104.825 -2.287 . . . . 3.15 104.825 149.387 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -163.56 -60.42 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 102.403 -3.184 . . . . 2.33 102.403 175.882 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -41.26 -58.08 1.93 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.53 1.132 . . . . 2.94 113.602 -179.129 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 11.9 ttmm -54.78 -30.55 57.1 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.456 0.702 . . . . 2.57 112.42 -179.277 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -65.0 -25.5 67.89 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 121.083 -1.011 . . . . 3.04 110.898 -173.707 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.69 -49.54 62.23 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.27 0.941 . . . . 2.62 108.92 179.272 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 15.3 m -66.67 -38.16 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 115.337 -0.847 . . . . 0.8 109.142 -175.704 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 72.5 m -63.53 -54.37 37.31 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.767 0.827 . . . . 0.97 111.323 175.503 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -80.79 -62.33 1.7 Allowed 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 112.199 0.444 . . . . 2.25 112.199 -164.424 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -80.94 -43.72 19.32 Favored 'General case' 0 C--O 1.226 -0.148 0 O-C-N 122.144 -0.348 . . . . 2.48 110.687 -170.677 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 6.6 mp -81.71 -18.89 0.27 Allowed Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 119.171 3.026 . . . . 2.48 119.171 -161.523 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -52.05 89.56 0.03 OUTLIER 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.396 2.731 . . . . 3.12 114.104 -145.787 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 154.36 -65.06 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 129.656 3.182 . . . . 3.95 106.579 -175.098 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 52.7 tp -49.13 -73.37 0.04 OUTLIER 'General case' 0 C--O 1.235 0.304 0 C-N-CA 123.649 0.78 . . . . 1.07 109.445 -164.801 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.3 mt -74.01 131.85 41.78 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.002 -1.851 . . . . 2.02 106.002 147.029 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.49 168.46 12.55 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 104.333 -2.469 . . . . 6.56 104.333 167.864 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 52' ' ' ASP . . . . . 0.408 ' OD2' ' NZ ' ' B' ' 59' ' ' LYS . 8.8 t0 61.3 84.21 0.14 Allowed 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 124.493 1.12 . . . . 3.56 108.349 -152.599 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 27.3 m -89.13 4.15 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 CA-C-N 114.061 -1.427 . . . . 1.63 109.712 165.649 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.79 -71.48 1.27 Allowed Glycine 0 C--N 1.341 0.854 0 N-CA-C 108.215 -1.954 . . . . 2.35 108.215 -173.55 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 1.5 t -77.01 64.17 2.44 Favored 'General case' 0 CA--C 1.528 0.096 0 C-N-CA 125.518 1.527 . . . . 2.61 107.671 177.583 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -75.25 -27.74 59.59 Favored 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 126.35 1.86 . . . . 0.99 108.845 178.235 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -42.24 -48.84 4.98 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.256 1.822 . . . . 4.33 112.143 170.336 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -45.87 -54.4 8.2 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.369 1.468 . . . . 3.26 110.723 174.872 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 59' ' ' LYS . . . . . 0.455 ' H ' ' HE2' ' B' ' 59' ' ' LYS . 1.6 mppt? -67.93 -55.51 12.48 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 107.363 -1.347 . . . . 3.93 107.363 -177.912 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -40.87 -56.17 2.29 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 125.207 1.403 . . . . 2.02 110.966 -179.973 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -61.27 -42.04 97.96 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 117.8 0.273 . . . . 2.77 111.404 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 21.4 m -59.44 -32.1 69.9 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.065 0.394 . . . . 1.51 112.065 176.871 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 mp -76.65 -57.2 3.99 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.463 0.574 . . . . 2.12 111.076 172.134 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -59.63 -16.19 24.32 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.348 1.859 . . . . 1.74 113.557 -162.397 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.7 m -32.01 -26.33 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 129.848 3.259 . . . . 1.51 119.007 -132.885 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -54.3 -31.32 53.77 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 120.497 1.499 . . . . 2.51 111.314 159.025 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 70.57 68.89 0.2 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.814 1.246 . . . . 2.95 111.077 166.44 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 41.5 p30 -121.14 -7.23 9.4 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.845 1.258 . . . . 1.89 112.497 -177.816 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 18.8 m 72.13 15.48 5.46 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.239 1.415 . . . . 2.14 112.789 -176.567 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -115.76 106.19 13.57 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 127.152 2.181 . . . . 3.94 107.386 164.778 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -83.49 90.12 7.17 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 106.505 -1.665 . . . . 0.98 106.505 167.004 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 31.3 pttt -84.75 174.2 10.08 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.049 0.94 . . . . 4.23 111.37 179.078 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 23.3 p90 -84.67 49.35 1.69 Allowed 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.75 1.019 . . . . 5.51 113.75 -168.424 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -172.03 58.36 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.529 1.531 . . . . 2.95 108.866 116.96 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -87.11 -59.13 2.34 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 106.758 -1.571 . . . . 2.05 106.758 124.182 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 76' ' ' TYR . . . . . 0.428 ' CG ' HD13 ' B' ' 33' ' ' LEU . 53.7 t80 -42.27 -50.94 4.92 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 125.51 1.524 . . . . 3.22 115.044 -168.333 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.444 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 0.0 OUTLIER -45.88 -35.39 4.5 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-O 117.918 -1.039 . . . . 4.64 109.621 -177.835 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 8.0 mmt180 -35.77 -55.26 0.72 Allowed 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 117.66 -1.162 . . . . 3.89 111.087 -178.159 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.4 tp -48.31 -46.98 36.94 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 120.276 1.398 . . . . 0.84 112.203 -177.369 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 64.3 mt -72.87 -39.75 59.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 C-N-CA 125.154 1.382 . . . . 1.87 107.965 -176.965 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -45.93 -53.19 9.08 Favored Glycine 0 N--CA 1.446 -0.638 0 CA-C-O 122.908 1.282 . . . . 2.33 110.864 170.254 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -75.3 -47.77 26.28 Favored 'General case' 0 N--CA 1.438 -1.029 0 C-N-CA 126.734 2.014 . . . . 3.47 107.199 -166.847 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mp -38.85 -47.15 1.38 Allowed 'General case' 0 C--N 1.34 0.171 0 C-N-CA 125.305 1.442 . . . . 2.09 111.138 172.929 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -45.61 -46.16 14.22 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.448 -0.787 . . . . 1.76 111.379 178.548 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.453 0.0 OUTLIER -83.74 -34.72 24.8 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 116.285 1.957 . . . . 2.01 116.285 166.033 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -59.45 -18.92 43.59 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 121.215 1.825 . . . . 3.85 113.052 -176.593 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 6.9 tp -41.51 -51.54 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 O-C-N 121.894 -0.504 . . . . 1.76 110.732 163.468 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -86.22 -48.69 8.33 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.681 1.593 . . . . 4.4 113.441 171.137 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 46.2 tttp . . . . . 0 CA--C 1.537 0.475 0 C-N-CA 124.476 1.11 . . . . 4.32 111.991 -163.853 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 . . . . . 0 CA--C 1.539 0.547 0 N-CA-C 108.116 -1.068 . . . . 5.73 108.116 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -72.71 88.34 0.91 Allowed 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 122.814 2.343 . . . . 3.39 110.066 -175.908 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 87.6 mt -64.3 137.02 57.7 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 107.36 -1.348 . . . . 1.42 107.36 170.912 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.9 t -65.47 169.07 6.42 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.403 -0.591 . . . . 1.94 109.403 176.72 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.1 tt0 -59.23 -48.28 82.22 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 121.586 0.708 . . . . 3.7 109.561 -175.896 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.4 mp -57.98 -45.7 86.32 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 118.245 -0.883 . . . . 1.64 110.267 -179.307 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -57.81 -53.33 59.48 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.09 0.956 . . . . 2.12 111.34 174.824 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.84 -49.35 75.69 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 108.827 -0.805 . . . . 5.19 108.827 -176.1 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 70.7 p -68.81 -44.42 73.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.097 -0.501 . . . . 1.33 110.994 -175.141 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.483 HG21 HD12 ' B' ' 83' ' ' LEU 0.257 2.5 pp -63.59 -36.94 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 C-N-CA 118.441 -1.304 . . . . 0.81 109.809 176.797 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -59.04 -50.37 74.35 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.462 1.028 . . . . 3.22 110.187 173.031 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.73 -38.34 78.16 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.366 0.603 . . . . 1.29 111.921 -175.143 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 10.8 m -78.27 -36.98 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 O-C-N 120.54 -1.35 . . . . 0.77 111.012 174.302 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 t -59.01 -41.89 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-N 119.427 1.012 . . . . 0.78 110.481 177.359 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.6 t -65.22 -41.88 93.97 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.015 0.825 . . . . 0.92 110.466 176.604 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 22.4 m -61.98 -47.83 83.05 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.659 0.663 . . . . 0.92 109.907 177.929 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -48.45 -56.77 7.36 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 124.449 1.1 . . . . 3.19 109.883 169.075 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -62.72 -45.44 92.75 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.338 0.655 . . . . 3.95 111.737 -171.467 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.24 -25.88 68.06 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 122.269 -0.269 . . . . 2.23 110.775 179.823 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -80.2 -39.64 28.79 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 118.354 0.524 . . . . 2.57 112.262 164.798 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.94 -37.67 64.1 Favored 'General case' 0 C--O 1.24 0.553 0 O-C-N 120.122 -1.611 . . . . 1.02 110.497 -174.747 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -21.07 66.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.25 1.42 . . . . 4.87 113.302 -179.841 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.0 -66.07 0.45 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 119.849 1.204 . . . . 2.52 111.561 -168.713 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -123.39 151.82 42.19 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 127.148 2.179 . . . . 3.25 109.858 -168.333 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 41.63 62.54 1.89 Allowed Glycine 0 CA--C 1.523 0.589 0 C-N-CA 124.207 0.908 . . . . 2.03 112.941 153.772 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . 0.457 10.7 mpt_? 85.54 112.1 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.558 1.318 . . . . 6.2 114.558 175.757 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -67.14 49.87 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 128.605 2.762 . . . . 3.84 114.522 -177.796 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.86 -54.46 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 108.626 -0.879 . . . . 4.36 108.626 -165.294 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -82.71 131.19 35.21 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 127.403 2.281 . . . . 2.15 107.72 175.907 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -97.97 129.64 44.86 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.297 0.639 . . . . 2.6 109.606 -175.807 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.9 t -82.58 161.86 22.13 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 125.663 1.585 . . . . 2.84 109.603 177.64 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.4 p -57.46 -39.71 70.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 116.212 -0.449 . . . . 2.54 109.927 167.919 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -69.91 -57.14 5.39 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-O 117.823 -1.084 . . . . 1.84 108.977 -178.186 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 63.9 mt-10 -39.0 -49.61 1.72 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 119.07 0.85 . . . . 1.77 112.12 169.91 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -57.71 -52.15 66.63 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 122.011 -0.43 . . . . 2.69 110.723 175.006 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 48.1 tttt -57.23 -38.13 73.3 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.715 -0.616 . . . . 2.5 111.261 -179.959 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -55.43 -34.91 64.86 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.278 0.49 . . . . 2.96 111.376 177.193 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -65.07 -53.78 40.24 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.294 -1.002 . . . . 2.58 108.294 -178.096 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.2 m -66.86 -40.91 86.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-N 115.318 -0.856 . . . . 0.98 109.71 -173.458 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.3 m -60.9 -53.74 53.59 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.288 1.035 . . . . 1.32 110.533 176.001 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -71.11 -48.0 54.79 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 119.188 -0.434 . . . . 2.37 111.282 -170.128 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -154.21 85.85 1.15 Allowed 'General case' 0 C--N 1.34 0.166 0 CA-C-N 118.644 0.656 . . . . 4.97 111.492 177.776 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 tp -157.62 59.02 1.59 Allowed Pre-proline 0 CA--C 1.543 0.696 0 CA-C-N 117.988 0.358 . . . . 1.85 111.602 161.454 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -65.85 -54.61 0.52 Allowed 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 124.103 3.202 . . . . 2.33 113.865 -166.394 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -107.66 41.31 1.54 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 119.295 0.952 . . . . 3.95 110.066 -169.671 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.475 HD23 HD22 ' A' ' 83' ' ' LEU . 1.1 mp -126.31 -98.78 0.4 Allowed 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 106.727 -1.583 . . . . 1.61 106.727 -178.416 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 87.6 mt -90.06 55.99 3.29 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.119 -0.988 . . . . 2.6 109.365 -168.183 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 157.57 14.49 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.658 -0.701 . . . . 4.92 110.925 -179.528 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 84.25 41.57 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 128.045 2.538 . . . . 4.56 110.193 -170.01 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.3 m -72.4 26.29 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 124.389 1.076 . . . . 2.23 113.556 -177.425 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -74.02 -76.85 0.67 Allowed Glycine 0 CA--C 1.522 0.478 0 N-CA-C 105.86 -2.896 . . . . 1.5 105.86 166.475 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 10.7 m -71.19 54.57 0.19 Allowed 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 127.276 2.23 . . . . 2.84 112.114 176.955 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -57.04 -28.54 62.63 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 125.302 1.441 . . . . 1.15 109.866 175.554 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -46.6 -33.43 4.16 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 125.121 1.368 . . . . 4.21 112.565 170.032 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -50.19 -60.88 2.53 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.035 -1.098 . . . . 4.04 108.035 172.884 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.7 -38.81 73.69 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.059 -0.973 . . . . 3.7 109.47 -172.969 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -49.64 -56.79 8.77 Favored 'General case' 0 CA--C 1.528 0.126 0 N-CA-C 109.389 -0.597 . . . . 1.39 109.389 175.04 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -63.42 -36.53 84.05 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 111.549 0.203 . . . . 3.46 111.549 178.945 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.1 m -59.36 -32.53 70.2 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.821 -0.549 . . . . 1.95 112.45 174.063 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 17.7 mt -87.47 -51.67 5.79 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 125.307 1.443 . . . . 1.53 111.679 -175.709 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -75.22 69.42 2.07 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.616 1.167 . . . . 1.52 109.83 -173.695 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 16.4 m -51.36 -42.71 28.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 124.47 1.108 . . . . 1.92 113.711 -168.992 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -84.22 -6.62 59.42 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.273 0.488 . . . . 2.03 112.245 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . 0.306 0.0 OUTLIER 51.25 59.95 4.23 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.646 1.979 . . . . 4.47 113.448 179.365 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.0 p30 -101.6 -9.39 21.0 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.259 1.423 . . . . 1.83 111.44 175.91 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . 0.295 15.7 p 80.9 -0.54 1.8 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 127.751 2.42 . . . . 2.63 114.234 -174.831 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -110.33 124.68 52.11 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.204 1.002 . . . . 3.05 108.345 173.064 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -84.7 97.77 9.84 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 106.071 -1.825 . . . . 0.95 106.071 168.084 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.3 pttt -69.65 162.8 26.95 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.542 1.065 . . . . 6.13 109.32 173.095 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -38.46 -52.61 1.57 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.695 1.198 . . . . 5.29 113.429 -173.051 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.08 -45.49 85.04 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.858 0.463 . . . . 1.5 111.174 -179.212 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -60.0 -45.43 92.77 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.673 -0.492 . . . . 1.89 109.673 178.915 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -66.01 -45.15 82.57 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 118.558 -0.734 . . . . 2.85 110.458 177.581 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.53 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -42.8 -47.13 5.44 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-O 117.133 -1.413 . . . . 5.27 107.239 173.499 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 78' ' ' ARG . . . . . 0.581 ' HB3' HH11 ' A' ' 78' ' ' ARG . 13.4 mtp-105 -39.16 -45.76 1.36 Allowed 'General case' 0 C--O 1.213 -0.829 0 CA-C-O 117.368 -1.301 . . . . 3.58 111.364 -177.422 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.5 tp -45.12 -56.94 4.25 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 120.226 1.375 . . . . 1.1 112.319 174.526 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.7 mp -61.81 -40.69 87.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 C-N-CA 126.949 2.1 . . . . 1.62 107.761 179.636 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -44.98 -54.89 6.66 Favored Glycine 0 CA--C 1.528 0.858 0 N-CA-C 109.761 -1.336 . . . . 2.12 109.761 170.707 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -74.27 -38.9 63.3 Favored 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 127.266 2.226 . . . . 2.7 107.727 -169.193 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.475 HD22 HD23 ' A' ' 49' ' ' LEU . 11.3 mt -52.85 -43.17 65.86 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 119.365 0.984 . . . . 2.21 110.912 178.869 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.49 -25.0 59.09 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.833 0.679 . . . . 1.65 112.833 176.829 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -83.78 -57.15 3.33 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.908 1.683 . . . . 1.56 111.498 168.716 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -57.33 -26.34 60.79 Favored 'General case' 0 N--CA 1.465 0.306 0 O-C-N 120.826 -1.171 . . . . 3.86 112.841 -175.604 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.0 tp -42.5 -33.24 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 C-N-CA 124.626 1.17 . . . . 1.94 112.284 168.913 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.1 -5.7 5.53 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.122 0.969 . . . . 6.15 112.785 174.39 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 26.8 tttp . . . . . 0 CA--C 1.542 0.644 0 CA-C-N 119.666 1.121 . . . . 3.41 113.424 176.233 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.546 0.806 0 CA-C-O 118.886 -0.578 . . . . 2.9 110.338 . . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 3.2 t -86.77 -171.88 3.73 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.334 1.054 . . . . 1.92 113.149 -170.397 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -55.16 -67.04 0.31 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.786 1.634 . . . . 2.33 112.837 -170.97 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 20.5 mt -53.13 -42.21 65.82 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.265 -0.897 . . . . 1.42 111.32 176.234 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -57.45 -42.4 82.42 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 119.454 -0.308 . . . . 3.17 110.443 177.415 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.7 -49.58 75.9 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 124.536 1.134 . . . . 4.03 110.148 175.066 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 76.0 p -67.33 -25.88 66.22 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 118.895 -0.574 . . . . 1.55 112.151 -174.58 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.287 2.7 pp -80.32 -32.56 13.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 119.219 0.918 . . . . 1.26 111.268 165.844 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -58.46 -53.42 58.47 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 119.553 1.069 . . . . 2.97 110.808 175.406 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 8.2 t -48.47 -45.13 36.31 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 119.59 1.086 . . . . 1.18 111.557 -174.013 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 33.3 m -69.96 -34.25 59.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 O-C-N 121.113 -0.992 . . . . 0.9 111.577 177.917 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 59.1 t -63.14 -52.32 60.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 118.883 0.765 . . . . 0.94 110.224 173.353 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 8.9 t -60.72 -43.01 98.37 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.547 1.067 . . . . 1.04 110.557 179.009 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 54.9 m -57.72 -49.23 77.22 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.388 -0.82 . . . . 1.09 110.768 174.251 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -48.68 -53.51 18.47 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 121.512 -0.742 . . . . 3.91 110.191 170.209 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -59.32 -47.83 83.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.442 1.097 . . . . 2.54 110.969 -173.331 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -61.55 -47.43 85.58 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 119.876 -0.73 . . . . 2.63 109.909 178.38 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -59.2 -35.16 73.12 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 120.849 -1.157 . . . . 2.87 111.828 173.584 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.11 -34.77 79.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 120.926 -1.109 . . . . 1.02 109.601 -179.875 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -18.53 64.79 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 117.566 -1.207 . . . . 4.05 113.159 -177.86 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.4 ' HB3' ' HG3' ' B' ' 37' ' ' GLU . 0.7 OUTLIER -49.17 -66.73 0.35 Allowed 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 114.113 1.153 . . . . 2.15 114.113 -155.921 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -92.54 -79.69 0.39 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.361 0.875 . . . . 3.3 113.361 -172.762 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.79 170.61 30.89 Favored Glycine 0 C--N 1.34 0.764 0 C-N-CA 128.792 3.091 . . . . 1.88 111.611 160.527 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.9 mmt85 46.69 96.85 0.01 OUTLIER 'General case' 0 C--O 1.241 0.621 0 C-N-CA 124.843 1.257 . . . . 3.56 113.724 146.781 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -76.69 52.88 0.85 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.937 0.895 . . . . 3.56 111.198 173.239 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -147.59 -64.78 0.27 Allowed 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 105.256 -2.128 . . . . 4.09 105.256 179.182 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 26.0 p -78.34 139.38 38.82 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.942 -1.026 . . . . 2.04 109.855 -178.533 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.82 128.42 36.16 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 106.883 -1.525 . . . . 2.61 106.883 159.156 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 6.5 t -82.46 -170.13 2.79 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.37 1.468 . . . . 2.86 108.496 163.707 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 85.1 t -67.03 -98.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 130.183 3.393 . . . . 2.63 101.969 -174.113 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -71.7 77.92 0.84 Allowed 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 121.364 1.893 . . . . 2.68 108.313 178.546 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.4 ' HG3' ' HB3' ' B' ' 26' ' ' GLN . 1.8 tt0 -163.3 -56.84 0.04 OUTLIER 'General case' 0 N--CA 1.444 -0.755 1 C-N-CA 132.155 4.182 . . . . 1.8 102.752 177.849 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -63.36 -52.78 60.29 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.061 -0.972 . . . . 2.09 109.01 170.359 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 9.8 ttmm -55.95 -37.1 68.56 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 119.677 -0.809 . . . . 2.78 110.333 -176.217 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -56.2 -38.03 70.44 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.839 0.681 . . . . 2.76 112.839 175.528 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -62.97 -51.66 65.99 Favored 'General case' 0 C--O 1.231 0.106 0 N-CA-C 108.083 -1.08 . . . . 2.55 108.083 -178.784 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 12.6 m -68.85 -48.66 69.52 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-N 115.861 -0.608 . . . . 0.71 109.726 -172.913 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 47.1 m -53.64 -54.95 30.48 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.991 0.916 . . . . 0.92 110.931 175.662 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -77.18 -56.4 4.6 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 122.362 -0.211 . . . . 1.9 110.745 -168.929 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -80.91 -50.75 9.37 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.552 0.945 . . . . 3.05 113.552 -164.97 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.23 -21.28 0.74 Allowed Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 115.022 1.49 . . . . 2.22 115.022 -157.014 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -62.98 -11.56 25.27 Favored 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 121.59 -2.254 . . . . 1.94 111.467 -74.407 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -107.39 -37.01 6.34 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 125.512 1.525 . . . . 2.49 110.993 -174.884 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 49' ' ' LEU . . . . . 0.452 ' CD2' HD13 ' B' ' 83' ' ' LEU . 28.5 tp -47.39 -46.3 25.96 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 124.313 1.045 . . . . 1.4 111.765 -172.432 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.2 mt -108.27 131.05 55.1 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 105.696 -1.965 . . . . 1.74 105.696 153.641 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -105.37 -175.09 2.69 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 125.609 1.564 . . . . 5.8 109.15 -178.403 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.25 3.7 p30 44.5 47.25 8.32 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 125.227 1.411 . . . . 4.63 110.917 178.731 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -52.85 -14.84 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 C-N-CA 128.082 2.553 . . . . 2.84 113.589 -178.587 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -48.61 -59.58 6.51 Favored Glycine 0 CA--C 1.531 1.063 0 N-CA-C 110.197 -1.161 . . . . 2.35 110.197 162.835 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 23.2 t -73.97 39.49 0.11 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 128.212 2.605 . . . . 2.65 113.15 -169.244 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -67.77 -31.66 71.7 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 125.786 1.634 . . . . 1.09 110.131 -178.393 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -43.75 -52.64 6.45 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.604 1.562 . . . . 4.33 112.602 177.795 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -40.43 87.3 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.625 1.102 . . . . 4.11 111.17 -176.308 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -62.05 -58.99 5.75 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.866 -0.791 . . . . 4.66 108.866 172.12 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -44.48 -50.74 9.29 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 119.112 0.869 . . . . 1.65 111.4 -179.118 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 10.9 tptp -55.3 -46.03 76.24 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.284 1.033 . . . . 4.08 111.333 177.052 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 20.0 m -71.79 -29.06 64.05 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.54 0.736 . . . . 1.44 112.356 179.783 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 65.6 mt -81.3 -57.91 3.28 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.857 1.263 . . . . 1.2 111.212 -175.935 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -57.68 -10.96 1.8 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.797 2.039 . . . . 1.84 115.773 -166.047 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 30.2 m -35.9 -25.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 130.618 3.567 . . . . 1.88 119.173 -130.92 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 21.6 p-10 -61.71 -24.62 66.91 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 120.846 1.657 . . . . 3.34 110.645 169.051 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 65.7 65.07 0.55 Allowed 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.711 2.005 . . . . 4.85 112.047 176.067 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 35.7 p30 -109.48 -8.57 15.0 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.664 1.986 . . . . 2.4 110.542 176.798 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.5 m 63.66 16.24 9.55 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.304 1.041 . . . . 1.88 113.402 -170.384 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -108.62 101.08 10.26 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 105.861 -1.903 . . . . 3.15 105.861 158.377 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.82 94.97 0.34 Allowed 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 105.026 -2.213 . . . . 1.54 105.026 166.482 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 46.5 tptt -83.14 162.42 21.3 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.999 0.519 . . . . 5.36 111.007 -155.009 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -83.11 64.4 7.65 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 109.044 -0.725 . . . . 4.22 109.044 162.413 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -163.97 51.67 0.14 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 115.66 -2.416 . . . . 5.19 113.303 82.397 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 -85.85 -53.06 5.34 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 126.855 2.062 . . . . 2.24 108.213 153.035 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -40.9 -43.2 2.02 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 127.571 2.348 . . . . 3.53 113.077 -169.523 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.512 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 0.0 OUTLIER -39.09 -48.51 1.69 Allowed 'General case' 0 C--N 1.343 0.29 0 O-C-N 124.124 0.89 . . . . 4.54 109.078 178.031 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -38.8 -46.39 1.26 Allowed 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 124.127 0.971 . . . . 4.92 112.948 -168.477 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 5.4 tp -57.59 -46.24 84.27 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.943 1.247 . . . . 0.86 112.966 178.534 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 15.7 mt -66.04 -41.42 89.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 106.95 -1.5 . . . . 2.02 106.95 177.596 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -43.64 -56.6 4.89 Favored Glycine 0 N--CA 1.44 -1.064 0 N-CA-C 108.739 -1.744 . . . . 1.8 108.739 171.806 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -69.32 -61.66 1.7 Allowed 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 125.567 1.547 . . . . 2.2 108.803 -171.881 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.483 HD12 HG21 ' A' ' 13' ' ' ILE . 4.5 pp -53.18 -29.92 34.54 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 111.802 0.297 . . . . 1.95 111.802 -171.79 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -51.12 -48.22 61.8 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.988 1.107 . . . . 1.51 113.988 169.148 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.27 0.0 OUTLIER -77.18 -39.8 47.59 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 119.781 1.173 . . . . 1.77 111.743 172.286 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -55.84 -34.01 65.02 Favored 'General case' 0 C--N 1.339 0.117 0 CA-C-O 118.36 -0.829 . . . . 2.94 112.715 -166.37 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 10.0 tt -42.65 -45.75 1.16 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 118.749 0.704 . . . . 0.93 111.363 173.381 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 63.8 ttt-85 -83.67 -43.78 15.21 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.097 0.959 . . . . 3.9 111.684 172.464 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 45.2 tttt . . . . . 0 CA--C 1.536 0.44 0 N-CA-C 114.682 1.364 . . . . 6.18 114.682 -144.032 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 . . . . . 0 CA--C 1.541 0.618 0 N-CA-C 109.719 -0.474 . . . . 5.47 109.719 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.87 142.33 62.37 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.392 1.395 . . . . 2.23 108.662 171.335 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.7 mt -111.6 -173.86 2.34 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.562 0.745 . . . . 1.41 110.086 -169.158 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.2 t -91.09 151.34 21.04 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.331 0.652 . . . . 2.01 110.202 -178.542 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -37.2 -54.52 1.02 Allowed 'General case' 0 C--N 1.339 0.134 0 C-N-CA 125.998 1.719 . . . . 2.13 113.456 -177.353 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.1 mt -63.7 -47.32 81.65 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 117.739 -1.125 . . . . 1.78 110.392 -175.857 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.21 -61.15 2.14 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.713 1.205 . . . . 4.97 110.392 170.044 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -48.7 -51.23 29.7 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.195 0.998 . . . . 3.77 109.318 -178.359 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 81.3 p -62.5 -48.42 79.63 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.626 0.602 . . . . 1.72 112.626 179.783 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' ILE . . . . . 0.456 HG21 HD12 ' B' ' 83' ' ' LEU 0.309 2.7 pp -60.42 -41.66 88.27 Favored 'Isoleucine or valine' 0 C--N 1.344 0.362 0 CA-C-N 119.459 1.027 . . . . 0.96 110.537 179.685 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -60.41 -53.05 62.24 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 119.261 -0.976 . . . . 2.87 109.234 173.962 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -53.62 -36.78 62.38 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.81 0.67 . . . . 1.33 112.81 -174.849 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.3 m -78.52 -45.2 26.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-N 119.311 0.96 . . . . 0.99 111.156 172.8 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 45.5 t -57.47 -40.75 76.39 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.333 0 CA-C-O 118.553 -0.737 . . . . 1.02 110.834 -176.891 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.0 t -59.61 -48.05 83.2 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 119.729 1.15 . . . . 0.95 110.335 176.027 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.7 m -53.19 -59.23 4.81 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 109.005 -0.739 . . . . 1.01 109.005 175.147 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -59.11 -43.52 91.91 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 112.052 0.39 . . . . 7.89 112.052 -176.127 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -61.18 -53.97 50.25 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 125.515 1.526 . . . . 3.69 110.409 -178.605 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 40.0 p -57.3 -50.51 72.69 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.074 -0.713 . . . . 2.35 109.074 177.07 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.89 -47.04 64.75 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-O 121.637 0.732 . . . . 3.17 111.63 176.806 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.65 -17.16 45.71 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 126.55 1.94 . . . . 1.1 111.973 -178.041 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -24.12 67.59 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 117.657 -1.163 . . . . 4.91 111.351 171.598 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -42.61 -62.45 0.98 Allowed 'General case' 0 C--N 1.346 0.431 0 C-N-CA 124.378 1.071 . . . . 2.16 112.082 -174.056 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -122.44 173.17 7.83 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 127.816 2.446 . . . . 2.59 107.606 -177.271 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -22.36 133.33 0.01 OUTLIER Glycine 0 CA--C 1.533 1.201 0 C-N-CA 127.458 2.456 . . . . 1.37 115.348 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.1 mtt85 64.47 103.49 0.03 OUTLIER 'General case' 0 C--O 1.239 0.503 0 C-N-CA 125.319 1.448 . . . . 5.29 111.907 179.509 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.38 58.25 0.39 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.194 1.398 . . . . 5.04 112.015 173.424 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 57.4 p-10 -170.94 -45.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 126.109 1.764 . . . . 3.2 108.61 170.391 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.5 m -84.16 139.87 32.13 Favored 'General case' 0 N--CA 1.444 -0.741 0 C-N-CA 125.152 1.381 . . . . 3.42 109.639 -179.379 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -89.8 175.11 7.36 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.44 1.096 . . . . 1.97 108.563 -178.447 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 35.2 m -153.56 170.13 21.55 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 105.845 -1.909 . . . . 2.99 105.845 179.365 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.3 p -51.63 -57.75 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 119.873 1.215 . . . . 2.31 113.443 -167.001 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -67.03 -47.26 71.97 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.907 -0.405 . . . . 1.7 109.907 -176.419 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -38.62 -51.54 1.64 Allowed 'General case' 0 C--O 1.231 0.12 0 C-N-CA 125.83 1.652 . . . . 1.83 110.863 167.839 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.56 -58.05 10.27 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.431 -0.804 . . . . 3.32 109.665 176.916 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.9 tttm -53.13 -47.45 68.67 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 118.849 -0.596 . . . . 3.1 111.555 -175.106 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -51.36 -41.58 60.72 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.378 0.535 . . . . 2.28 110.986 175.795 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 14.9 tp -64.96 -49.92 68.42 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 119.204 0.911 . . . . 2.69 109.028 -174.876 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 2.3 m -70.31 -46.52 71.09 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 CA-C-O 121.519 0.676 . . . . 1.05 109.215 -173.696 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.4 m -59.6 -49.29 78.33 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.79 0.836 . . . . 1.62 109.941 179.877 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -81.11 -56.13 4.29 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 118.914 -0.565 . . . . 4.16 112.13 -171.527 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.01 39.43 2.55 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.223 0.92 . . . . 5.08 113.44 -173.753 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 tp -150.19 70.83 9.26 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-N 119.273 0.942 . . . . 1.88 110.231 173.062 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.08 -49.38 1.39 Allowed 'Trans proline' 0 N--CA 1.451 -1.017 0 C-N-CA 123.221 2.614 . . . . 1.85 113.084 -165.067 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -120.24 -29.41 4.85 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 118.373 0.533 . . . . 3.05 112.082 -167.27 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' LEU . . . . . 0.463 HD23 HD22 ' A' ' 83' ' ' LEU . 13.6 tp -45.43 -62.98 1.05 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.241 1.017 . . . . 1.3 113.242 -170.065 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.3 mt -84.87 -64.13 1.21 Allowed 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 108.186 -1.042 . . . . 3.48 108.186 174.132 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.5 tptm 68.59 157.65 0.14 Allowed 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 124.656 1.182 . . . . 6.64 111.665 -170.284 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 59.6 t0 50.13 68.69 0.71 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 123.626 1.679 . . . . 4.56 109.145 -147.739 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.7 m -82.64 29.91 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 112.999 -1.91 . . . . 2.2 109.893 160.484 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -101.85 -58.43 0.8 Allowed Glycine 0 C--N 1.341 0.823 0 N-CA-C 108.278 -1.929 . . . . 1.65 108.278 172.834 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.1 t -74.1 57.14 0.63 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.386 1.474 . . . . 2.19 110.682 179.851 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -69.33 -42.53 75.19 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 124.035 0.934 . . . . 1.43 109.528 -175.889 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -39.46 -50.31 2.12 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 126.065 1.746 . . . . 4.25 112.961 -179.096 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -52.88 -52.47 57.36 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.596 0.712 . . . . 3.07 110.291 176.618 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.59 -38.01 83.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.213 0.605 . . . . 3.4 109.549 -177.346 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -55.34 -49.84 71.2 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.506 -0.553 . . . . 1.49 109.506 174.095 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -64.52 -39.01 92.98 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 117.933 0.333 . . . . 3.08 111.353 177.04 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.8 m -58.06 -41.82 84.16 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.768 -0.583 . . . . 2.3 111.072 174.978 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 36.7 mt -70.0 -68.44 0.42 Allowed 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.881 0.872 . . . . 1.98 109.067 178.363 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -77.46 75.83 4.0 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.801 1.24 . . . . 1.79 110.069 -171.775 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.7 m -46.24 -35.96 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 124.718 1.207 . . . . 1.87 113.625 -177.824 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -84.95 -14.62 47.02 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.707 1.203 . . . . 1.93 112.879 -178.214 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 51.89 46.64 26.25 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.028 1.331 . . . . 4.27 110.805 -176.535 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 35.1 p30 -86.38 -18.5 31.68 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.666 0.787 . . . . 1.93 109.909 168.168 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.0 t 71.45 16.06 6.05 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.872 1.669 . . . . 2.78 112.743 -178.886 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -120.84 104.92 10.23 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 105.76 -1.941 . . . . 3.83 105.76 172.397 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -88.07 92.91 9.32 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.221 -1.399 . . . . 1.19 107.221 -174.012 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 33.5 tttt -55.13 160.03 2.27 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 108.878 -0.786 . . . . 6.09 108.878 172.385 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -39.77 -57.62 1.51 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.422 1.089 . . . . 5.31 112.777 -178.75 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -60.46 -38.25 83.58 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.087 0.555 . . . . 1.86 112.01 179.08 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -66.77 -50.55 62.34 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.822 -0.436 . . . . 2.14 109.822 -178.024 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -58.88 -43.98 91.03 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 119.818 -0.753 . . . . 6.77 109.628 175.778 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 77' ' ' TRP . . . . . 0.611 ' CZ2' ' CE2' ' B' ' 77' ' ' TRP . 3.8 t-105 -48.5 -34.04 10.53 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 117.714 -1.136 . . . . 3.89 112.019 -177.142 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.7 mtp85 -39.25 -47.49 1.68 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.726 1.148 . . . . 3.88 111.549 174.072 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.1 tp -45.66 -47.45 15.0 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.408 0.683 . . . . 1.08 111.164 179.208 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.8 mp -64.08 -21.37 28.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-O 120.874 0.368 . . . . 1.88 110.265 -169.57 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 81' ' ' GLY . . . . . 0.541 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -76.67 -44.69 14.88 Favored Glycine 0 CA--C 1.496 -1.106 0 N-CA-C 109.012 -1.635 . . . . 1.58 109.012 179.452 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -63.98 -43.23 96.36 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 105.802 -1.925 . . . . 2.64 105.802 -179.53 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 83' ' ' LEU . . . . . 0.463 HD22 HD23 ' A' ' 49' ' ' LEU . 5.5 mt -54.62 -60.28 3.56 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 121.447 -0.783 . . . . 2.78 111.71 171.094 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.7 -27.74 63.2 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.281 1.032 . . . . 1.28 112.46 -176.908 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -80.53 -48.77 12.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.5 1.52 . . . . 1.95 110.054 177.202 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -55.46 -45.67 76.88 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 126.038 1.735 . . . . 2.37 110.694 -179.967 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.0 tt -63.69 0.3 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 N-CA-C 113.271 0.841 . . . . 1.75 113.271 175.661 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.71 -59.54 1.82 Allowed 'General case' 0 C--O 1.236 0.367 0 O-C-N 120.552 -1.343 . . . . 7.76 109.821 162.975 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.342 0.261 0 N-CA-C 114.339 1.237 . . . . 3.36 114.339 -168.812 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.541 0.599 0 N-CA-C 109.088 -0.708 . . . . 2.44 109.088 . . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 13.7 t -79.57 -176.62 5.4 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.875 0.87 . . . . 2.22 111.828 -166.706 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -62.98 -67.58 0.41 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.491 0.716 . . . . 3.27 112.26 -165.278 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 18.6 mt -50.07 -45.46 52.49 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.03 -1.044 . . . . 1.16 111.244 176.139 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -56.93 -37.46 71.52 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.252 1.021 . . . . 3.69 111.686 177.123 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.72 -44.21 51.09 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.195 0.998 . . . . 4.19 109.241 179.521 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 25.7 t -57.39 -46.95 82.89 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.272 0.629 . . . . 1.7 110.07 -179.031 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.275 2.7 pp -65.98 -18.93 24.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 O-C-N 121.172 -0.955 . . . . 1.78 112.282 174.505 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.38 -56.17 5.16 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.751 1.16 . . . . 3.17 110.639 167.496 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.1 t -47.48 -43.91 24.83 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.051 1.296 . . . . 1.38 111.422 -169.836 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 15.4 m -69.36 -37.93 76.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 O-C-N 121.562 -0.711 . . . . 1.05 112.128 178.032 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.65 -42.36 95.76 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.133 0.973 . . . . 1.32 109.585 175.011 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 18' ' ' THR . . . . . . . . . . . . 0.269 9.8 t -68.26 -36.9 80.14 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 120.774 -1.204 . . . . 1.35 111.358 174.69 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.0 m -53.59 -57.52 10.45 Favored 'General case' 0 C--N 1.345 0.382 0 CA-C-N 120.705 1.593 . . . . 1.4 109.248 169.632 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -41.59 -55.54 2.87 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.269 1.028 . . . . 4.26 110.539 172.503 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -58.28 -53.21 60.81 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.251 1.02 . . . . 2.38 111.1 -174.624 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 40.3 p -56.1 -52.9 62.63 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.729 0.411 . . . . 2.31 110.893 -178.955 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -61.47 -47.8 84.01 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 118.042 0.383 . . . . 2.87 110.632 177.699 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.19 -29.55 61.04 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 126.221 1.809 . . . . 0.99 111.271 -176.176 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.16 -15.67 47.7 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 117.951 -1.023 . . . . 3.46 113.038 176.524 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 26' ' ' GLN . . . . . 0.412 ' CB ' ' HG2' ' B' ' 37' ' ' GLU . 1.1 tp-100 -58.13 -65.13 0.69 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 116.131 1.9 . . . . 1.98 116.131 -166.801 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -88.02 -77.88 0.34 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.371 0.532 . . . . 2.98 112.205 -163.199 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.39 164.9 25.94 Favored Glycine 0 C--N 1.339 0.728 0 C-N-CA 128.048 2.737 . . . . 1.83 110.609 150.805 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 17.9 mmt85 53.47 98.96 0.01 OUTLIER 'General case' 0 C--O 1.24 0.591 0 N-CA-C 115.326 1.602 . . . . 3.55 115.326 135.565 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -72.82 60.68 0.52 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.018 1.727 . . . . 3.33 112.261 178.615 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -164.25 -61.24 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 106.716 -1.587 . . . . 4.02 106.716 -171.406 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 87.6 p -58.88 138.94 57.09 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 118.008 -0.996 . . . . 2.32 109.938 168.774 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 6.5 mp -102.08 101.45 11.81 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.248 -1.019 . . . . 2.44 108.248 152.353 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 1.4 p -84.25 176.11 8.96 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.684 1.194 . . . . 2.51 108.521 168.841 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 7.8 p -91.6 50.94 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 O-C-N 120.516 -1.365 . . . . 2.55 111.492 -170.523 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -156.37 52.78 0.54 Allowed 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 106.376 -1.712 . . . . 2.64 106.376 149.254 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 37' ' ' GLU . . . . . 0.412 ' HG2' ' CB ' ' B' ' 26' ' ' GLN . 91.8 mt-10 -158.68 -54.83 0.07 Allowed 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 130.915 3.686 . . . . 1.72 104.046 -178.099 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -62.63 -57.64 10.34 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.801 -1.09 . . . . 2.14 109.105 173.683 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -59.13 -41.52 88.42 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 110.061 -0.348 . . . . 2.76 110.061 -175.334 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -47.88 -41.94 25.55 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.621 0.6 . . . . 3.54 112.621 170.549 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 tp -63.24 -52.4 62.29 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 119.115 0.871 . . . . 1.94 108.807 -175.018 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -68.51 -48.52 71.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.436 -0.802 . . . . 0.63 109.242 -173.307 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 68.2 m -56.67 -54.87 41.09 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 123.909 0.884 . . . . 0.87 111.178 177.34 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -80.68 -59.38 2.7 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 117.792 0.269 . . . . 2.48 111.627 -170.375 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -81.3 -48.51 11.9 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 112.404 0.52 . . . . 3.11 112.404 -160.075 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mp -64.77 -24.43 1.21 Allowed Pre-proline 0 CA--C 1.534 0.361 0 N-CA-C 113.727 1.01 . . . . 2.37 113.727 -164.178 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.79 -10.72 18.0 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.027 -2.072 . . . . 1.64 112.365 -82.837 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 70.1 t60 -95.98 -34.95 11.59 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.02 1.328 . . . . 2.52 111.15 179.761 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 33.5 tp -55.08 -66.6 0.38 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-N 119.014 0.824 . . . . 1.03 110.313 -169.078 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 80.3 mt -92.14 156.33 17.42 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 105.984 -1.858 . . . . 2.06 105.984 152.186 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.45 -166.19 2.35 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 106.42 -1.696 . . . . 6.06 106.42 -170.945 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 57.53 33.38 23.19 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 122.651 1.215 . . . . 4.7 109.456 -177.356 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 21.1 m -56.71 -29.98 31.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 125.756 1.622 . . . . 1.99 111.328 -166.564 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -41.78 -46.38 4.87 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 123.688 0.661 . . . . 2.93 111.737 172.869 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 2.4 t -93.7 19.72 8.35 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.626 0.77 . . . . 2.68 112.48 -174.389 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -42.65 -41.65 3.18 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 124.313 1.045 . . . . 1.07 111.201 178.693 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -34.58 -44.54 0.21 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.05 2.14 . . . . 4.22 113.722 173.569 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -65.11 -43.16 92.91 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.001 -1.062 . . . . 3.67 110.844 178.074 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? -65.67 -44.94 84.75 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 118.539 -0.743 . . . . 4.23 109.283 177.431 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -47.15 -53.55 12.71 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 119.196 0.907 . . . . 1.89 109.651 170.628 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -61.38 -39.26 90.0 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 122.182 -0.324 . . . . 3.63 111.568 -178.531 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 32.4 t -61.52 -41.96 98.1 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.846 0.859 . . . . 1.56 111.754 173.852 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 33.9 mt -77.94 -53.52 7.36 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 124.305 1.042 . . . . 1.51 110.254 -171.606 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.256 17.9 t0 -59.41 -8.88 1.98 Allowed 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 127.011 2.124 . . . . 1.42 116.535 -164.09 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.0 m -33.76 -19.26 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 C-N-CA 131.111 3.764 . . . . 1.45 119.414 -131.66 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -58.39 -28.2 64.96 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 120.962 1.71 . . . . 3.01 111.321 158.083 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 59.42 62.34 1.8 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.427 1.491 . . . . 3.91 110.991 175.401 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -103.18 -15.34 16.05 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.202 1.801 . . . . 1.96 111.591 175.21 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 11.8 m 73.79 21.92 2.62 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.783 1.633 . . . . 2.04 113.464 -175.254 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -129.52 109.7 11.25 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 125.36 1.464 . . . . 3.5 107.592 162.135 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -77.77 106.38 9.56 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.847 -1.168 . . . . 1.05 107.847 176.931 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 12.0 ptmt -85.54 -178.46 6.68 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 126.551 1.94 . . . . 3.9 112.115 -174.803 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -75.65 82.55 2.65 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 124.591 1.156 . . . . 3.83 108.284 -172.539 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 96.53 47.79 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.314 1 C-N-CA 133.554 4.742 . . . . 2.25 108.295 178.088 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -89.63 -60.93 1.81 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 107.934 -1.136 . . . . 1.94 107.934 120.467 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -38.71 -53.67 1.63 Allowed 'General case' 0 C--N 1.344 0.358 0 C-N-CA 127.049 2.14 . . . . 3.45 111.529 -174.172 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 77' ' ' TRP . . . . . 0.611 ' CE2' ' CZ2' ' A' ' 77' ' ' TRP . 43.0 t90 -43.4 -38.42 2.75 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 125.989 1.716 . . . . 4.1 112.42 -171.292 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -38.85 -48.66 1.57 Allowed 'General case' 0 C--N 1.342 0.25 0 C-N-CA 123.866 0.866 . . . . 5.23 111.746 174.988 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 6.0 tp -52.12 -48.05 65.01 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.033 0.533 . . . . 0.89 111.504 -177.271 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 64.5 mt -62.16 -30.68 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 N-CA-C 107.529 -1.285 . . . . 1.37 107.529 -178.255 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 81' ' ' GLY . . . . . 0.577 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -69.33 -52.94 19.75 Favored Glycine 0 CA--C 1.496 -1.154 0 C-N-CA 124.894 1.235 . . . . 1.29 111.392 179.965 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -50.54 -63.22 1.19 Allowed 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 107.192 -1.41 . . . . 3.37 107.192 174.047 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 83' ' ' LEU . . . . . 0.456 HD12 HG21 ' A' ' 13' ' ' ILE 0.289 4.5 pp -58.98 -34.05 71.38 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.941 0.719 . . . . 1.94 112.941 -173.645 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.91 -38.62 73.1 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 118.265 -0.874 . . . . 1.17 111.966 174.939 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.315 0.0 OUTLIER -80.39 -41.12 25.2 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-O 116.101 -1.904 . . . . 3.39 112.189 166.451 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -45.62 -36.05 4.5 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 121.331 1.878 . . . . 2.62 112.914 -169.862 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 10.5 tt -44.05 -50.85 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 CA-C-N 118.316 0.507 . . . . 0.96 111.969 171.914 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.44 -50.18 8.0 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.861 2.464 . . . . 4.14 112.613 175.133 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 10.5 tttm . . . . . 0 CA--C 1.531 0.241 0 C-N-CA 126.04 1.736 . . . . 5.96 112.313 -168.68 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.0 mtt . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 108.551 -0.907 . . . . 6.66 108.551 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -146.15 170.76 16.06 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 106.202 -1.777 . . . . 3.09 106.202 170.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.71 71.47 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 128.189 2.596 . . . . 3.76 108.792 -172.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -62.82 133.22 95.08 Favored Pre-proline 0 N--CA 1.444 -0.756 0 C-N-CA 126.053 1.741 . . . . 4.3 110.457 -168.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -71.62 106.99 2.08 Favored 'Trans proline' 0 N--CA 1.453 -0.902 0 C-N-CA 122.829 2.353 . . . . 2.21 110.757 -174.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.5 mt -66.27 162.75 19.43 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.584 1.154 . . . . 1.24 110.089 172.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 t -76.31 170.1 16.98 Favored 'General case' 0 C--O 1.226 -0.135 0 O-C-N 121.554 -0.717 . . . . 1.72 109.89 -178.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -59.56 -50.21 74.79 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.477 0.711 . . . . 2.0 109.635 -174.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.451 HD12 ' HG2' ' B' ' 45' ' ' GLN . 3.7 mt -62.09 -53.39 56.18 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.55 -1.214 . . . . 1.56 111.696 176.156 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -47.33 -55.66 8.34 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.163 1.385 . . . . 2.28 110.785 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -49.71 -60.16 3.15 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.435 1.494 . . . . 3.94 109.616 173.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.4 p -57.05 -40.5 76.91 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.403 -0.811 . . . . 1.66 112.239 -175.548 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.295 2.8 pp -69.59 -42.2 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 O-C-N 121.819 -0.55 . . . . 0.58 110.248 177.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -58.66 -47.65 83.73 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 118.997 0.817 . . . . 3.47 109.804 177.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.9 m -46.03 -45.77 16.18 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.582 1.553 . . . . 1.84 112.745 174.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 32.6 m -79.89 -35.78 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 O-C-N 120.376 -1.453 . . . . 0.73 110.993 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 49.2 t -58.47 -44.23 88.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 118.779 0.718 . . . . 0.57 110.415 176.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.8 t -63.05 -46.53 87.1 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.02 0.827 . . . . 0.62 110.058 177.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 16.2 m -59.33 -49.48 77.65 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.293 0.497 . . . . 0.67 109.774 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -46.73 -52.07 14.77 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 124.146 0.978 . . . . 3.52 110.043 168.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -57.75 -50.18 74.08 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 118.566 0.621 . . . . 3.39 110.21 -174.085 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -55.79 -58.53 7.46 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 122.14 -0.35 . . . . 2.49 110.798 174.562 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -62.98 -23.23 67.33 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 112.377 0.51 . . . . 2.66 112.377 -177.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.46 -26.58 38.23 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 120.996 -1.065 . . . . 0.81 110.338 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 71.4 ttp85 -80.43 -25.73 38.8 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.888 0.875 . . . . 4.37 112.317 -177.505 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -39.06 -60.59 0.85 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.12 1.368 . . . . 2.3 112.974 -178.633 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -118.84 167.5 11.64 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 127.447 2.299 . . . . 2.37 106.354 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 0.74 108.73 0.01 OUTLIER Glycine 0 CA--C 1.536 1.383 0 C-N-CA 127.021 2.248 . . . . 1.31 115.636 171.463 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 66.13 103.25 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.928 1.455 . . . . 4.65 114.928 165.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.5 pttt -62.92 64.71 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.816 2.047 . . . . 4.01 110.973 166.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -177.2 -30.08 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.066 2.146 . . . . 3.61 110.599 -158.655 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 34.1 t -134.83 148.69 50.23 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 121.307 -0.871 . . . . 3.08 111.964 166.792 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -83.99 120.04 25.64 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 125.501 1.521 . . . . 1.94 107.473 165.078 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.4 m -84.48 169.6 14.34 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.599 1.56 . . . . 3.04 108.176 166.396 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.21 -43.64 91.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 O-C-N 120.854 -1.154 . . . . 2.01 112.215 -170.788 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -64.63 -51.45 62.54 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 108.989 -0.745 . . . . 2.2 108.989 -178.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -37.97 -54.31 1.31 Allowed 'General case' 0 C--O 1.232 0.136 0 C-N-CA 124.965 1.306 . . . . 1.85 112.139 166.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.21 -51.96 67.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 122.009 -0.432 . . . . 3.05 109.849 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt -55.46 -39.55 70.49 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 122.069 -0.394 . . . . 3.71 110.927 -179.121 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -55.42 -40.14 71.1 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.609 0.64 . . . . 2.56 111.851 173.474 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -62.88 -51.17 68.03 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 119.52 1.055 . . . . 2.6 108.664 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -69.01 -38.75 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 CA-C-N 115.991 -0.55 . . . . 1.06 110.169 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 78.0 m -63.15 -42.76 99.51 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.666 0.786 . . . . 1.34 111.224 175.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -79.84 -53.81 6.42 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 119.283 -0.389 . . . . 2.14 110.308 -168.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -98.0 -127.64 0.16 Allowed 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 109.858 -0.423 . . . . 3.67 109.858 171.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.487 HD22 ' H ' ' A' ' 46' ' ' LEU . 3.2 mm? 29.7 59.56 0.84 Allowed Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 127.268 2.227 . . . . 2.17 114.374 -173.52 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.31 -42.54 3.77 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 122.488 2.125 . . . . 1.74 111.864 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -122.96 -20.6 5.75 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 113.618 0.97 . . . . 3.1 113.618 -170.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.971 HD23 ' HG ' ' A' ' 83' ' ' LEU . 2.0 mp -64.84 -97.2 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 118.898 0.772 . . . . 1.42 111.212 172.7 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 75.5 mt -88.74 71.66 8.71 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 120.87 -1.144 . . . . 2.27 109.31 -163.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.5 ttmm -56.06 156.03 5.84 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.155 -0.93 . . . . 6.01 110.845 170.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.0 t0 57.0 66.06 1.25 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 123.496 1.617 . . . . 4.82 109.987 -157.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.4 m -68.19 -3.3 2.36 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 112.851 -1.977 . . . . 2.0 111.616 162.244 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -75.4 -55.93 4.89 Favored Glycine 0 C--N 1.343 0.948 0 N-CA-C 108.136 -1.986 . . . . 1.75 108.136 176.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.5 t -74.08 52.06 0.43 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.158 1.383 . . . . 2.1 110.61 173.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -72.09 -45.57 60.14 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 125.015 1.326 . . . . 1.2 108.339 170.08 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.79 -38.14 74.95 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.561 1.144 . . . . 4.72 110.248 -164.411 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -54.07 -55.06 31.06 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.415 1.086 . . . . 3.16 111.669 167.778 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -51.36 68.57 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 107.653 -1.24 . . . . 2.92 107.653 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -46.94 -53.74 11.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.441 0.696 . . . . 1.49 110.698 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -59.56 -26.26 65.23 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.91 0.707 . . . . 3.23 112.91 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.2 m -79.76 -48.59 13.35 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.951 0.9 . . . . 2.3 111.466 178.089 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.4 mp -62.19 -48.82 78.33 Favored 'General case' 0 C--N 1.341 0.209 0 N-CA-C 109.381 -0.6 . . . . 1.6 109.381 177.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -74.33 73.07 1.83 Allowed 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 107.84 -1.17 . . . . 1.9 107.84 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 20.9 m -49.47 -30.34 4.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.484 1.113 . . . . 1.79 113.09 -173.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -87.33 -21.21 25.85 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.837 1.655 . . . . 2.54 112.645 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 55.16 50.88 14.24 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.509 1.124 . . . . 3.92 109.338 -176.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 34.1 p30 -94.09 -18.05 22.2 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.953 1.701 . . . . 1.94 110.612 172.552 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.9 m 70.4 17.21 6.98 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.371 1.468 . . . . 1.79 113.453 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -107.21 107.75 18.85 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 104.094 -2.558 . . . . 3.79 104.094 155.441 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.57 96.74 8.17 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 103.455 -2.794 . . . . 1.03 103.455 171.202 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.59 162.18 16.07 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.909 -1.145 . . . . 5.17 107.909 176.224 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -39.58 -52.49 2.19 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 123.578 0.751 . . . . 6.64 111.628 176.129 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 53.3 t30 -66.81 -27.58 67.67 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 113.496 0.924 . . . . 2.62 113.496 -176.132 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -79.73 -56.44 4.28 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.628 -1.249 . . . . 2.02 107.628 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -45.5 -50.48 12.74 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.42 1.088 . . . . 3.26 111.209 173.003 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.595 ' CH2' ' CH2' ' B' ' 77' ' ' TRP . 2.5 t-105 -39.78 -41.1 1.06 Allowed 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.426 1.89 . . . . 4.13 111.77 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 21.7 mmt180 -39.86 -48.12 2.25 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 123.651 0.781 . . . . 4.43 111.599 176.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.2 tp -48.64 -46.18 39.61 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.681 0.793 . . . . 0.88 110.405 -178.13 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 66.8 mt -63.46 -29.36 47.05 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 107.913 -1.143 . . . . 1.62 107.913 -172.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.488 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -69.98 -45.37 57.34 Favored Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 109.743 -1.343 . . . . 1.54 109.743 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -68.42 -48.19 65.27 Favored 'General case' 0 N--CA 1.437 -1.096 0 N-CA-C 106.667 -1.605 . . . . 2.5 106.667 -175.896 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.971 ' HG ' HD23 ' A' ' 49' ' ' LEU . 4.3 mp -42.04 -58.92 1.92 Allowed 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 118.613 0.642 . . . . 2.37 110.945 166.564 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.99 -19.73 53.96 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 113.133 0.79 . . . . 1.2 113.133 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -80.45 -52.74 7.29 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.757 1.623 . . . . 1.61 109.761 174.695 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -58.43 -29.15 65.9 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 127.305 2.242 . . . . 2.63 110.962 -171.317 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.0 tp -40.59 -38.2 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 124.534 1.134 . . . . 1.62 111.766 168.491 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.23 -43.73 3.05 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.462 1.105 . . . . 5.16 111.371 177.304 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 49.0 tttp -75.44 65.66 1.74 Allowed 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 123.765 0.826 . . . . 3.53 110.414 177.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 11.8 tttp -69.04 -18.34 64.01 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.585 -0.697 . . . . 8.16 110.486 165.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -158.53 -81.87 0.05 Allowed 'General case' 0 C--O 1.236 0.39 0 C-N-CA 125.276 1.43 . . . . 8.23 108.721 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . 2.475 39.9 m-20 137.21 -35.81 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 123.78 0.832 . . . . 5.36 109.814 176.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . 2.531 10.4 tt 161.51 -153.13 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.047 1 C-N-CA 139.749 7.219 . . . . 8.2 101.532 -15.794 . . . . . . . . 3 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.66 144.29 32.7 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 121.151 1.796 . . . . 10.37 110.007 174.23 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 19.0 mt 48.43 57.13 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 107.363 -1.347 . . . . 10.79 107.363 -156.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 7.2 ptp85 -79.0 -113.49 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.535 1.134 . . . . 13.87 110.588 -171.241 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.6 tmtm? -176.78 132.64 0.2 Allowed 'General case' 0 C--O 1.237 0.415 0 N-CA-C 104.971 -2.233 . . . . 9.88 104.971 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . 2.208 31.9 mttm . . . . . 0 C--O 1.251 1.155 0 C-N-CA 129.529 3.132 . . . . 12.86 113.782 171.27 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 59.0 mmm . . . . . 0 CA--C 1.534 0.355 0 N-CA-C 106.736 -1.579 . . . . 6.4 106.736 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.346 . . 61.05 134.74 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 119.0 2.963 . . . . 4.72 119.0 156.869 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 79.27 92.48 0.06 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 116.772 2.138 . . . . 4.43 116.772 112.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -164.37 145.7 6.78 Favored Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 125.167 1.387 . . . . 6.35 108.783 161.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -81.83 159.31 18.69 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 124.56 3.506 . . . . 2.35 110.234 173.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.526 ' HB3' ' HB3' ' B' ' 10' ' ' GLU . 1.7 mt -150.88 -175.47 5.14 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 113.884 1.068 . . . . 2.19 113.884 -153.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 4.2 t -89.05 -163.72 1.03 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.316 1.446 . . . . 1.63 113.464 173.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -65.14 -67.29 0.45 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.98 2.112 . . . . 2.1 113.057 -172.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 16.3 mt -57.16 -41.46 79.25 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 120.622 -1.299 . . . . 1.05 109.976 178.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.62 ' HG2' HD22 ' A' ' 49' ' ' LEU . 99.2 mt-10 -49.77 -42.97 47.8 Favored 'General case' 0 CA--C 1.563 1.473 0 C-N-CA 123.794 0.838 . . . . 3.15 112.512 167.864 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -61.05 -46.98 88.5 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 119.677 -1.889 . . . . 3.88 110.124 172.061 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 54.1 p -61.23 -36.96 81.36 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.613 -0.68 . . . . 1.9 111.121 -175.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.283 2.9 pp -68.63 -43.05 83.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 O-C-N 121.587 -0.696 . . . . 1.04 110.476 171.588 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.07 -43.55 82.23 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.263 0.938 . . . . 4.3 110.845 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.38 -28.77 68.89 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.1 0.56 . . . . 1.42 111.735 -174.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 34.3 m -81.35 -36.84 15.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 O-C-N 120.888 -1.132 . . . . 0.93 111.276 168.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 39.5 t -56.89 -43.92 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 118.731 0.696 . . . . 1.3 110.688 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.6 t -59.49 -50.53 73.58 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.59 0.632 . . . . 1.65 110.268 176.672 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.9 m -53.83 -55.03 30.31 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.395 -0.816 . . . . 1.05 110.351 177.056 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -42.84 -56.7 3.12 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 123.929 0.891 . . . . 4.42 110.3 171.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -57.01 -52.15 66.42 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.791 0.436 . . . . 3.62 110.996 -177.256 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 75.7 p -56.64 -32.9 65.79 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.334 0.494 . . . . 2.62 112.334 -177.341 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -81.1 -47.2 13.84 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 118.844 0.747 . . . . 2.71 111.534 171.827 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.32 -40.89 68.41 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 120.769 -1.207 . . . . 1.02 109.854 -175.352 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -17.19 64.57 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 117.234 -1.365 . . . . 4.75 113.097 -175.379 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -47.75 -60.87 2.26 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.987 1.267 . . . . 2.22 114.262 -168.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -79.54 -35.38 39.98 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 118.65 2.833 . . . . 3.28 118.65 -158.442 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -81.6 -92.94 0.52 Allowed Glycine 0 C--N 1.34 0.766 1 C-N-CA 131.448 4.356 . . . . 3.13 114.308 7.57 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.1 mmt-85 49.15 73.12 0.25 Allowed 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.876 -1.157 . . . . 5.51 107.876 -153.43 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -78.89 49.78 0.95 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.962 1.705 . . . . 3.71 110.949 -175.035 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -161.03 -48.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 126.73 2.012 . . . . 4.23 107.448 -168.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 29.8 m -116.35 140.21 49.58 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 124.676 1.19 . . . . 3.05 110.956 -174.853 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 6.3 mp -93.59 120.68 34.17 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.711 1.204 . . . . 2.36 109.249 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 7.1 m -83.38 171.55 13.38 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.399 -0.963 . . . . 2.41 108.399 173.475 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 7.1 p -85.37 51.5 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 120.098 -1.626 . . . . 2.67 110.507 177.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -158.53 57.25 0.45 Allowed 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 106.124 -1.806 . . . . 2.06 106.124 157.584 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -176.29 -57.6 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 102.024 -3.324 . . . . 1.58 102.024 -167.451 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -62.91 -60.73 3.07 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.914 -1.039 . . . . 2.18 110.479 171.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -58.78 -39.17 80.28 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.984 -0.376 . . . . 3.51 109.984 -176.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -54.39 -34.3 60.96 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.862 -0.59 . . . . 2.56 112.428 175.337 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 30.8 tp -67.44 -45.77 75.05 Favored 'General case' 0 C--N 1.338 0.092 0 CA-C-N 119.754 1.161 . . . . 1.92 109.045 -177.419 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.557 ' HA ' HD23 ' B' ' 46' ' ' LEU . 5.6 m -68.67 -45.49 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 N-CA-C 110.009 -0.367 . . . . 0.99 110.009 -177.391 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 97.7 m -55.56 -51.15 68.03 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.431 0.692 . . . . 1.09 111.111 174.682 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -80.04 -57.49 3.61 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.094 0.558 . . . . 2.13 111.641 -168.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 45' ' ' GLN . . . . . 0.451 ' HG2' HD12 ' A' ' 9' ' ' LEU . 34.9 tp60 -80.23 -54.21 5.95 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 112.817 0.673 . . . . 3.84 112.817 -158.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 46' ' ' LEU . . . . . 0.557 HD23 ' HA ' ' B' ' 42' ' ' VAL 0.269 1.0 OUTLIER -39.37 -49.57 4.81 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 116.053 1.872 . . . . 2.45 116.053 -136.425 . . . . . . . . 4 4 . 1 . 001 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -84.34 -28.17 1.21 Allowed 'Trans proline' 0 N--CA 1.448 -1.19 0 CA-C-N 120.672 1.276 . . . . 2.71 108.871 -36.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -100.82 -37.4 8.71 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 125.291 1.437 . . . . 2.56 110.047 -171.335 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.438 HD23 ' HB2' ' B' ' 83' ' ' LEU . 43.9 tp -35.31 -58.95 0.55 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.99 1.716 . . . . 2.04 115.235 -171.762 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.89 -175.24 3.12 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.408 -0.96 . . . . 2.71 108.408 168.396 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.42 ' NZ ' ' OE1' ' B' ' 86' ' ' GLU . 0.0 OUTLIER -150.57 169.88 20.47 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 124.97 1.308 . . . . 5.74 108.04 -163.39 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 11.7 t0 58.9 67.1 0.96 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 123.443 1.592 . . . . 4.24 109.11 -171.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 16.1 m -83.54 -12.1 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 112.213 -2.267 . . . . 1.79 109.897 164.681 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -64.96 -61.86 5.46 Favored Glycine 0 C--N 1.34 0.803 0 N-CA-C 108.884 -1.686 . . . . 2.42 108.884 176.083 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 35.5 t -78.3 57.28 1.86 Allowed 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.943 -1.132 . . . . 2.82 107.943 173.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.419 HD23 HG21 ' B' ' 42' ' ' VAL . 2.8 tm? -60.93 -44.29 97.43 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 119.67 -1.894 . . . . 1.08 108.116 173.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -65.03 -24.02 67.37 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.256 1.022 . . . . 4.32 112.25 -166.637 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -50.95 -60.12 3.42 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.647 1.179 . . . . 2.35 109.585 161.592 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.47 -51.59 68.82 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.106 -1.072 . . . . 4.01 108.106 177.631 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.42 -60.47 1.93 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.303 0.956 . . . . 1.67 110.618 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -61.66 -36.38 80.65 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 122.377 -0.202 . . . . 3.16 110.935 -175.328 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 18.5 m -66.24 -32.48 73.92 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.4 0.518 . . . . 2.28 112.4 175.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 22.0 mt -80.65 -43.8 19.86 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.789 1.236 . . . . 1.54 111.158 -177.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -66.45 -7.15 17.63 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 129.905 3.282 . . . . 1.59 116.787 -166.52 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 17.1 m -36.95 -19.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 128.629 2.771 . . . . 1.99 117.844 -160.459 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -69.12 -1.3 7.4 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 120.689 1.586 . . . . 4.01 112.043 170.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 82.43 -29.56 0.1 Allowed 'General case' 0 C--N 1.342 0.241 0 C-N-CA 127.613 2.365 . . . . 4.6 113.284 161.385 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -50.8 109.16 0.29 Allowed 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.421 -0.955 . . . . 3.31 108.421 160.489 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 41.0 p -66.85 66.93 0.06 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.31 1.844 . . . . 2.75 111.469 -179.386 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -167.03 120.28 0.98 Allowed 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 128.472 2.709 . . . . 3.0 104.828 -167.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -87.55 97.9 11.1 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 107.514 -1.291 . . . . 1.13 107.514 -175.381 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 4.0 tttt -80.25 167.74 19.92 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 122.949 0.5 . . . . 4.1 109.691 -165.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -83.15 54.6 2.83 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.536 -0.727 . . . . 4.8 110.065 175.535 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -167.37 50.73 0.06 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.879 1.271 . . . . 2.2 107.713 111.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -93.21 -60.69 1.73 Allowed 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.286 -2.133 . . . . 1.85 108.34 140.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.467 ' CZ ' HD11 ' B' ' 80' ' ' ILE . 1.3 t80 -41.37 -50.45 3.79 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 126.135 1.774 . . . . 3.44 111.53 -173.621 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.595 ' CH2' ' CH2' ' A' ' 77' ' ' TRP . 25.8 t-105 -39.02 -45.99 1.3 Allowed 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 125.787 1.635 . . . . 4.81 111.78 178.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 40.9 mtt-85 -39.42 -52.4 2.08 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.374 1.07 . . . . 5.58 111.681 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 11.9 tp -52.17 -42.29 63.3 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.399 0.679 . . . . 1.09 111.384 -177.476 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.467 HD11 ' CZ ' ' B' ' 76' ' ' TYR . 4.1 mp -62.82 -33.47 60.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 N-CA-C 107.063 -1.458 . . . . 2.91 107.063 -175.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.485 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -67.41 -44.03 85.6 Favored Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 110.151 -1.18 . . . . 1.33 110.151 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -68.38 -54.75 15.12 Favored 'General case' 0 N--CA 1.437 -1.077 0 N-CA-C 108.185 -1.043 . . . . 2.34 108.185 -176.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.438 ' HB2' HD23 ' B' ' 49' ' ' LEU . 4.6 pp -57.52 -38.1 74.11 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.608 1.095 . . . . 1.94 111.924 177.094 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.28 -58.57 7.39 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 118.859 0.754 . . . . 1.66 109.912 173.071 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -51.79 -39.33 58.46 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.66 1.584 . . . . 1.49 111.802 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.42 ' OE1' ' NZ ' ' B' ' 51' ' ' LYS . 8.6 mm-40 -60.22 -24.15 64.62 Favored 'General case' 0 C--N 1.338 0.072 0 C-N-CA 125.063 1.345 . . . . 3.09 111.431 -176.788 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 5.0 tt -52.05 -39.45 26.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 118.897 0.771 . . . . 0.93 109.865 171.14 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 18.4 tpt180 -84.94 -54.46 4.64 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.747 1.219 . . . . 4.77 112.916 169.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -91.71 141.75 28.34 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.938 0.895 . . . . 5.0 112.397 -159.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . 0.282 16.6 pttp -80.75 -14.29 58.22 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 115.472 1.656 . . . . 6.56 115.472 -178.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 49.4 mtpt 73.93 49.77 0.12 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 127.128 2.171 . . . . 8.51 106.873 -143.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -56.2 -65.91 0.52 Allowed 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.153 1.781 . . . . 6.02 110.978 179.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 24.0 tp -126.63 137.71 53.34 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 105.649 -1.982 . . . . 7.91 105.649 168.712 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.22 140.45 58.87 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.268 1.027 . . . . 7.01 112.128 177.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 2.3 pt -79.0 105.3 8.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 123.074 0.55 . . . . 9.26 110.37 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.58 148.1 26.13 Favored 'General case' 0 N--CA 1.457 -0.086 0 O-C-N 121.355 -0.841 . . . . 7.26 109.494 165.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -178.16 136.14 0.17 Allowed 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 105.059 -2.2 . . . . 7.48 105.059 -177.414 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.253 1.265 0 N-CA-C 100.825 -3.768 . . . . 6.7 100.825 148.054 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.9 mtt . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 106.135 -1.802 . . . . 7.24 106.135 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.61 174.28 5.95 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 124.47 1.108 . . . . 4.88 110.091 177.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.09 99.11 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 128.957 2.903 . . . . 3.46 110.092 -178.612 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -110.1 100.36 43.41 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 125.661 1.584 . . . . 5.99 108.357 -176.142 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -71.96 154.98 58.04 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.306 2.004 . . . . 2.66 109.718 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.7 mt -118.06 176.83 5.03 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.856 1.262 . . . . 1.42 109.414 -169.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.482 HG22 ' CG ' ' A' ' 10' ' ' GLU . 1.0 OUTLIER -74.09 159.03 33.19 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.107 -0.996 . . . . 1.89 110.077 178.835 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -43.4 -56.52 3.53 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.237 1.015 . . . . 3.05 112.188 -178.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.8 mt -59.16 -47.38 85.53 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.178 -0.915 . . . . 1.31 110.818 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.482 ' CG ' HG22 ' A' ' 7' ' ' THR . 83.9 mt-10 -53.08 -50.92 63.42 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.354 1.061 . . . . 2.19 111.569 176.071 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -54.85 -53.06 60.23 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.488 0.661 . . . . 4.23 110.011 175.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 84.8 p -62.07 -44.03 97.56 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.867 -0.521 . . . . 1.6 111.69 -174.943 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.452 HG21 HD12 ' B' ' 83' ' ' LEU . 1.8 pp -65.38 -40.6 88.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 117.695 -1.145 . . . . 0.78 110.023 175.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -51.52 -55.84 16.77 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 119.779 1.172 . . . . 2.91 110.033 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.7 t -58.42 -36.82 74.19 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.469 0.544 . . . . 1.32 112.469 -171.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.3 m -77.67 -37.2 23.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 O-C-N 120.629 -1.294 . . . . 0.72 111.148 175.055 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.5 t -61.09 -43.55 96.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 124.394 1.078 . . . . 0.8 110.18 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -64.87 -49.35 70.86 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.576 0.625 . . . . 0.63 110.339 176.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 39.7 m -53.3 -44.62 68.49 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.307 0.643 . . . . 0.83 110.055 176.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -59.89 -61.97 2.22 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.037 0.935 . . . . 3.28 110.512 175.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -62.52 -41.28 98.75 Favored 'General case' 0 C--O 1.233 0.204 0 O-C-N 121.163 -0.96 . . . . 5.39 111.89 -171.053 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.1 t -65.6 -22.13 66.65 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 119.365 -0.35 . . . . 2.2 111.247 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -81.35 -43.09 19.55 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 118.415 0.552 . . . . 3.01 111.059 166.154 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.08 -28.78 62.92 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 126.304 1.842 . . . . 1.13 111.929 -166.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 33.6 ptt85 -66.38 -34.21 77.45 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.365 1.066 . . . . 3.59 112.383 177.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -41.18 -60.09 1.33 Allowed 'General case' 0 C--N 1.345 0.401 0 C-N-CA 124.604 1.162 . . . . 2.05 112.962 -163.586 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -106.05 75.75 1.12 Allowed 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 104.931 -2.248 . . . . 2.95 104.931 -178.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 60.21 164.16 0.16 Allowed Glycine 0 CA--C 1.533 1.204 0 C-N-CA 125.449 1.499 . . . . 1.6 114.478 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 28.72 100.38 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 128.104 2.562 . . . . 4.77 114.839 165.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.9 pttt -69.38 65.06 0.17 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.317 1.847 . . . . 3.37 112.741 -177.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -169.31 -45.08 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 127.571 2.348 . . . . 3.82 108.066 -175.166 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.96 110.92 19.24 Favored 'General case' 0 C--O 1.242 0.659 0 C-N-CA 127.548 2.339 . . . . 1.68 110.193 171.66 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.9 mp -91.3 124.52 35.56 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 118.776 -0.631 . . . . 2.55 109.549 172.03 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.9 t -100.05 -179.88 4.28 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 122.007 0.908 . . . . 2.48 111.109 172.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.6 m -57.59 -35.97 52.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 CA-C-N 114.958 -1.019 . . . . 2.94 112.923 -167.123 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -73.18 -50.72 21.0 Favored 'General case' 0 C--O 1.223 -0.316 0 N-CA-C 108.373 -0.973 . . . . 2.07 108.373 -177.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 62.3 mt-10 -46.09 -48.17 17.11 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.138 0.975 . . . . 1.86 110.901 172.327 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.17 -58.77 7.08 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.897 -0.592 . . . . 2.85 110.138 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.419 ' HA ' HG22 ' A' ' 42' ' ' VAL . 11.0 ttmm -58.0 -37.05 73.55 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 118.243 0.474 . . . . 2.44 111.577 -175.526 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -53.33 -44.98 68.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.735 0.814 . . . . 3.23 110.547 173.721 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -65.57 -50.28 65.71 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 119.441 1.019 . . . . 2.44 108.699 -172.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.419 HG22 ' HA ' ' A' ' 39' ' ' LYS . 31.0 m -62.66 -41.31 91.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 114.767 -1.106 . . . . 1.38 108.782 -173.478 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 96.6 m -62.19 -50.13 73.02 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.102 0.961 . . . . 2.32 111.235 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -62.77 -54.29 41.39 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.219 1.408 . . . . 3.71 111.818 -168.454 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -149.36 66.86 1.01 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 118.185 0.448 . . . . 4.36 110.336 -177.483 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.427 ' N ' ' CD ' ' A' ' 47' ' ' PRO . 2.5 tp -155.04 29.13 0.04 OUTLIER Pre-proline 0 CA--C 1.544 0.74 0 N-CA-C 114.049 1.129 . . . . 1.88 114.049 173.323 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 46' ' ' LEU . 58.8 Cg_endo -64.12 -46.14 8.69 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.943 2.429 . . . . 1.76 112.932 -166.082 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 -79.6 -45.53 18.98 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.47 -0.937 . . . . 5.16 108.47 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.553 ' CD2' ' HB2' ' A' ' 83' ' ' LEU . 3.4 tp -66.36 -44.24 83.74 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.455 -0.793 . . . . 1.55 111.996 -168.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.7 mt -129.16 75.02 1.62 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 119.191 0.905 . . . . 2.57 109.628 165.243 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.96 157.51 5.67 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.164 -0.926 . . . . 5.3 109.64 165.595 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 42.9 t0 61.21 74.05 0.46 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 123.378 1.561 . . . . 4.77 108.838 -164.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.2 m -76.97 4.38 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 CA-C-N 113.079 -1.873 . . . . 2.45 110.582 163.65 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.19 -66.89 1.69 Allowed Glycine 0 C--N 1.341 0.83 0 N-CA-C 107.924 -2.07 . . . . 1.92 107.924 179.475 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 29.2 t -76.28 63.36 1.9 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-O 123.227 1.489 . . . . 1.9 110.23 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -77.83 -31.42 51.59 Favored 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 127.978 2.511 . . . . 1.31 108.323 174.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -46.41 -51.16 15.57 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 127.102 2.161 . . . . 4.12 112.206 172.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.411 ' OE2' ' NZ ' ' A' ' 94' ' ' LYS . 37.9 tt0 -55.78 -53.97 50.16 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.436 -0.579 . . . . 2.92 109.436 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.4 -48.75 78.26 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 109.119 -0.697 . . . . 3.3 109.119 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 8.2 ttt -48.89 -53.73 18.33 Favored 'General case' 0 C--O 1.227 -0.099 0 C-N-CA 123.861 0.864 . . . . 2.32 109.976 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -60.19 -45.78 91.97 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 119.798 -0.144 . . . . 3.13 111.003 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 26.6 m -60.67 -41.45 95.1 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.291 0.478 . . . . 2.41 112.291 177.398 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.8 mt -71.39 -56.17 6.51 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.178 0.991 . . . . 1.84 110.77 -176.139 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -75.09 82.41 2.28 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.356 0.663 . . . . 2.42 109.83 -170.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.9 m -45.04 -39.92 2.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 124.492 1.117 . . . . 1.67 113.548 -173.862 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 23.9 p-10 -97.46 -4.32 38.34 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.93 0.715 . . . . 2.61 112.93 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 51.03 50.1 19.81 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.325 1.85 . . . . 3.31 111.243 177.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.9 p30 -82.2 -42.32 19.14 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.468 0.707 . . . . 2.28 110.291 176.901 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.4 m 99.92 16.56 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 129.652 3.181 . . . . 1.74 112.112 -170.436 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 70.8 mt-10 -116.23 108.62 16.35 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 105.145 -2.168 . . . . 2.89 105.145 161.268 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -79.04 87.42 4.83 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 102.312 -3.218 . . . . 1.16 102.312 168.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.36 145.9 50.0 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.841 -1.541 . . . . 3.38 106.841 177.511 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -37.61 -51.78 1.2 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.775 1.398 . . . . 5.39 114.775 -169.385 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -73.3 -26.5 61.09 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.519 1.054 . . . . 1.67 112.167 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -63.79 -60.36 3.39 Favored 'General case' 0 C--N 1.341 0.238 0 N-CA-C 108.338 -0.986 . . . . 2.34 108.338 164.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -50.59 -44.41 56.88 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.253 0.621 . . . . 3.19 110.604 -175.239 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.671 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 41.7 t90 -44.32 -38.22 3.78 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 125.498 1.519 . . . . 4.32 111.887 -178.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 13.2 mmt85 -39.72 -46.6 1.9 Allowed 'General case' 0 C--N 1.341 0.238 0 C-N-CA 124.06 0.944 . . . . 4.01 111.619 173.075 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 12.7 tp -49.58 -50.59 41.85 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.974 0.909 . . . . 0.86 111.492 178.813 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.6 mp -64.7 -24.21 35.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 107.616 -1.253 . . . . 1.75 107.616 -176.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.59 ' CA ' ' CZ2' ' B' ' 77' ' ' TRP . . . -69.79 -55.21 9.94 Favored Glycine 0 CA--C 1.49 -1.525 0 C-N-CA 125.334 1.445 . . . . 1.32 111.822 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.69 -47.19 77.21 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 107.389 -1.337 . . . . 2.39 107.389 -177.476 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.553 ' HB2' ' CD2' ' A' ' 49' ' ' LEU . 4.0 pp -74.09 -39.97 63.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 115.098 1.518 . . . . 2.11 115.098 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.99 -31.95 63.51 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 121.236 -0.915 . . . . 1.2 110.228 170.935 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -79.7 -42.41 24.74 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 124.809 1.244 . . . . 1.93 111.461 175.255 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -45.36 -42.15 9.71 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 126.123 1.769 . . . . 2.93 110.626 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.8 tt -46.46 -32.25 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 123.697 0.799 . . . . 1.65 112.638 178.555 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -121.93 -18.83 6.88 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.925 1.083 . . . . 4.94 113.925 177.431 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.4 tttp -77.91 69.17 4.09 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 123.177 1.465 . . . . 3.38 109.139 175.835 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.73 -34.51 0.11 Allowed 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 130.16 3.384 . . . . 11.16 117.258 -167.488 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -158.44 61.53 0.44 Allowed 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 107.234 -1.395 . . . . 8.29 107.234 175.809 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . 0.261 7.5 p-10 7.57 -111.12 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 128.772 2.829 . . . . 9.88 116.616 172.121 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.0 tp -97.86 -45.25 6.38 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.144 2.578 . . . . 12.33 108.065 155.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.411 ' NZ ' ' OE2' ' A' ' 58' ' ' GLU . 16.6 mmtt -74.34 -173.56 1.74 Allowed 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 126.159 1.783 . . . . 15.83 110.027 -171.808 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' ILE . . . . . 0.537 HD13 ' H ' ' A' ' 95' ' ' ILE . 0.1 OUTLIER -120.32 160.82 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 C-N-CA 124.473 1.109 . . . . 12.11 108.11 171.219 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 9.8 ttt85 -149.46 -68.27 0.21 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 122.919 0.488 . . . . 15.41 109.86 -166.094 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.9 tttp 177.01 138.24 0.07 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 105.573 -2.01 . . . . 10.57 105.573 -168.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 63.5 pttt . . . . . 0 C--O 1.252 1.194 0 N-CA-C 105.048 -2.204 . . . . 14.76 105.048 150.584 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 117.273 -1.346 . . . . 5.91 108.449 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 86.94 167.42 0.07 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 127.32 2.248 . . . . 6.34 113.02 178.218 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.66 100.24 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 130.252 3.421 . . . . 6.27 109.431 -166.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -132.43 -78.15 0.01 OUTLIER Pre-proline 0 CA--C 1.555 1.154 0 CA-C-O 117.22 -1.372 . . . . 5.79 114.337 -159.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -74.85 156.84 43.67 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 122.869 2.379 . . . . 3.95 112.779 -171.203 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.3 mt -141.68 134.41 28.58 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.22 0.608 . . . . 2.97 110.364 -165.767 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.617 HG22 ' CD ' ' B' ' 10' ' ' GLU . 15.3 t -73.98 -154.35 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.543 0.737 . . . . 1.94 109.924 156.885 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -84.13 -62.02 1.67 Allowed 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 121.073 -1.017 . . . . 3.1 111.866 -164.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 mt -47.08 -43.8 20.58 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 120.611 1.55 . . . . 1.26 111.715 168.283 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.617 ' CD ' HG22 ' B' ' 7' ' ' THR . 90.6 mt-10 -53.83 -44.58 70.36 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.541 1.136 . . . . 3.07 111.676 173.917 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -35.07 63.58 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.026 -1.671 . . . . 3.86 111.705 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 22.9 t -59.14 -47.19 86.19 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.717 0.807 . . . . 1.81 110.551 177.438 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.263 2.2 pp -58.05 -37.2 60.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 O-C-N 121.124 -0.985 . . . . 1.14 111.522 172.232 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -58.4 -55.17 38.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.663 0.665 . . . . 2.98 110.137 174.952 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . 0.251 4.0 t -54.2 -33.27 57.83 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.247 0.931 . . . . 1.37 112.617 -172.042 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 33.9 m -78.43 -44.35 26.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 119.008 0.822 . . . . 1.08 111.522 173.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 38.2 t -53.23 -46.74 56.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-O 119.025 -0.512 . . . . 1.14 110.491 177.423 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 15.3 t -62.38 -45.89 91.08 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.15 0.886 . . . . 1.46 111.43 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 20.4 m -54.82 -50.65 68.06 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 120.621 1.555 . . . . 1.2 109.788 174.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -55.21 -51.46 66.5 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.207 0.603 . . . . 7.13 110.513 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -64.06 -48.26 76.93 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 126.505 1.922 . . . . 2.73 111.285 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 30.4 p -57.36 -53.29 59.82 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.412 -0.588 . . . . 2.16 109.412 176.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -56.1 -39.57 72.36 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.782 0.719 . . . . 3.07 111.258 175.286 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.32 -29.23 63.77 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.266 1.026 . . . . 1.21 110.851 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -53.74 -32.0 50.51 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 118.105 -0.95 . . . . 4.64 111.494 176.696 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.16 -65.99 0.47 Allowed 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 116.033 1.864 . . . . 2.2 116.033 -143.142 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 71.7 mt-10 -91.72 -74.87 0.49 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.846 0.831 . . . . 3.7 112.319 -175.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.46 163.73 28.9 Favored Glycine 0 C--N 1.336 0.563 0 C-N-CA 126.898 2.19 . . . . 1.96 111.361 167.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 38.1 ttm180 36.25 102.93 0.0 OUTLIER 'General case' 0 C--O 1.242 0.709 0 C-N-CA 125.675 1.59 . . . . 4.12 115.155 142.386 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -72.11 34.82 0.06 Allowed 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 115.213 1.56 . . . . 3.36 115.213 -173.254 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -147.8 -50.82 0.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.458 -0.942 . . . . 4.05 108.458 -167.799 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 20.2 m -87.43 130.68 34.58 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-N 115.851 -0.613 . . . . 1.96 109.837 173.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -87.11 160.19 18.64 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.488 1.515 . . . . 2.44 109.186 172.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 7.0 m -154.71 169.51 23.75 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.787 0.835 . . . . 2.18 109.699 -167.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.55 120.36 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 101.503 -3.517 . . . . 3.69 101.503 152.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -118.1 98.45 6.32 Favored 'General case' 0 C--N 1.331 -0.198 1 C-N-CA 131.944 4.098 . . . . 2.31 107.309 9.889 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -155.03 -52.49 0.09 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 113.592 -1.64 . . . . 2.43 106.852 -175.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -59.3 -49.35 78.18 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 114.132 -1.394 . . . . 1.98 108.314 176.148 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -58.38 -36.83 74.11 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 120.259 -0.576 . . . . 2.77 110.631 -175.569 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -58.0 -38.83 76.89 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 112.512 0.56 . . . . 2.7 112.512 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 7.7 tp -66.75 -47.79 71.15 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 119.207 0.912 . . . . 1.96 108.849 -178.288 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 16.2 m -69.59 -39.01 77.82 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.814 -0.63 . . . . 0.72 109.536 -172.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 97.8 m -64.21 -60.1 3.61 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.446 0.698 . . . . 1.01 110.604 174.9 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -81.83 -57.39 3.45 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.701 0.8 . . . . 1.99 111.939 -166.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -82.47 -40.61 20.89 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.709 1.204 . . . . 3.11 112.74 -167.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 18.4 tp -81.0 -19.16 0.27 Allowed Pre-proline 0 CA--C 1.538 0.499 0 N-CA-C 116.095 1.887 . . . . 1.97 116.095 -167.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -30.67 -63.26 0.1 Allowed 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 124.82 3.68 . . . . 1.75 116.938 -126.355 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -80.7 -51.26 8.89 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.87 0.759 . . . . 2.11 112.799 -162.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.418 HD23 ' HB2' ' B' ' 83' ' ' LEU . 17.5 tp -18.84 -62.82 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 127.296 2.238 . . . . 1.72 116.329 -175.156 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 pp -117.71 145.22 44.58 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-O 121.354 0.597 . . . . 2.53 109.438 168.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.22 163.2 18.82 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.558 -0.746 . . . . 5.8 111.054 -173.637 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 61.1 t0 57.35 66.73 1.09 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 124.606 2.146 . . . . 3.73 110.236 172.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 18.3 m -71.82 8.59 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.892 0 CA-C-N 110.486 -3.052 . . . . 1.91 111.171 157.26 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -83.59 -55.37 2.87 Favored Glycine 0 C--N 1.343 0.933 0 N-CA-C 108.467 -1.853 . . . . 2.33 108.467 179.138 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 17.2 t -69.05 59.16 0.1 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.811 2.445 . . . . 2.55 109.83 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -86.16 -29.5 23.2 Favored 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 124.257 1.023 . . . . 1.12 110.348 -172.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -57.75 -46.45 84.47 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.845 0.858 . . . . 3.71 110.281 173.59 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -51.51 -60.27 3.33 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.174 0.99 . . . . 2.48 109.832 171.863 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.07 -49.05 74.87 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.846 0.458 . . . . 3.24 109.957 -176.734 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tpt -49.05 -56.84 7.77 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 126.464 1.906 . . . . 3.04 108.614 178.346 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -60.83 -39.73 90.12 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 111.624 0.231 . . . . 3.57 111.624 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.6 t -58.35 -39.05 78.49 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.83 0.452 . . . . 1.64 111.322 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 3.5 mp -74.61 -52.89 10.48 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.549 -0.719 . . . . 1.6 111.956 174.153 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -54.39 -10.9 0.44 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 116.939 2.2 . . . . 1.46 116.939 -163.962 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 28.1 m -34.27 -22.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 130.591 3.557 . . . . 1.49 118.906 -137.855 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -57.26 -24.48 55.1 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.669 1.577 . . . . 2.72 111.608 163.625 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 69.73 56.62 0.33 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.119 1.367 . . . . 3.37 110.871 168.358 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 47.2 p30 -110.6 -12.29 14.36 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.578 1.551 . . . . 1.79 111.898 177.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 14.2 m 72.96 1.08 3.9 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.41 1.884 . . . . 2.08 114.154 -174.915 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -105.14 107.15 17.98 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.351 1.46 . . . . 2.98 107.594 169.299 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -80.86 94.86 6.54 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 107.354 -1.35 . . . . 1.03 107.354 -179.364 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 7.6 ptmt -83.38 175.11 10.09 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.03 0.532 . . . . 3.37 110.248 -173.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 40.7 p90 -93.76 52.87 1.74 Allowed 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.616 -0.677 . . . . 4.55 111.996 -175.27 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -155.62 49.54 0.54 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.377 -0.971 . . . . 2.46 108.377 112.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -93.32 -62.09 1.44 Allowed 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 107.475 -1.306 . . . . 2.13 107.475 142.23 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -46.85 -48.28 21.02 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 126.431 1.893 . . . . 4.12 112.156 -172.505 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.671 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 7.5 t-105 -40.34 -40.68 1.22 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.754 1.222 . . . . 4.83 111.916 175.662 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 8.3 mtp-105 -39.54 -46.31 1.72 Allowed 'General case' 0 C--N 1.347 0.462 0 C-N-CA 124.11 0.964 . . . . 4.97 112.681 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.0 tp -54.68 -38.73 67.33 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 118.861 -0.59 . . . . 0.8 110.922 -176.47 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 68.3 mt -58.66 -38.09 69.45 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 N-CA-C 109.17 -0.678 . . . . 1.41 109.17 -177.379 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.575 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -74.2 -42.83 34.41 Favored Glycine 0 CA--C 1.488 -1.655 0 N-CA-C 110.715 -0.954 . . . . 1.25 110.715 -174.264 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 82' ' ' GLU . . . . . 0.405 ' C ' ' HG2' ' B' ' 86' ' ' GLU . 1.8 mm-40 -64.38 -63.27 1.18 Allowed 'General case' 0 N--CA 1.427 -1.616 0 N-CA-C 104.722 -2.325 . . . . 2.18 104.722 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.452 HD12 HG21 ' A' ' 13' ' ' ILE . 3.4 pp -52.12 -38.97 59.16 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.069 0.849 . . . . 1.92 111.948 -176.068 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.2 -60.04 3.86 Favored 'General case' 0 C--N 1.341 0.212 0 N-CA-C 112.237 0.458 . . . . 1.41 112.237 171.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.18 -35.15 66.35 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.001 0.819 . . . . 1.57 111.71 -174.112 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.405 ' HG2' ' C ' ' B' ' 82' ' ' GLU . 0.9 OUTLIER -48.62 -34.21 11.24 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 125.719 1.607 . . . . 2.93 110.524 -178.509 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 11.8 tt -39.94 -48.29 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 123.972 0.909 . . . . 1.06 110.839 174.077 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 49.3 ttt180 -85.72 -56.76 3.34 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.339 1.455 . . . . 4.19 111.692 168.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 18.2 mttt -86.13 58.31 4.98 Favored 'General case' 0 N--CA 1.461 0.11 0 C-N-CA 124.957 1.303 . . . . 7.35 112.859 -157.592 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -38.57 -42.69 0.79 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 127.401 2.281 . . . . 5.32 114.244 -171.766 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.67 44.66 0.85 Allowed 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.491 -0.929 . . . . 7.26 108.491 174.932 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -140.0 70.07 1.36 Allowed 'General case' 0 C--O 1.231 0.1 0 N-CA-C 109.119 -0.697 . . . . 4.34 109.119 -159.524 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -142.41 -66.3 0.39 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.929 1.085 . . . . 5.44 113.929 -167.888 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.97 170.79 0.88 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.209 1.404 . . . . 9.33 108.686 -171.945 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 20.7 tt -145.92 155.14 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 125.85 1.66 . . . . 7.13 106.621 176.093 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 5.0 tmm_? -61.93 131.98 51.49 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 109.872 -0.418 . . . . 8.55 109.872 -176.747 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 30.0 mttp -174.66 135.4 0.4 Allowed 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 128.18 2.592 . . . . 9.85 104.488 -176.946 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 9.7 tptp . . . . . 0 C--O 1.253 1.258 0 N-CA-C 103.586 -2.746 . . . . 7.13 103.586 -176.077 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.6 ptt? . . . . . 0 N--CA 1.469 0.511 0 CA-C-O 118.753 -0.641 . . . . 11.19 112.011 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -136.6 43.12 2.46 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.782 0.719 . . . . 3.37 111.808 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 75.05 78.15 0.11 Allowed 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 125.501 1.52 . . . . 5.09 109.492 168.409 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -121.74 63.92 16.03 Favored Pre-proline 0 N--CA 1.442 -0.865 0 C-N-CA 124.891 1.276 . . . . 6.03 107.625 -173.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -64.02 149.22 90.95 Favored 'Trans proline' 0 N--CA 1.451 -1.002 0 N-CA-C 107.65 -1.711 . . . . 2.23 107.65 172.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.53 -164.19 0.92 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.729 -0.841 . . . . 1.6 108.729 -172.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.406 ' HB ' ' HB2' ' A' ' 10' ' ' GLU . 7.3 m -64.93 140.92 58.92 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 120.914 -1.116 . . . . 3.97 109.615 177.554 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -39.51 -56.52 1.62 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.159 0.984 . . . . 2.86 112.322 173.748 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.1 mt -69.62 -38.75 77.36 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.257 -0.902 . . . . 1.64 112.153 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.406 ' HB2' ' HB ' ' A' ' 7' ' ' THR . 80.6 tt0 -50.04 -49.45 51.02 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.802 1.241 . . . . 3.17 111.16 170.867 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -52.25 -52.11 54.48 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.583 0.753 . . . . 4.25 109.077 173.161 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.9 p -63.19 -42.37 99.33 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.241 -0.436 . . . . 1.81 111.765 -173.622 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.28 2.6 pp -71.1 -36.15 61.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 O-C-N 121.742 -0.599 . . . . 0.6 110.405 179.079 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -55.46 -56.03 24.9 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.122 0.874 . . . . 2.66 109.678 172.647 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.2 t -58.57 -28.63 65.71 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 119.712 -0.795 . . . . 1.32 112.75 -170.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.7 m -80.72 -39.56 18.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 O-C-N 121.361 -0.837 . . . . 0.63 111.556 170.976 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.8 t -54.57 -46.89 72.35 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 119.267 0.939 . . . . 0.53 110.743 175.42 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.5 t -59.25 -46.88 87.31 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.715 1.143 . . . . 0.79 111.055 176.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.6 m -59.63 -39.3 83.83 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.848 0.859 . . . . 0.97 110.839 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -56.63 -61.13 2.64 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.474 0.71 . . . . 3.64 109.635 168.608 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -62.09 -45.97 91.16 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.81 0.844 . . . . 2.78 110.801 -164.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -59.79 -33.57 71.89 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.526 -0.306 . . . . 1.99 110.935 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -76.98 -41.57 42.42 Favored 'General case' 0 C--O 1.22 -0.472 0 O-C-N 121.921 -0.487 . . . . 2.76 111.338 173.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.38 -25.76 66.13 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 125.442 1.497 . . . . 0.99 111.604 -169.351 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -71.21 -25.18 62.39 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 117.079 -1.439 . . . . 3.96 113.329 175.871 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -44.11 -53.82 6.08 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-N 119.742 1.156 . . . . 1.69 112.355 -167.367 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -124.26 170.71 10.5 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 106.422 -1.695 . . . . 2.7 106.422 176.042 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -7.87 119.15 0.01 OUTLIER Glycine 0 CA--C 1.537 1.409 0 C-N-CA 127.47 2.462 . . . . 1.86 115.972 177.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 60.4 105.33 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.397 1.479 . . . . 6.19 114.885 159.257 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -72.56 60.87 0.49 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.467 1.107 . . . . 3.94 113.471 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -147.65 -48.1 0.17 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 129.02 2.928 . . . . 4.88 105.419 167.712 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -81.77 117.15 21.84 Favored 'General case' 0 C--O 1.242 0.669 0 C-N-CA 128.141 2.576 . . . . 1.66 111.116 174.949 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.402 HD22 ' CD1' ' A' ' 76' ' ' TYR . 6.7 mp -89.27 132.48 34.88 Favored 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 122.661 0.384 . . . . 2.3 110.068 164.434 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 29.1 t -82.23 174.67 10.95 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.473 1.509 . . . . 2.46 109.313 175.644 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.6 t -55.07 -46.34 77.33 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 108.893 -0.78 . . . . 2.18 108.893 172.412 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -54.8 -62.3 1.75 Allowed 'General case' 0 C--N 1.34 0.179 0 C-N-CA 123.056 0.543 . . . . 4.05 109.897 176.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -49.78 -48.4 50.5 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 124.435 1.094 . . . . 1.96 110.857 -177.365 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.588 ' CZ ' HD21 ' A' ' 56' ' ' LEU . 3.7 t80 -61.59 -55.89 25.87 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 116.197 -0.456 . . . . 2.71 110.567 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 40.3 tttt -60.14 -38.18 82.3 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.549 -0.72 . . . . 2.86 111.174 -174.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -54.74 -34.23 62.22 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.813 -0.613 . . . . 2.55 112.087 174.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.81 -55.64 21.51 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 119.751 1.16 . . . . 2.69 108.407 -177.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.9 m -65.94 -38.56 82.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 CA-C-N 115.042 -0.981 . . . . 1.06 109.464 -172.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.8 m -60.84 -52.49 64.84 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 123.627 0.771 . . . . 1.2 110.865 174.156 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -76.25 -51.2 12.52 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.039 0.536 . . . . 2.49 111.709 -167.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -146.02 78.25 1.52 Allowed 'General case' 0 CA--C 1.523 -0.086 0 C-N-CA 123.006 0.522 . . . . 3.56 110.1 -175.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.4 tp -153.78 48.99 0.45 Allowed Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 113.313 0.857 . . . . 1.72 113.313 159.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -68.02 139.81 48.04 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.793 2.329 . . . . 4.05 111.984 -177.696 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 76.48 -1.74 2.84 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.241 1.417 . . . . 3.97 113.681 165.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 11.1 tp -100.47 -92.25 0.29 Allowed 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 124.313 1.045 . . . . 1.31 110.565 -175.688 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 28.6 mt -65.74 -42.06 91.43 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 118.283 0.492 . . . . 3.15 110.864 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt 57.1 -168.59 0.11 Allowed 'General case' 0 C--N 1.344 0.367 0 C-N-CA 123.185 0.594 . . . . 7.16 110.869 -160.818 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.6 t0 60.39 44.11 12.56 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 124.028 1.871 . . . . 3.94 110.447 175.114 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.4 m -53.48 -24.32 8.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 112.76 -2.018 . . . . 2.5 110.796 159.031 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -62.99 -78.31 0.18 Allowed Glycine 0 CA--C 1.528 0.88 0 N-CA-C 110.64 -0.984 . . . . 1.52 110.64 171.276 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.25 32.34 0.5 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.229 1.012 . . . . 2.97 111.528 -167.208 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.588 HD21 ' CZ ' ' A' ' 38' ' ' PHE . 3.2 tm? -50.31 -37.55 37.13 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 124.761 1.225 . . . . 1.37 110.022 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.91 -19.74 45.23 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.25 1.82 . . . . 4.33 113.682 -177.317 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -80.18 -41.23 25.68 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 120.62 1.554 . . . . 2.98 110.351 166.234 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.66 -47.19 70.6 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 108.515 -0.92 . . . . 2.9 108.515 174.749 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -43.96 -51.83 7.4 Favored 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 124.688 1.195 . . . . 1.47 110.153 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.5 mttp -69.39 -47.47 64.11 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 110.333 -0.247 . . . . 3.87 110.333 -177.075 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.5 m -57.29 -31.49 65.68 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.31 0.644 . . . . 2.73 112.476 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.1 mt -75.69 -60.17 2.43 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.155 1.382 . . . . 2.0 109.409 174.939 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -76.43 75.37 3.18 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 123.685 0.794 . . . . 1.84 110.717 -174.429 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.2 m -49.55 -34.49 8.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.203 1.001 . . . . 2.41 113.059 -179.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -89.86 -32.28 16.96 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.19 0.596 . . . . 2.99 112.127 -178.454 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 56.85 44.1 23.84 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.296 1.038 . . . . 3.08 111.466 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 23.8 p30 -50.95 -42.1 59.61 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.14 0.976 . . . . 2.13 110.02 155.658 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.6 t 113.25 18.37 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.635 1 C-N-CA 131.706 4.002 . . . . 1.7 112.277 -174.325 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -134.24 126.98 30.96 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.802 1.241 . . . . 4.65 109.211 178.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -80.43 77.58 7.2 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 104.218 -2.512 . . . . 1.25 104.218 168.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.1 tppt? -49.93 153.76 1.25 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 128.124 2.569 . . . . 4.0 108.885 173.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -38.95 -59.95 0.91 Allowed 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.352 1.433 . . . . 5.43 112.836 -166.165 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.08 -40.03 96.45 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.096 0.558 . . . . 1.81 110.853 -177.022 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -64.06 -41.72 97.26 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.176 0.591 . . . . 2.38 111.278 177.467 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.402 ' CD1' HD22 ' A' ' 33' ' ' LEU . 31.5 t80 -68.64 -53.86 19.92 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 118.937 0.79 . . . . 2.66 109.31 176.122 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.508 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.7 OUTLIER -40.5 -42.19 1.59 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.317 1.047 . . . . 4.82 108.918 176.216 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 11.3 ttt180 -38.69 -52.39 1.67 Allowed 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 117.868 -1.063 . . . . 5.02 111.266 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.4 tp -43.77 -42.47 5.55 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 123.929 0.892 . . . . 0.71 111.085 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 29.5 mt -68.66 -43.61 83.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 C-N-CA 125.81 1.644 . . . . 1.45 108.066 -174.238 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -59.46 -47.76 89.32 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 110.591 -1.004 . . . . 1.22 110.591 172.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -58.42 -39.94 81.14 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 124.156 0.982 . . . . 2.52 109.898 178.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 13.7 mt -56.76 -48.62 77.44 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 120.069 1.304 . . . . 2.33 110.984 174.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.36 -27.71 64.45 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.222 0.609 . . . . 1.23 111.86 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.2 ttmt -75.58 -60.64 2.22 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.333 0.653 . . . . 1.86 109.744 168.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -48.67 -49.3 38.15 Favored 'General case' 0 C--N 1.334 -0.068 0 C-N-CA 125.861 1.664 . . . . 2.34 111.223 -172.791 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.9 tt -51.2 -39.78 21.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 C-N-CA 122.577 0.351 . . . . 1.1 111.625 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.43 -31.02 26.83 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.015 1.326 . . . . 4.47 109.965 -177.025 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.4 ' NZ ' ' OD1' ' A' ' 92' ' ' ASP . 43.4 tttm -107.16 32.49 4.58 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.561 1.544 . . . . 4.15 112.138 -168.714 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 58.4 mttt -67.18 -65.15 0.72 Allowed 'General case' 0 CA--C 1.533 0.323 0 O-C-N 120.888 -1.133 . . . . 8.0 112.684 -173.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -62.27 -24.82 67.49 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 118.941 0.791 . . . . 12.12 112.312 -169.406 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.4 ' OD1' ' NZ ' ' A' ' 89' ' ' LYS . 0.1 OUTLIER -56.49 -39.69 73.69 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.217 1.807 . . . . 6.45 111.671 173.802 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 21.1 tp -125.94 -55.72 1.48 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.902 0.881 . . . . 9.87 110.72 -168.798 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -69.04 162.83 26.05 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 109.192 -0.67 . . . . 14.18 109.192 175.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 19.5 tt -49.71 144.16 1.7 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.809 -0.632 . . . . 10.73 109.804 170.176 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -62.18 100.58 0.17 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.541 0.737 . . . . 12.86 109.863 -175.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -174.24 140.63 0.68 Allowed 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 126.233 1.813 . . . . 12.67 107.495 -161.917 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.409 ' NZ ' ' OE1' ' B' ' 4' ' ' GLU . 3.7 ptmt . . . . . 0 C--O 1.253 1.266 0 C-N-CA 126.093 1.757 . . . . 11.63 112.517 166.767 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.338 1.5 ppp? . . . . . 0 N--CA 1.47 0.546 0 CA-C-O 116.853 -1.546 . . . . 6.28 107.044 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.42 . . 79.05 -171.25 0.05 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.429 1.013 . . . . 4.27 113.363 166.197 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 83.3 79.37 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 127.9 2.48 . . . . 5.39 114.456 171.527 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.409 ' OE1' ' NZ ' ' A' ' 98' ' ' LYS . 6.2 mt-10 -150.12 158.73 36.39 Favored Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 125.641 1.576 . . . . 5.55 107.427 159.526 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.09 159.31 53.62 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 123.883 3.056 . . . . 3.24 111.609 -177.554 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.7 mt -132.98 -127.49 0.18 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.139 0.575 . . . . 2.37 110.762 -158.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 1.7 t -129.43 -79.9 0.56 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.857 1.263 . . . . 2.62 112.381 -174.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -159.5 -71.32 0.08 Allowed 'General case' 0 C--N 1.342 0.263 0 CA-C-N 119.38 0.991 . . . . 2.32 109.256 -176.021 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.2 mt -50.98 -49.67 59.77 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.522 -0.736 . . . . 1.05 110.106 169.026 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 22.8 mp0 -50.68 -46.17 58.57 Favored 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 124.636 1.175 . . . . 3.91 111.788 173.16 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -60.34 -41.18 93.04 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.519 -0.738 . . . . 4.44 110.398 176.485 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 31.6 p -64.96 -39.3 93.28 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.595 -0.691 . . . . 1.61 111.51 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.322 2.8 pp -69.57 -32.44 52.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 O-C-N 121.524 -0.735 . . . . 0.8 111.41 172.006 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -58.76 -57.27 13.78 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.466 -0.771 . . . . 2.79 110.339 173.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.4 t -51.52 -39.46 57.71 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.762 0.71 . . . . 1.35 111.731 -171.879 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 23.2 m -72.68 -37.02 54.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 120.995 -1.066 . . . . 0.76 111.896 176.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 42.1 t -60.57 -45.27 97.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 119.43 1.014 . . . . 0.89 110.786 173.436 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -66.22 -41.4 90.15 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.98 -1.075 . . . . 1.11 110.783 176.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 61.6 m -59.23 -46.7 87.78 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.151 0.887 . . . . 0.99 110.826 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -48.25 -61.86 1.78 Allowed 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 108.073 -1.084 . . . . 3.85 108.073 169.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -52.95 -52.81 56.71 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.203 1.001 . . . . 3.21 112.238 -172.498 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 7.1 t -61.55 -29.97 70.35 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 119.075 -0.488 . . . . 2.67 111.826 -174.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -81.69 -40.25 23.09 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 119.358 0.981 . . . . 3.01 111.538 170.381 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.16 -25.26 65.4 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 126.913 2.085 . . . . 0.9 112.653 -168.391 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 20.3 ptt180 -58.62 -28.86 66.04 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 117.675 -1.155 . . . . 5.09 112.9 172.23 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -52.01 -63.83 1.01 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 115.448 1.647 . . . . 2.12 115.448 -155.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -88.93 -76.74 0.4 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.361 0.6 . . . . 3.33 112.384 -166.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.75 165.38 27.03 Favored Glycine 0 C--N 1.337 0.635 0 C-N-CA 127.791 2.615 . . . . 2.15 110.885 158.634 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 38.94 103.07 0.0 OUTLIER 'General case' 0 C--O 1.238 0.487 0 N-CA-C 115.973 1.842 . . . . 3.63 115.973 139.121 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 18.3 pttm -54.58 -32.08 57.96 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.948 1.299 . . . . 3.97 114.033 174.642 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -79.37 -33.43 42.88 Favored 'General case' 0 CA--C 1.531 0.226 0 O-C-N 121.591 -0.693 . . . . 4.05 111.626 -173.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.0 p -100.73 130.23 46.74 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.953 -0.758 . . . . 1.69 108.953 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.26 170.72 4.39 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 122.486 1.136 . . . . 1.98 108.995 161.894 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 4.7 m -157.24 -173.5 4.46 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 106.259 -1.756 . . . . 3.57 106.259 -154.37 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 93.3 t -71.77 -111.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 101.397 -3.557 . . . . 3.13 101.397 -175.926 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -75.07 59.68 0.97 Allowed 'General case' 0 CA--C 1.551 0.998 0 O-C-N 119.597 -1.94 . . . . 2.38 110.074 -176.856 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -115.37 -52.05 2.67 Favored 'General case' 0 N--CA 1.452 -0.347 1 C-N-CA 132.574 4.35 . . . . 2.45 107.621 144.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -56.31 -50.33 71.76 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.677 -1.231 . . . . 2.89 107.677 173.347 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 7.8 tttp -56.0 -39.5 71.97 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 121.02 -0.272 . . . . 2.96 110.723 178.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -56.36 -45.06 80.64 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 122.642 0.377 . . . . 2.55 110.745 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 7.2 tt -64.23 -48.83 74.31 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.381 -0.97 . . . . 2.15 108.381 -174.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.406 HG21 HD23 ' B' ' 56' ' ' LEU . 6.8 m -67.05 -42.69 88.78 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-N 115.773 -0.649 . . . . 0.8 109.899 -173.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 88.1 m -61.22 -53.33 58.28 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.929 0.892 . . . . 0.97 110.843 175.72 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -76.76 -61.16 2.06 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 124.036 0.935 . . . . 1.85 110.617 -167.167 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -82.64 -53.13 6.18 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.72 0.408 . . . . 2.85 110.575 -173.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 5.8 tp -83.47 -18.77 0.26 Allowed Pre-proline 0 CA--C 1.542 0.653 0 N-CA-C 121.281 3.808 . . . . 2.29 121.281 -143.163 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -46.17 -54.81 4.26 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 CA-C-N 123.108 2.146 . . . . 3.08 116.154 -145.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -79.69 55.85 2.12 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 118.971 0.805 . . . . 2.44 112.055 -175.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 33.2 tp -147.39 -87.1 0.09 Allowed 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 125.898 1.679 . . . . 1.3 107.117 170.624 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 53.1 mt -73.99 77.46 1.69 Allowed 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 107.29 -1.374 . . . . 1.87 107.29 165.17 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.5 151.76 2.15 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.247 -0.888 . . . . 5.59 109.583 174.77 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 61.3 t0 66.7 73.47 0.35 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 123.665 1.697 . . . . 3.59 108.893 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 14.3 m -78.42 6.68 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 CA-C-N 112.172 -2.285 . . . . 1.55 110.284 163.803 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -74.11 -58.9 4.15 Favored Glycine 0 C--N 1.342 0.904 0 N-CA-C 106.681 -2.568 . . . . 2.35 106.681 172.907 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 1.7 t -77.34 49.07 0.68 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.706 0.765 . . . . 2.62 110.46 172.48 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.406 HD23 HG21 ' B' ' 42' ' ' VAL . 2.2 tm? -62.32 -47.47 84.12 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 107.634 -1.247 . . . . 0.96 107.634 167.745 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -63.25 -30.72 71.81 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.844 0.857 . . . . 4.59 111.221 -165.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -52.98 -59.94 3.91 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.132 0.973 . . . . 2.41 110.113 163.82 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -58.51 -39.42 80.04 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.436 -0.792 . . . . 4.62 109.982 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -52.49 -55.77 19.74 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 119.066 0.848 . . . . 1.84 109.232 174.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 35.1 mtmt -58.1 -40.9 82.35 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.226 0.921 . . . . 3.29 111.954 176.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 18.0 t -61.35 -25.27 67.04 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.734 -0.604 . . . . 1.75 112.475 173.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.831 ' HB3' HD11 ' B' ' 71' ' ' LEU . 1.2 tp -81.95 -52.07 7.43 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.035 1.734 . . . . 2.44 110.625 176.929 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -62.16 -13.73 30.17 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 128.662 2.785 . . . . 1.67 115.211 -164.187 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 30.1 m -35.98 -27.12 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 C-N-CA 130.931 3.693 . . . . 1.48 118.456 -130.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -65.25 -11.52 42.05 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.603 1.092 . . . . 2.37 111.643 166.957 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 70.15 28.67 3.94 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.712 1.205 . . . . 4.19 112.297 165.099 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 55.4 p30 -91.54 -1.21 57.59 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.783 1.233 . . . . 2.13 112.73 177.664 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 8.1 t 69.39 1.56 3.35 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 114.524 1.305 . . . . 2.7 114.524 -176.394 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -103.64 126.77 50.99 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 119.855 1.207 . . . . 3.7 108.412 171.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 71' ' ' LEU . . . . . 0.831 HD11 ' HB3' ' B' ' 63' ' ' LEU . 3.8 mm? -98.76 80.85 2.58 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.802 -1.184 . . . . 1.57 107.802 175.47 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 11.0 ptpp? -83.42 177.75 8.34 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.513 1.125 . . . . 3.92 111.772 -174.207 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -83.08 56.65 3.57 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.373 -0.829 . . . . 3.91 112.898 -173.144 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -163.19 49.07 0.15 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.375 -0.972 . . . . 2.31 108.375 109.689 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -93.78 -62.47 1.35 Allowed 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 124.885 1.274 . . . . 1.76 108.428 150.376 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -61.1 -32.32 71.99 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.174 -0.921 . . . . 4.69 112.012 -164.073 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.425 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 5.8 t90 -41.11 -44.64 2.55 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 124.49 1.119 . . . . 4.58 109.541 175.916 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 60.1 mtp85 -38.92 -41.19 0.73 Allowed 'General case' 0 C--N 1.344 0.36 0 C-N-CA 123.833 0.853 . . . . 4.11 111.509 -178.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 16.7 tp -51.53 -54.5 26.7 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.934 0.788 . . . . 1.09 112.822 176.329 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.6 mt -70.23 -30.94 45.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 120.144 1.338 . . . . 1.43 108.529 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -41.92 -51.98 4.9 Favored Glycine 0 C--N 1.344 0.999 0 C-N-CA 125.437 1.494 . . . . 1.41 110.184 165.867 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -75.58 -57.9 3.61 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 112.89 -1.655 . . . . 2.23 109.862 -176.775 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 10.5 mp -41.69 -59.33 1.68 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 120.62 1.555 . . . . 2.19 112.212 -176.95 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.71 -28.84 70.16 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-N 115.436 -0.802 . . . . 1.32 111.739 -174.662 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -71.24 -62.09 1.53 Allowed 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 108.12 -1.067 . . . . 1.76 108.12 172.877 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -58.27 -39.11 78.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.047 0.939 . . . . 2.73 111.87 -166.462 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 11.4 tt -47.51 -47.37 10.64 Favored 'Isoleucine or valine' 0 C--N 1.347 0.492 0 CA-C-N 119.603 1.092 . . . . 1.05 112.104 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 5.9 ttp85 -82.27 -48.4 11.26 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 122.313 1.054 . . . . 4.27 110.14 173.511 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -83.43 61.01 5.95 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.846 2.058 . . . . 6.41 109.022 -169.685 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -41.16 -41.5 1.81 Allowed 'General case' 0 C--O 1.24 0.578 0 C-N-CA 126.125 1.77 . . . . 5.2 113.275 -167.212 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 3.5 tpmp? -142.16 -47.87 0.35 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 118.148 -0.929 . . . . 7.04 111.441 162.386 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -2.34 74.87 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 130.725 3.61 . . . . 5.22 114.753 164.667 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 50.7 tp -151.79 -74.53 0.14 Allowed 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 121.069 -1.02 . . . . 5.31 108.499 -177.982 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -168.92 167.74 10.68 Favored 'General case' 0 C--N 1.339 0.145 0 C-N-CA 124.088 0.955 . . . . 7.15 108.613 177.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 44.1 pt -134.54 19.23 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 C-N-CA 123.988 0.915 . . . . 10.21 110.561 160.956 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.22 113.76 1.63 Allowed 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.494 -0.753 . . . . 8.62 110.681 -174.377 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 27.1 tptp 152.09 120.05 0.0 OUTLIER 'General case' 0 C--O 1.234 0.266 0 C-N-CA 129.02 2.928 . . . . 6.26 107.544 158.154 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt . . . . . 0 C--O 1.249 1.068 0 N-CA-C 103.045 -2.946 . . . . 9.78 103.045 151.81 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptt? . . . . . 0 N--CA 1.476 0.858 0 N-CA-C 111.913 0.338 . . . . 10.22 111.913 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -160.93 176.99 10.81 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 106.637 -1.616 . . . . 4.14 106.637 -177.274 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.03 96.65 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 128.914 2.885 . . . . 3.8 109.726 -173.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -75.74 128.86 82.79 Favored Pre-proline 0 CA--C 1.537 0.462 0 C-N-CA 123.844 0.858 . . . . 5.51 110.199 -173.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.69 103.4 1.7 Allowed 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.912 2.408 . . . . 2.63 110.467 -177.238 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 88.5 mt -67.65 164.82 18.4 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.228 0.537 . . . . 1.29 110.833 173.575 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.8 t -83.18 175.68 9.77 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.658 -0.867 . . . . 2.03 108.658 171.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -69.37 -48.52 60.99 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.567 0.747 . . . . 2.58 109.175 -167.562 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.5 mp -62.33 -52.46 63.56 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 119.361 -0.352 . . . . 2.33 111.226 178.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -54.42 -50.55 67.34 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.226 1.01 . . . . 2.89 110.248 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -50.99 -55.2 18.52 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.3 1.04 . . . . 3.58 110.606 172.451 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.9 m -55.24 -49.77 71.17 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.878 -0.514 . . . . 2.23 111.654 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.293 2.9 pp -62.49 -37.12 78.02 Favored 'Isoleucine or valine' 0 C--N 1.339 0.13 0 C-N-CA 119.763 -0.775 . . . . 0.67 110.332 178.074 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -60.65 -58.08 9.98 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.093 0.86 . . . . 2.63 110.431 175.499 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.9 t -52.33 -39.86 61.18 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.392 0.996 . . . . 1.18 111.583 -172.007 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.0 m -73.36 -42.09 57.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 O-C-N 121.107 -0.996 . . . . 0.75 111.271 175.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 28.2 t -55.39 -51.29 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 119.376 0.989 . . . . 0.62 110.853 175.312 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.6 t -60.27 -48.34 82.15 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.163 0.892 . . . . 0.84 110.448 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 90.6 m -55.29 -51.38 66.85 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-N 118.691 0.678 . . . . 0.98 110.251 178.252 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -46.88 -58.9 3.47 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 123.658 0.783 . . . . 2.96 109.447 171.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -57.09 -47.07 81.95 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.617 1.167 . . . . 2.64 111.452 -169.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.05 -41.85 65.19 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 119.101 -0.476 . . . . 2.38 111.945 178.203 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -81.41 -31.18 33.31 Favored 'General case' 0 C--O 1.221 -0.427 0 C-N-CA 123.668 0.787 . . . . 3.54 111.71 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.01 -34.91 72.42 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 120.432 -1.417 . . . . 0.98 109.762 178.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 33.7 ttp180 -69.27 -26.24 64.66 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.12 1.768 . . . . 4.59 113.589 178.214 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -41.05 -60.82 1.11 Allowed 'General case' 0 C--N 1.344 0.345 0 CA-C-N 120.49 1.495 . . . . 1.78 113.514 -168.158 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -110.54 169.27 8.86 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 127.009 2.124 . . . . 2.63 106.346 175.972 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -11.91 121.09 0.01 OUTLIER Glycine 0 CA--C 1.533 1.2 0 C-N-CA 127.264 2.364 . . . . 1.4 115.19 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.27 106.3 0.06 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.932 0.893 . . . . 5.76 113.072 170.118 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -68.08 55.22 0.07 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.163 1.385 . . . . 3.63 111.769 168.062 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -158.83 -61.8 0.08 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 126.572 1.949 . . . . 4.14 105.771 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.7 m -82.53 127.24 33.14 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.003 -0.999 . . . . 2.3 109.365 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.408 HD22 ' CE2' ' A' ' 76' ' ' TYR . 5.8 mp -93.29 132.41 37.51 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.694 0.283 . . . . 2.28 110.537 170.956 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.5 t -81.5 175.78 10.23 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.276 1.43 . . . . 2.56 108.429 172.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.1 t -64.73 -48.58 84.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 C-N-CA 123.1 0.56 . . . . 1.97 109.642 -175.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -59.5 -56.8 17.45 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 118.932 -0.556 . . . . 2.11 109.537 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -39.23 -52.14 1.96 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 125.098 1.359 . . . . 1.72 112.479 172.765 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -58.58 -58.2 9.59 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.476 -0.564 . . . . 3.04 109.476 175.778 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 33.9 tttm -52.98 -39.59 63.14 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 119.216 -0.421 . . . . 3.55 111.823 -175.124 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 67.9 mt-10 -47.78 -47.56 30.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 118.972 -0.537 . . . . 2.89 111.224 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.3 tp -65.95 -46.76 77.0 Favored 'General case' 0 C--N 1.337 0.063 0 CA-C-N 119.816 1.189 . . . . 2.68 109.266 -171.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.8 m -69.04 -36.29 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-O 121.494 0.664 . . . . 0.95 109.471 -173.676 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 57.9 m -75.35 -30.34 60.2 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.393 0.677 . . . . 1.19 110.795 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -80.53 -57.42 3.59 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.754 1.222 . . . . 2.18 110.655 -176.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.4 mp0 -97.95 -125.95 0.15 Allowed 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 109.109 -0.701 . . . . 3.98 109.109 177.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.587 ' CD1' HD23 ' A' ' 49' ' ' LEU . 1.4 mm? 28.96 64.61 0.73 Allowed Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 127.973 2.509 . . . . 2.34 115.62 175.377 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -75.54 -50.12 0.13 Allowed 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 121.918 1.745 . . . . 1.72 111.062 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 19.6 t-160 -107.47 -22.77 12.43 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.13 0.972 . . . . 4.12 112.181 -166.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.816 HD21 ' HB2' ' A' ' 83' ' ' LEU . 18.1 tp -74.73 -91.08 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.475 1.11 . . . . 1.2 109.733 -167.285 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.6 mt -82.65 68.08 8.97 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.117 -1.068 . . . . 2.11 108.117 172.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -59.74 156.1 14.62 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.155 -0.475 . . . . 5.42 110.054 170.927 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 60.1 t0 67.69 84.58 0.15 Allowed 'General case' 0 C--O 1.231 0.089 0 C-N-CA 125.879 1.672 . . . . 4.44 109.055 -155.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 25.2 m -100.09 28.72 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 114.224 -1.353 . . . . 2.08 109.244 166.819 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -104.57 -59.0 0.68 Allowed Glycine 0 C--N 1.34 0.778 0 C-N-CA 126.419 1.961 . . . . 1.45 108.74 177.221 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 t -77.28 60.81 2.04 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 123.242 1.496 . . . . 2.04 109.571 175.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -73.88 -25.01 59.81 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 124.782 1.233 . . . . 1.2 109.078 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -52.83 -53.07 53.86 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.953 1.701 . . . . 4.02 111.613 171.641 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLU . . . . . 0.409 ' OE1' ' NZ ' ' A' ' 59' ' ' LYS . 2.1 tt0 -54.26 -56.74 15.41 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.132 0.973 . . . . 3.39 108.903 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.409 ' NZ ' ' OE1' ' A' ' 58' ' ' GLU . 0.0 OUTLIER -53.43 -45.52 69.48 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.969 -0.56 . . . . 2.62 110.034 179.502 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -57.35 -56.06 26.68 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 123.514 0.725 . . . . 1.37 109.693 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 60.1 mttt -63.05 -33.08 74.67 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 111.665 0.246 . . . . 3.67 111.665 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -62.09 -41.96 98.73 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.132 -0.355 . . . . 1.92 110.781 173.396 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 21.5 mt -76.54 -56.4 4.65 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.214 1.406 . . . . 1.5 112.773 -174.948 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -59.34 114.42 2.65 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.04 0.936 . . . . 1.85 108.834 -175.242 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.2 t -73.76 -30.66 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 N-CA-C 109.169 -0.678 . . . . 3.63 109.169 -173.403 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -84.19 -40.5 18.06 Favored 'General case' 0 C--O 1.227 -0.109 0 N-CA-C 109.197 -0.668 . . . . 2.12 109.197 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 65.36 64.56 0.6 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.014 1.326 . . . . 3.42 108.032 -158.569 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -104.11 -125.11 0.21 Allowed 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 105.467 -2.049 . . . . 3.64 105.467 172.1 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.3 t -137.28 18.22 2.96 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.365 1.066 . . . . 2.47 110.117 170.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 40.0 mp0 -133.12 113.38 12.66 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 125.282 1.433 . . . . 5.02 107.399 -165.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -84.27 87.85 7.21 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 105.461 -2.052 . . . . 1.0 105.461 167.241 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -54.64 158.96 2.34 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 118.222 -0.894 . . . . 4.53 109.485 176.066 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -37.25 -53.03 1.07 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.44 1.096 . . . . 4.88 112.011 -176.707 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -70.23 -40.31 74.56 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.565 0.58 . . . . 2.55 112.565 -178.08 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -63.07 -34.76 78.28 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.873 0.469 . . . . 2.12 110.576 176.358 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.408 ' CE2' HD22 ' A' ' 33' ' ' LEU . 28.3 t80 -75.63 -47.04 28.18 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 119.008 -0.52 . . . . 3.43 109.832 175.999 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.526 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 2.3 t-105 -43.74 -43.94 6.31 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 108.73 -0.841 . . . . 4.79 108.73 173.515 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.0 mtp180 -39.71 -51.48 2.33 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-O 117.087 -1.435 . . . . 4.28 109.44 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.7 tp -43.6 -47.64 7.52 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 120.44 1.473 . . . . 0.73 112.198 177.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.5 mp -68.19 -44.11 84.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 125.689 1.595 . . . . 1.76 108.707 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -60.49 -36.97 92.53 Favored Glycine 0 C--N 1.332 0.314 0 CA-C-O 122.121 0.845 . . . . 1.56 113.48 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.422 ' O ' ' HD2' ' A' ' 85' ' ' LYS . 5.9 mm-40 -75.99 -56.04 5.03 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 104.979 -2.23 . . . . 3.12 104.979 -175.347 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.816 ' HB2' HD21 ' A' ' 49' ' ' LEU 0.282 4.6 pp -57.14 -32.18 66.11 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 121.207 -0.933 . . . . 2.2 113.38 177.027 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.12 -25.09 68.2 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 118.065 -0.969 . . . . 1.77 112.876 175.615 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.422 ' HD2' ' O ' ' A' ' 82' ' ' GLU 0.308 0.0 OUTLIER -84.74 -41.4 16.24 Favored 'General case' 0 C--N 1.344 0.346 0 CA-C-N 120.201 1.364 . . . . 2.24 112.507 158.968 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.487 ' HB2' ' HA ' ' A' ' 83' ' ' LEU . 16.8 mm-40 -52.94 -39.39 62.84 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 119.211 0.914 . . . . 2.54 111.336 -171.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.415 HG21 HG21 ' B' ' 17' ' ' VAL . 4.3 tp -26.87 -50.47 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.449 1.1 . . . . 1.81 111.963 166.115 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -115.24 -42.68 3.15 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.007 0.923 . . . . 4.65 112.981 -176.445 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 44.6 tttm -53.67 -54.38 38.68 Favored 'General case' 0 C--O 1.232 0.166 0 O-C-N 119.92 -1.737 . . . . 3.05 109.298 171.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.531 ' C ' ' H3 ' ' B' ' 1' ' ' MET . 0.2 OUTLIER -75.78 -41.67 52.33 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 107.976 -1.12 . . . . 8.55 107.976 178.982 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . 0.613 0.1 OUTLIER -138.32 57.07 1.71 Allowed 'General case' 0 CA--C 1.565 1.533 1 N-CA-C 121.803 4.001 . . . . 10.36 121.803 -177.569 . . . . . . . . 4 3 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ASP . . . . . 0.563 ' O ' ' HB3' ' B' ' 1' ' ' MET . 0.0 OUTLIER -130.03 129.24 43.43 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 129.915 3.286 . . . . 7.43 109.199 147.529 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.496 ' H ' ' HB2' ' B' ' 2' ' ' ALA 0.577 0.1 OUTLIER 91.91 24.01 0.02 OUTLIER 'General case' 0 CA--C 1.573 1.829 2 C-N-CA 136.37 5.868 . . . . 11.0 126.554 169.273 . . . . . . . . 5 4 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.428 ' CD ' ' HG3' ' B' ' 1' ' ' MET . 4.1 tttp -158.26 -71.27 0.09 Allowed 'General case' 0 N--CA 1.486 1.365 1 CA-C-N 126.385 4.175 . . . . 10.71 120.302 -178.242 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.3 mm -61.4 86.54 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 125.168 1.387 . . . . 8.42 111.275 -154.592 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.4 mtp85 64.68 -65.23 0.14 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.208 1.803 . . . . 13.22 108.017 -165.715 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt 152.91 62.58 0.0 OUTLIER 'General case' 0 C--O 1.233 0.221 0 C-N-CA 131.285 3.834 . . . . 11.03 105.407 151.374 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 37.8 mmtm . . . . . 0 C--O 1.251 1.144 0 C-N-CA 125.89 1.676 . . . . 11.4 107.237 -173.364 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.563 ' HB3' ' O ' ' A' ' 92' ' ' ASP 2.36 0.0 OUTLIER . . . . . 0 CA--C 1.579 2.084 0 CA-C-O 116.725 -1.607 . . . . 8.62 113.078 . . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ALA . . . . . 0.496 ' HB2' ' H ' ' A' ' 93' ' ' LEU 2.333 . . 120.03 90.53 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.159 0 CA-C-N 124.927 3.512 . . . . 5.74 119.631 177.869 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 104.03 70.26 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.166 0 N-CA-C 120.48 3.511 . . . . 6.15 120.48 124.1 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.401 ' HB3' ' CD ' ' B' ' 5' ' ' PRO 0.452 21.2 tt0 91.02 -117.22 0.0 OUTLIER Pre-proline 0 CA--C 1.559 1.311 0 N-CA-C 118.915 2.932 . . . . 6.39 118.915 131.307 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 5' ' ' PRO . . . . . 0.401 ' CD ' ' HB3' ' B' ' 4' ' ' GLU . 59.2 Cg_endo -66.08 152.17 81.95 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 123.805 3.003 . . . . 3.56 114.563 -147.187 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.442 ' HB2' ' HB3' ' B' ' 10' ' ' GLU . 0.3 OUTLIER -160.02 158.41 30.49 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 120.011 -0.676 . . . . 3.37 112.188 -149.42 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 5.1 t -79.85 -159.9 0.24 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.403 1.881 . . . . 2.05 113.068 -173.13 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -75.28 -66.83 0.72 Allowed 'General case' 0 C--O 1.223 -0.29 0 O-C-N 121.957 -0.465 . . . . 2.68 111.786 -172.745 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.0 mt -48.81 -41.67 33.54 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 120.852 -1.155 . . . . 1.04 110.353 175.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.599 ' HG3' HD22 ' A' ' 49' ' ' LEU . 1.6 mt-10 -44.69 -61.51 1.55 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.323 1.849 . . . . 3.52 113.71 164.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.66 -34.94 78.12 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 120.464 -1.397 . . . . 4.29 110.234 -177.963 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.8 m -64.16 -38.06 89.71 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.204 0.602 . . . . 2.3 111.238 178.591 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.263 2.9 pp -71.47 -36.51 60.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 O-C-N 121.477 -0.765 . . . . 1.12 111.209 167.562 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -53.11 -57.3 10.9 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 118.857 0.753 . . . . 2.65 110.043 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.1 t -47.24 -44.51 22.77 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.284 0.947 . . . . 1.36 112.699 -176.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.0 m -74.36 -36.22 41.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 O-C-N 120.832 -1.168 . . . . 1.23 110.967 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.415 HG21 HG21 ' A' ' 87' ' ' ILE . 56.3 t -61.53 -48.18 89.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 118.828 0.74 . . . . 0.99 110.739 175.696 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 10.1 t -59.89 -44.91 93.97 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 120.197 1.362 . . . . 1.15 110.532 176.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 56.5 m -55.7 -49.81 72.0 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.422 0.63 . . . . 1.18 110.483 175.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -49.75 -55.64 13.24 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 118.155 -0.926 . . . . 3.79 110.751 170.77 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -49.61 -57.74 6.58 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 120.125 1.329 . . . . 4.21 111.161 178.408 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 30.5 p -60.05 -45.75 91.82 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 122.311 -0.243 . . . . 2.04 110.398 -172.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -66.21 -49.38 67.47 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 121.506 0.67 . . . . 3.54 110.488 177.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.02 -30.24 64.03 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 126.011 1.724 . . . . 0.82 110.384 -177.805 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -58.5 -26.11 63.1 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 117.541 -1.218 . . . . 7.16 111.453 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.403 ' HB2' ' HG2' ' B' ' 37' ' ' GLU . 0.3 OUTLIER -45.05 -66.19 0.43 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.87 1.804 . . . . 1.72 115.87 -156.949 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -90.21 -75.41 0.46 Allowed 'General case' 0 C--N 1.341 0.219 0 C-N-CA 119.604 -0.838 . . . . 3.48 111.694 -168.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.85 165.18 29.28 Favored Glycine 0 C--N 1.337 0.628 0 C-N-CA 126.891 2.186 . . . . 1.98 110.741 156.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 18.4 mmt85 36.33 105.5 0.0 OUTLIER 'General case' 0 C--O 1.242 0.67 0 N-CA-C 116.819 2.155 . . . . 5.46 116.819 136.773 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -66.09 46.76 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.833 2.053 . . . . 4.07 114.448 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -148.07 -55.98 0.22 Allowed 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 124.872 1.269 . . . . 4.43 108.161 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 2.6 p -81.89 117.55 22.23 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.791 1.636 . . . . 1.73 109.952 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.423 ' N ' HD12 ' B' ' 33' ' ' LEU . 7.7 mp -96.22 137.59 35.07 Favored 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 108.382 -0.97 . . . . 2.22 108.382 169.382 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 34' ' ' SER . . . . . 0.457 ' C ' ' H ' ' B' ' 36' ' ' ASN . 0.8 OUTLIER -81.77 -171.5 3.38 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 128.547 2.739 . . . . 2.54 108.055 179.464 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 13.2 p -96.52 42.99 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 CA-C-O 123.454 1.597 . . . . 2.51 108.569 164.394 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 36' ' ' ASN . . . . . 0.457 ' H ' ' C ' ' B' ' 34' ' ' SER . 0.6 OUTLIER -161.09 170.55 20.22 Favored 'General case' 0 CA--C 1.544 0.747 1 C-N-CA 141.317 7.847 . . . . 3.68 101.403 169.592 . . . . . . . . 4 4 . 1 . 004 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.403 ' HG2' ' HB2' ' B' ' 26' ' ' GLN . 63.8 mt-10 58.0 -65.36 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 121.918 2.145 . . . . 1.6 110.156 -153.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -57.62 -50.59 72.64 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.709 -0.849 . . . . 2.2 108.709 177.289 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -57.32 -48.58 78.6 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.741 -0.208 . . . . 4.4 110.885 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -53.86 -38.48 64.74 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 121.917 -0.49 . . . . 3.61 111.137 174.145 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 8.8 tt -68.56 -47.04 67.85 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.955 -0.758 . . . . 2.42 108.955 -177.183 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.451 HG21 HD23 ' B' ' 56' ' ' LEU . 0.2 OUTLIER -65.24 -51.79 60.67 Favored 'Isoleucine or valine' 0 C--N 1.34 0.155 0 CA-C-N 118.379 0.536 . . . . 1.01 110.187 -179.535 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 63.3 m -53.39 -53.58 49.17 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.878 0.871 . . . . 0.94 111.252 177.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -81.64 -60.44 2.25 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.93 0.492 . . . . 1.68 112.139 -171.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -80.92 -44.19 18.64 Favored 'General case' 0 C--N 1.337 0.039 0 N-CA-C 113.808 1.04 . . . . 2.51 113.808 -159.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 46' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' B' ' 42' ' ' VAL . 1.2 mm? -39.89 -57.08 2.83 Favored Pre-proline 0 N--CA 1.467 0.418 0 CA-C-O 117.333 -1.317 . . . . 2.39 112.823 -164.196 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -87.22 -27.57 5.2 Favored 'Cis proline' 0 N--CA 1.45 -1.04 0 CA-C-N 120.48 1.207 . . . . 2.15 109.506 -25.07 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 22.2 t-160 -98.72 -44.36 6.44 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.467 1.107 . . . . 2.73 110.327 -166.824 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.467 HD23 ' HG ' ' B' ' 83' ' ' LEU . 13.0 tp -29.34 -57.8 0.15 Allowed 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.555 1.942 . . . . 1.07 114.652 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 72.0 mt -97.56 116.19 29.29 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 109.398 -0.593 . . . . 1.57 109.398 175.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.21 178.23 8.19 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.108 0.563 . . . . 5.31 109.617 164.414 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.326 1.0 OUTLIER 62.6 16.26 8.67 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.761 2.025 . . . . 4.31 114.075 176.973 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 19.3 m -54.76 -20.17 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 C-N-CA 125.812 1.645 . . . . 2.38 113.101 171.005 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.3 -44.95 21.42 Favored Glycine 0 CA--C 1.532 1.095 0 N-CA-C 110.456 -1.058 . . . . 2.6 110.456 166.04 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 18.4 m -92.17 40.34 1.04 Allowed 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.821 1.248 . . . . 2.55 110.872 174.832 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.522 HD13 ' C ' ' B' ' 56' ' ' LEU . 2.6 tm? -48.36 -48.67 36.39 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 119.541 1.064 . . . . 1.13 109.809 176.391 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -45.41 -36.73 4.5 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.188 1.795 . . . . 4.83 112.819 177.663 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -64.69 -51.39 62.73 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.139 -0.976 . . . . 2.88 110.111 172.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 4.4 mmpt? -54.16 -53.61 51.04 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 107.997 -1.112 . . . . 3.35 107.997 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.03 -42.08 98.78 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.876 -0.583 . . . . 2.02 110.464 -174.065 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -53.84 -37.17 63.34 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.178 0.899 . . . . 3.54 112.051 171.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 9.2 m -68.86 -44.81 72.6 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 122.708 0.403 . . . . 1.96 111.703 176.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 6.5 mp -69.5 -43.61 72.77 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.23 -0.919 . . . . 1.61 111.816 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.268 16.9 t0 -62.88 -9.0 8.12 Favored 'General case' 0 C--O 1.221 -0.395 0 C-N-CA 127.874 2.469 . . . . 1.46 115.99 -166.103 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.3 m -32.26 -21.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 130.57 3.548 . . . . 1.54 120.139 -131.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -53.94 -33.82 57.89 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 121.191 1.814 . . . . 2.41 110.723 155.672 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 58.92 55.33 4.59 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.638 0.775 . . . . 4.21 109.658 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 34.2 p30 -81.66 -34.24 30.88 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.331 -0.849 . . . . 2.13 109.056 172.791 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 24.8 m 109.07 -6.23 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 129.531 3.132 . . . . 1.9 111.879 -175.413 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -111.85 98.22 7.23 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.852 1.661 . . . . 5.39 106.568 -177.193 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -76.02 91.19 3.06 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 126.674 1.99 . . . . 0.98 106.843 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 12.3 ptmt -84.25 176.37 8.79 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.873 1.269 . . . . 3.14 110.25 -177.307 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -83.73 50.24 1.76 Allowed 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.42 1.267 . . . . 4.5 114.42 -176.687 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -162.13 49.46 0.19 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.206 1.402 . . . . 2.14 107.882 125.762 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -95.54 -58.85 2.01 Favored 'General case' 0 N--CA 1.44 -0.963 0 O-C-N 119.498 -2.001 . . . . 1.85 108.475 131.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -46.27 -44.53 16.56 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 124.15 0.98 . . . . 3.57 112.967 -173.106 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.417 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 7.7 t90 -43.2 -46.65 6.13 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 123.636 0.585 . . . . 4.31 110.207 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -41.57 -37.7 1.18 Allowed 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.749 -0.643 . . . . 5.72 111.802 -177.776 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 11.1 tp -50.34 -55.51 15.26 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 119.186 0.903 . . . . 0.92 111.935 175.735 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.2 mt -71.29 -30.51 40.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 120.183 1.356 . . . . 1.45 108.353 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -41.77 -49.57 5.05 Favored Glycine 0 C--N 1.344 1.001 0 C-N-CA 125.687 1.613 . . . . 1.67 111.298 166.03 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -80.51 -59.54 2.65 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 112.538 -1.831 . . . . 2.42 108.676 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.467 ' HG ' HD23 ' B' ' 49' ' ' LEU . 8.4 mp -39.01 -56.48 1.41 Allowed 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 121.374 1.897 . . . . 2.27 113.893 -174.097 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.35 -30.34 69.48 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 123.146 0.578 . . . . 1.29 111.953 -177.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt -75.84 -46.58 29.66 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 123.971 0.908 . . . . 1.73 109.896 169.629 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -56.77 -40.86 76.59 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-N 120.372 1.442 . . . . 2.66 111.931 -175.577 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 5.7 tt -55.52 -32.36 30.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 CA-C-N 118.776 0.717 . . . . 1.04 111.657 174.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 50.2 tpt85 -81.86 -40.53 22.29 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.449 1.1 . . . . 3.61 112.79 175.482 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 43.4 tttp -85.31 142.57 29.25 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.182 1.393 . . . . 4.28 112.866 -157.52 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 5.6 tmtp? -84.53 -61.0 1.9 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 122.921 0.488 . . . . 4.92 110.374 170.6 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -172.68 20.38 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 126.086 1.754 . . . . 6.09 110.335 -173.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -89.11 55.31 3.27 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 121.165 -0.959 . . . . 4.37 109.509 -150.545 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 54.4 tp -111.18 -77.43 0.59 Allowed 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 124.707 1.203 . . . . 4.95 108.04 -172.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -171.82 179.46 2.75 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.985 1.314 . . . . 7.89 108.176 175.837 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 65.5 mt -92.55 -78.0 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 N-CA-C 106.843 -1.54 . . . . 10.92 106.843 168.351 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -160.07 135.34 8.09 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 107.186 -1.413 . . . . 10.85 107.186 175.878 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 18.9 tttp -179.74 136.34 0.12 Allowed 'General case' 0 C--O 1.236 0.378 0 C-N-CA 125.323 1.449 . . . . 9.11 108.207 -178.385 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 86.1 tttt . . . . . 0 C--O 1.253 1.241 0 N-CA-C 104.005 -2.591 . . . . 6.78 104.005 148.821 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.4 mtt . . . . . 0 N--CA 1.471 0.592 0 N-CA-C 104.325 -2.472 . . . . 7.59 104.325 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.16 173.78 0.78 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.223 0.919 . . . . 3.12 109.179 149.447 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 80.68 80.29 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 126.481 1.912 . . . . 3.5 110.096 -175.512 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -59.17 123.39 69.45 Favored Pre-proline 0 N--CA 1.448 -0.548 0 C-N-CA 126.152 1.781 . . . . 4.2 110.064 -179.475 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.41 101.46 1.36 Allowed 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 122.583 2.189 . . . . 2.71 109.688 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 91.4 mt -60.08 152.17 24.85 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.473 0.654 . . . . 1.46 110.82 175.744 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.4 t -69.07 151.06 46.91 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.823 0.849 . . . . 2.0 109.249 178.855 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -39.09 -59.12 1.04 Allowed 'General case' 0 CA--C 1.527 0.084 0 C-N-CA 126.291 1.836 . . . . 3.2 112.147 -172.688 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 10.3 mt -69.07 -46.05 68.79 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.435 -0.793 . . . . 1.54 111.16 -172.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -54.61 -48.55 72.06 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.996 0.919 . . . . 2.94 110.597 175.979 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -50.67 -60.8 2.66 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.984 1.314 . . . . 3.85 109.655 171.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 54.5 p -55.92 -42.95 76.86 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.606 0.362 . . . . 1.48 111.478 -173.625 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.306 2.6 pp -66.34 -41.03 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-O 117.671 -1.157 . . . . 0.76 111.346 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.72 -52.72 64.28 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 120.046 1.294 . . . . 2.52 108.818 172.591 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -43.23 -43.84 4.97 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.962 1.305 . . . . 2.06 113.72 177.839 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 35.1 m -81.43 -39.35 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.886 1.221 . . . . 0.74 112.619 173.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.3 t -57.47 -40.8 76.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 C-N-CA 123.816 0.847 . . . . 0.71 110.592 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.7 t -59.6 -50.78 72.55 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.544 0.611 . . . . 0.75 110.882 176.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.2 m -57.25 -50.89 71.45 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.376 -0.828 . . . . 0.82 110.12 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -49.1 -58.57 4.74 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.945 0.898 . . . . 3.01 109.951 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -63.15 -45.86 89.93 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 118.552 -0.737 . . . . 5.08 111.839 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.6 t -60.58 -44.7 95.92 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.506 1.048 . . . . 2.16 110.056 -176.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -61.17 -48.61 80.8 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 121.127 0.489 . . . . 2.66 111.02 172.037 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.2 -22.12 66.82 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 120.953 -1.092 . . . . 1.31 112.178 -175.67 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -79.04 -17.18 55.73 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.665 1.986 . . . . 6.21 112.378 174.239 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.437 ' HB3' ' HG3' ' A' ' 37' ' ' GLU . 6.4 tp60 -39.74 -55.28 1.96 Allowed 'General case' 0 C--N 1.344 0.335 0 CA-C-N 119.86 1.209 . . . . 2.8 111.255 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -145.64 -165.39 2.18 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 123.94 0.896 . . . . 5.34 109.471 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -18.28 113.58 0.01 OUTLIER Glycine 0 CA--C 1.527 0.806 0 C-N-CA 128.393 2.901 . . . . 1.89 114.37 -166.187 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? 66.05 106.9 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.48 1.112 . . . . 5.07 112.956 173.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.89 -26.11 65.63 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 113.32 0.859 . . . . 7.05 113.32 176.347 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -90.56 9.92 27.56 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.577 0.626 . . . . 4.64 111.99 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.6 p -151.35 160.5 43.74 Favored 'General case' 0 C--O 1.24 0.568 0 O-C-N 120.908 -1.12 . . . . 1.97 111.708 174.394 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.414 HD13 ' CG ' ' A' ' 76' ' ' TYR . 3.8 mp -118.03 127.97 54.32 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 122.678 0.391 . . . . 2.91 110.918 -172.488 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.7 t -81.92 172.46 13.27 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.502 -0.925 . . . . 2.23 108.502 174.444 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 43.1 t -67.28 -48.75 77.1 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 O-C-N 121.492 -0.755 . . . . 2.99 110.36 -168.667 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -56.99 -52.03 66.87 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 109.473 -0.565 . . . . 2.55 109.473 172.252 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.437 ' HG3' ' HB3' ' A' ' 26' ' ' GLN . 7.2 tt0 -48.71 -49.58 37.3 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.349 1.46 . . . . 2.1 110.39 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.564 ' CZ ' HD21 ' A' ' 56' ' ' LEU . 1.9 t80 -59.47 -57.65 12.05 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 124.553 1.141 . . . . 2.8 109.932 172.652 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -52.02 -44.72 64.29 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 117.948 0.34 . . . . 4.76 111.78 -174.145 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -48.58 -37.79 18.93 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.295 0.48 . . . . 2.74 112.295 177.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -64.65 -47.27 79.1 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 108.534 -0.913 . . . . 2.23 108.534 -176.028 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.539 HG21 HD23 ' A' ' 56' ' ' LEU . 28.7 m -71.01 -40.64 76.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 116.287 -0.415 . . . . 1.42 110.126 -175.827 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.8 m -61.5 -42.01 98.14 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.385 0.674 . . . . 1.77 110.88 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -80.63 -55.6 4.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.122 0.569 . . . . 2.11 111.478 -171.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -92.97 -122.34 0.09 Allowed 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.303 0.501 . . . . 4.27 110.421 177.461 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.653 ' H ' HD12 ' A' ' 46' ' ' LEU . 6.9 mp 12.81 71.53 0.11 Allowed Pre-proline 0 CA--C 1.545 0.754 0 C-N-CA 129.927 3.291 . . . . 2.43 115.502 -174.018 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.59 -52.22 0.6 Allowed 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 123.055 2.504 . . . . 1.66 113.263 -177.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 -136.0 61.58 1.64 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.78 0.8 . . . . 3.13 110.081 -168.637 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.674 HD21 ' HB2' ' A' ' 83' ' ' LEU . 5.9 tp -143.94 -118.72 0.09 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.876 -1.056 . . . . 1.88 108.477 -164.459 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 68.2 mt -68.56 77.83 0.28 Allowed 'General case' 0 C--N 1.34 0.164 0 N-CA-C 108.524 -0.917 . . . . 2.8 108.524 163.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -66.65 -168.91 0.07 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.43 -0.805 . . . . 5.33 110.433 172.063 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 63.93 37.84 9.19 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 124.698 1.199 . . . . 3.55 109.46 178.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -63.02 -22.38 30.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 124.796 1.238 . . . . 2.08 111.742 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -49.82 -35.82 24.98 Favored Glycine 0 CA--C 1.532 1.117 0 N-CA-C 111.235 -0.746 . . . . 1.98 111.235 166.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.8 t -108.06 46.59 0.94 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.118 1.367 . . . . 2.45 109.55 173.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.564 HD21 ' CZ ' ' A' ' 38' ' ' PHE . 2.4 tm? -55.39 -46.5 76.56 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.077 -1.015 . . . . 1.23 109.342 167.55 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -62.63 -22.82 66.71 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.355 1.062 . . . . 5.3 111.775 -169.397 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -62.34 -48.73 78.52 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 120.801 -1.187 . . . . 3.27 110.437 166.286 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.23 -37.78 81.37 Favored 'General case' 0 C--O 1.225 -0.232 0 O-C-N 121.441 -0.787 . . . . 3.25 109.406 174.266 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.0 ttp -53.33 -53.47 50.53 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 118.952 0.797 . . . . 1.88 109.876 173.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -57.21 -41.63 79.81 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 119.207 -0.425 . . . . 3.26 112.021 177.566 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.8 t -55.79 -57.47 11.89 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 118.908 0.776 . . . . 2.22 110.159 172.767 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 40.6 mt -58.97 -53.31 59.87 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.435 1.094 . . . . 1.56 110.971 -171.259 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -68.96 81.05 0.31 Allowed 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 123.66 0.6 . . . . 2.12 109.461 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.8 m -47.27 -33.34 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 C-N-CA 124.252 1.021 . . . . 1.82 111.722 172.468 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -92.83 -11.5 33.49 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.636 0.976 . . . . 2.24 113.636 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 45.41 59.02 3.79 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.587 1.555 . . . . 3.4 111.208 -176.389 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -77.73 -98.88 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 106.316 -1.735 . . . . 3.29 106.316 164.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.1 m 178.72 44.27 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 130.949 3.699 . . . . 1.8 106.003 162.091 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.66 109.34 3.45 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 105.792 -1.929 . . . . 4.01 105.792 -169.07 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -84.7 94.75 8.73 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 105.443 -2.058 . . . . 0.9 105.443 -176.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.54 151.67 45.87 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 107.858 -1.164 . . . . 3.24 107.858 175.35 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -39.13 -54.11 1.78 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.593 0.96 . . . . 5.86 113.593 -171.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -73.35 -26.95 61.24 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.553 0.575 . . . . 1.78 112.553 -176.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.32 -59.65 3.82 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 108.08 -1.082 . . . . 2.13 108.08 169.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.414 ' CG ' HD13 ' A' ' 33' ' ' LEU . 56.7 t80 -49.92 -49.53 49.49 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 124.044 0.937 . . . . 3.21 110.463 -177.189 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 1.3 t-105 -39.61 -42.41 1.18 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 125.266 1.426 . . . . 4.16 111.393 -178.844 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 -49.13 -38.98 26.87 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-O 117.994 -1.003 . . . . 3.74 112.102 -178.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 tp -46.43 -48.12 18.87 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 119.088 0.858 . . . . 0.97 110.763 178.485 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.6 mp -60.78 -34.44 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 108.0 -1.111 . . . . 1.84 108.0 -177.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.569 ' HA3' ' CE2' ' B' ' 77' ' ' TRP . . . -70.4 -48.45 37.3 Favored Glycine 0 CA--C 1.491 -1.415 0 C-N-CA 124.217 0.913 . . . . 1.26 110.904 -178.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.18 -58.69 7.54 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 104.503 -2.406 . . . . 2.74 104.503 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.674 ' HB2' HD21 ' A' ' 49' ' ' LEU 0.26 3.8 pp -56.01 -40.95 74.15 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.703 1.372 . . . . 2.05 114.703 177.324 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.79 -23.87 66.49 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 118.793 0.724 . . . . 1.44 112.27 174.81 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -80.91 -44.69 17.9 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 125.415 1.486 . . . . 1.91 109.514 168.529 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.427 ' CD ' ' HZ2' ' A' ' 89' ' ' LYS . 36.7 mm-40 -61.84 -34.21 75.55 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 120.061 1.3 . . . . 2.24 111.419 -172.149 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.4 tt -49.04 -37.7 10.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-N 118.114 0.415 . . . . 1.37 111.955 171.849 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.66 -53.96 4.51 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.246 1.018 . . . . 5.36 109.056 176.631 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.427 ' HZ2' ' CD ' ' A' ' 86' ' ' GLU . 3.1 ttpm? -78.38 49.55 0.86 Allowed 'General case' 0 N--CA 1.437 -1.122 0 C-N-CA 125.601 1.56 . . . . 3.72 112.826 -170.002 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -81.95 -19.1 41.36 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.773 1.229 . . . . 8.61 113.876 -174.922 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.1 tptm -173.62 -41.88 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.584 1.084 . . . . 8.86 111.426 -177.589 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 67.25 8.69 6.41 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 114.103 1.149 . . . . 5.8 114.103 159.016 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 43.5 tp -110.12 -76.21 0.61 Allowed 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 107.173 -1.417 . . . . 9.3 107.173 -178.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -83.05 67.13 8.99 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.372 -0.83 . . . . 13.01 112.105 -172.782 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 2.239 1.2 pp 57.21 -97.08 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 N-CA-C 115.279 1.585 . . . . 13.51 115.279 147.489 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 94.3 mtt-85 57.52 -93.67 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 128.305 2.642 . . . . 11.45 111.244 -164.909 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -177.53 139.64 0.25 Allowed 'General case' 0 C--O 1.237 0.413 0 N-CA-C 106.184 -1.784 . . . . 14.19 106.184 -159.107 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.545 ' HD3' ' H ' ' A' ' 98' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.256 1.435 0 N-CA-C 101.288 -3.597 . . . . 14.04 101.288 128.509 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 109.989 -0.374 . . . . 6.48 109.989 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -176.67 -176.79 0.75 Allowed 'General case' 0 C--O 1.234 0.28 0 C-N-CA 126.235 1.814 . . . . 4.54 107.702 -175.677 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 76.9 104.91 0.07 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 115.659 1.726 . . . . 3.99 115.659 143.62 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -153.0 159.32 32.38 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.562 1.545 . . . . 7.91 107.618 161.794 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.85 153.02 22.44 Favored 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 124.397 3.398 . . . . 3.22 109.886 173.161 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 44.1 mt -139.37 172.2 13.17 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.772 0.656 . . . . 2.34 112.772 -153.457 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 10.2 t -89.36 -132.04 0.09 Allowed 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.04 1.336 . . . . 1.8 110.513 171.238 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -92.44 -59.06 2.17 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.111 1.365 . . . . 2.11 114.03 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.5 mt -62.93 -50.33 71.24 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 120.846 -1.159 . . . . 1.06 111.482 -173.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.549 ' HG2' HD22 ' A' ' 49' ' ' LEU . 0.0 OUTLIER -88.02 115.22 25.34 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 100.433 -3.914 . . . . 4.82 100.433 138.399 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -54.67 -50.98 66.93 Favored 'General case' 0 C--N 1.342 0.271 1 C-N-CA 133.753 4.821 . . . . 3.68 118.752 19.719 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 52.7 p -51.74 -40.05 59.55 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.474 0.916 . . . . 1.45 113.474 -155.349 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.56 HD12 ' N ' ' B' ' 14' ' ' GLU . 2.7 pp -57.34 -42.68 80.85 Favored 'Isoleucine or valine' 0 C--N 1.339 0.134 0 N-CA-C 112.837 0.68 . . . . 1.03 112.837 174.103 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 14' ' ' GLU . . . . . 0.56 ' N ' HD12 ' B' ' 13' ' ' ILE . 1.2 tm-20 -60.2 -50.04 75.22 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.867 -1.16 . . . . 2.42 107.867 173.544 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -50.05 -38.69 39.2 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.526 0.73 . . . . 2.56 112.882 -178.529 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 35.8 m -80.36 -40.54 19.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 O-C-N 121.124 -0.985 . . . . 1.14 111.924 171.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 18.0 t -55.22 -43.99 73.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 123.645 0.778 . . . . 1.12 111.308 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 10.2 t -57.26 -49.05 77.27 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.233 0.924 . . . . 1.32 110.428 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 34.6 m -57.61 -52.68 64.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.753 -0.462 . . . . 1.28 109.753 176.958 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -46.47 -51.82 14.44 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.407 1.083 . . . . 4.41 111.395 174.131 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -66.18 -53.87 32.11 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.088 0.47 . . . . 3.67 109.8 -173.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 1.3 t -64.55 -32.66 74.4 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 122.092 -0.38 . . . . 3.33 110.363 -176.159 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -61.35 -59.03 5.91 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.591 1.157 . . . . 5.61 110.238 170.33 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.48 -22.94 35.8 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 126.638 1.975 . . . . 1.1 112.033 -178.626 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -18.01 22.58 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 117.678 -1.153 . . . . 4.75 113.456 171.849 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -45.99 -62.37 1.35 Allowed 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.237 1.569 . . . . 2.7 115.237 -172.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -73.11 -42.5 62.89 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 116.174 1.916 . . . . 5.24 116.174 -152.425 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -80.35 -88.29 0.55 Allowed Glycine 0 CA--C 1.528 0.874 0 C-N-CA 130.015 3.674 . . . . 2.82 115.1 18.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 43.49 72.88 0.16 Allowed 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.864 -0.786 . . . . 4.59 109.092 -163.272 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 61.23 2.31 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.951 1.3 . . . . 5.24 111.064 -174.164 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -168.66 -59.7 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 127.286 2.234 . . . . 4.39 106.658 171.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 4.1 p -83.86 149.41 26.39 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.72 -0.673 . . . . 1.81 111.164 -174.05 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -107.12 128.64 54.57 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 107.951 -1.129 . . . . 2.27 107.951 174.573 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 52.8 m -114.11 174.65 5.84 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 119.335 0.97 . . . . 2.92 108.851 166.322 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 12.7 p -84.88 56.1 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.167 0 O-C-N 120.826 -1.171 . . . . 2.66 111.45 -174.977 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -152.9 55.89 0.78 Allowed 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 123.683 1.706 . . . . 2.17 108.24 130.515 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -141.49 -57.51 0.48 Allowed 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 130.408 3.483 . . . . 1.94 101.976 164.142 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -40.76 -52.82 2.93 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.206 1.003 . . . . 2.56 112.616 -177.232 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -68.19 -28.04 66.93 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.373 0.509 . . . . 2.91 112.373 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -66.91 -35.53 80.22 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 121.376 -0.827 . . . . 3.45 110.886 -178.242 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.52 -49.13 70.11 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.324 -0.86 . . . . 2.57 109.181 -176.338 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -62.56 -44.07 99.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 114.957 -1.019 . . . . 0.74 109.217 -176.218 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 99.4 m -57.31 -55.65 32.04 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.583 0.753 . . . . 1.04 111.257 172.555 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -80.9 -62.61 1.62 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.349 0.66 . . . . 1.97 112.443 -162.211 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 -82.41 -39.87 22.06 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 121.805 -0.559 . . . . 2.97 111.985 -173.841 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.62 -12.77 0.19 Allowed Pre-proline 0 CA--C 1.544 0.746 1 N-CA-C 121.954 4.057 . . . . 2.12 121.954 -153.919 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -49.89 -41.46 47.39 Favored 'Trans proline' 0 CA--C 1.535 0.569 0 C-N-CA 122.726 2.284 . . . . 1.9 116.676 -147.644 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 61.5 t-80 -86.77 50.03 1.93 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 120.795 1.634 . . . . 3.35 109.415 -174.654 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.525 HD23 ' HB2' ' B' ' 83' ' ' LEU . 10.3 tp -151.18 -82.52 0.1 Allowed 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.076 0.55 . . . . 1.03 110.444 -175.877 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 69.9 mt -80.64 70.95 7.48 Favored 'General case' 0 CA--C 1.522 -0.117 0 N-CA-C 108.501 -0.926 . . . . 1.59 108.501 171.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.05 137.53 10.27 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.513 -0.921 . . . . 6.08 108.513 155.27 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 16.2 t0 70.71 79.07 0.18 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 126.021 1.728 . . . . 3.35 109.869 -156.641 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 18.1 m -90.47 6.87 4.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 114.085 -1.416 . . . . 1.52 110.209 160.052 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -89.16 -65.13 1.27 Allowed Glycine 0 C--N 1.341 0.854 0 N-CA-C 108.123 -1.991 . . . . 2.3 108.123 -171.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 13.0 t -78.17 50.04 0.87 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.104 0.961 . . . . 2.65 108.493 172.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.68 -41.47 99.12 Favored 'General case' 0 N--CA 1.445 -0.681 0 O-C-N 120.469 -1.394 . . . . 1.16 108.214 171.323 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -32.33 71.39 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.689 1.596 . . . . 4.35 110.338 -170.734 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -56.8 -55.73 30.63 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.646 1.179 . . . . 2.38 110.615 167.21 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.17 -48.52 73.66 Favored 'General case' 0 C--N 1.343 0.295 0 N-CA-C 108.184 -1.043 . . . . 3.94 108.184 177.682 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -48.88 -51.01 32.17 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 123.576 0.75 . . . . 1.77 110.411 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -49.28 -46.76 46.8 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.379 0.671 . . . . 3.4 111.494 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 10.0 t -71.16 -39.22 72.03 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.95 0.5 . . . . 2.14 111.417 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 41.0 mt -68.63 -46.66 68.62 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.583 1.153 . . . . 1.63 110.826 -174.897 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -61.46 -10.31 7.39 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.694 2.398 . . . . 1.64 115.989 -173.985 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 1.1 p -33.49 -18.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.529 1 C-N-CA 132.607 4.363 . . . . 2.82 119.956 -141.095 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.33 -38.3 41.14 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 120.053 1.297 . . . . 3.24 109.476 156.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 70.94 67.68 0.17 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 126.626 1.97 . . . . 3.27 109.303 -177.888 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 16.5 p30 -126.97 -13.66 5.7 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.463 1.905 . . . . 1.97 113.525 -174.055 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 4.5 m 88.53 -10.0 0.48 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 127.203 2.201 . . . . 2.22 114.061 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -111.57 115.04 28.51 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 119.346 0.975 . . . . 3.32 108.922 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.73 97.53 9.18 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 106.016 -1.846 . . . . 1.35 106.016 173.241 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -82.95 178.28 8.23 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.71 0.686 . . . . 4.28 110.67 -178.184 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 42.3 p90 -82.8 52.56 2.16 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 114.066 1.136 . . . . 5.56 114.066 -166.9 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -162.69 47.35 0.15 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.465 -1.309 . . . . 2.37 107.465 126.578 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -96.18 -63.79 1.11 Allowed 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 120.046 -1.658 . . . . 2.07 109.057 153.681 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -50.12 -43.63 51.89 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 125.992 1.717 . . . . 3.48 110.543 -175.759 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 7.7 t-105 -41.78 -43.55 2.97 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.943 0.897 . . . . 4.6 111.637 176.24 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 21.6 mtt180 -45.53 -44.57 12.76 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.615 0.643 . . . . 4.16 111.382 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.0 tp -53.72 -39.47 65.27 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.337 0.655 . . . . 0.87 111.39 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 62.5 mt -65.28 -32.73 59.52 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 N-CA-C 106.688 -1.597 . . . . 1.36 106.688 -177.758 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.559 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -69.22 -44.95 63.47 Favored Glycine 0 CA--C 1.496 -1.152 0 N-CA-C 110.297 -1.121 . . . . 1.45 110.297 -178.747 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 82' ' ' GLU . . . . . 0.442 ' OE2' ' NZ ' ' B' ' 85' ' ' LYS . 3.2 mm-40 -66.17 -62.27 1.58 Allowed 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 106.867 -1.531 . . . . 2.18 106.867 -179.382 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.525 ' HB2' HD23 ' B' ' 49' ' ' LEU . 3.7 pp -54.42 -37.06 64.66 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.466 1.03 . . . . 1.76 112.452 -178.506 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.69 -61.44 2.62 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.549 0.613 . . . . 2.02 109.869 173.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 85' ' ' LYS . . . . . 0.442 ' NZ ' ' OE2' ' B' ' 82' ' ' GLU . 2.1 ptpp? -66.73 -23.76 66.14 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 118.037 -0.982 . . . . 1.45 111.789 -173.457 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -53.11 -25.67 13.88 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.993 1.717 . . . . 3.08 111.656 173.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 3.8 tt -59.57 -36.27 64.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 CA-C-N 118.709 0.686 . . . . 1.01 110.447 172.753 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 -82.91 -48.23 10.93 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.801 1.641 . . . . 4.03 112.011 169.527 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 43.5 tttm -86.09 126.45 34.2 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.934 1.694 . . . . 6.51 112.043 -159.341 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 90' ' ' LYS . . . . . 0.413 ' HG2' ' H ' ' B' ' 90' ' ' LYS . 40.8 pttt -82.85 -55.78 4.21 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.299 1.44 . . . . 6.31 110.26 169.033 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 6.1 mmtp -163.71 18.34 0.07 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.392 1.877 . . . . 6.21 110.529 -169.009 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.74 54.58 3.18 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 126.921 2.088 . . . . 4.42 108.468 -163.974 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.86 -94.78 0.26 Allowed 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.613 1.165 . . . . 5.07 108.653 175.377 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt 41.78 61.42 1.89 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.62 1.568 . . . . 7.3 113.558 176.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 24.7 pt -132.0 155.56 41.69 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 124.306 1.043 . . . . 8.26 108.654 171.764 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -170.63 150.27 3.33 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 125.676 1.59 . . . . 8.14 107.676 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -176.86 137.57 0.25 Allowed 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 106.069 -1.826 . . . . 8.0 106.069 -172.895 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.251 1.142 0 N-CA-C 108.15 -1.056 . . . . 6.51 108.15 177.488 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.7 mtt . . . . . 0 N--CA 1.47 0.541 0 CA-C-O 119.464 -0.303 . . . . 9.17 111.301 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -178.69 158.62 1.03 Allowed 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 125.831 1.652 . . . . 3.85 107.581 -174.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 56.66 58.63 4.01 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.119 0.968 . . . . 4.7 110.752 -176.353 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -149.71 54.75 1.66 Allowed Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 125.615 1.566 . . . . 7.94 109.955 -172.872 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -82.5 -13.93 9.47 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.964 2.443 . . . . 7.44 113.291 -173.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 58.5 mt -72.23 134.8 45.82 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.38 0.672 . . . . 2.28 110.737 -162.255 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.6 t -63.52 -61.65 2.19 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.916 0.886 . . . . 3.62 112.062 -170.317 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -177.97 -75.32 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 126.253 1.821 . . . . 3.31 106.475 -175.438 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.06 -42.93 40.26 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.471 0.708 . . . . 1.25 111.154 171.88 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -49.64 -44.0 47.26 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.586 1.154 . . . . 2.24 112.497 174.018 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -54.59 -49.55 70.14 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.982 0.81 . . . . 3.81 109.229 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.3 t -63.78 -54.2 38.94 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.762 -0.654 . . . . 2.26 109.812 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.515 HG21 HD12 ' B' ' 83' ' ' LEU 0.352 2.8 pp -62.81 -34.6 66.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 C-N-CA 118.503 -1.279 . . . . 0.79 112.562 -178.042 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -61.06 -56.64 18.66 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 119.352 0.978 . . . . 2.86 108.95 173.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.88 -39.31 65.6 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.878 0.847 . . . . 1.39 111.556 -171.798 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.8 m -75.23 -37.43 39.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 120.798 -1.189 . . . . 0.9 111.815 175.644 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 28.3 t -58.66 -48.68 85.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 119.808 1.186 . . . . 0.88 110.803 174.225 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -59.52 -38.32 80.67 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.853 -1.154 . . . . 0.99 110.347 175.351 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.0 m -56.14 -49.82 72.85 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 118.669 0.668 . . . . 1.02 110.115 171.482 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -50.99 -52.7 40.11 Favored 'General case' 0 C--N 1.342 0.276 0 CA-C-N 118.613 0.642 . . . . 5.01 109.805 176.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -55.94 -58.21 8.83 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.199 0.444 . . . . 3.49 112.199 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -65.07 -24.31 67.42 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 121.152 0.501 . . . . 2.38 111.397 -175.316 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.512 ' CZ ' ' HB2' ' A' ' 41' ' ' LEU . 8.1 t80 -80.55 -51.77 8.38 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 124.271 1.028 . . . . 4.55 112.711 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.7 -22.89 65.73 Favored 'General case' 0 C--O 1.24 0.59 0 C-N-CA 126.352 1.861 . . . . 1.52 113.065 -166.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -69.12 -19.8 64.04 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.215 1.406 . . . . 4.69 112.385 175.575 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -41.9 -62.19 0.96 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.396 0.998 . . . . 2.82 113.041 -172.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -127.37 106.8 9.45 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 126.495 1.918 . . . . 3.86 105.93 -175.68 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 62.56 118.11 0.01 OUTLIER Glycine 0 CA--C 1.534 1.269 0 CA-C-N 118.822 0.737 . . . . 2.4 113.763 169.654 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.0 ttm180 63.41 102.85 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 121.794 0.806 . . . . 4.89 113.006 162.63 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt -73.06 59.96 0.54 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.219 1.007 . . . . 5.93 112.845 -177.256 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -156.19 -62.76 0.11 Allowed 'General case' 0 C--O 1.231 0.091 0 C-N-CA 128.023 2.529 . . . . 3.69 106.404 177.018 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.0 p -84.13 135.55 34.34 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 123.666 0.786 . . . . 2.12 110.993 -174.071 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -88.93 143.6 26.76 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.418 -0.956 . . . . 2.45 108.418 168.109 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.9 m -111.9 175.86 5.26 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.349 0.659 . . . . 2.05 109.952 168.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.9 p -57.05 -50.22 77.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 N-CA-C 114.008 1.114 . . . . 3.09 114.008 -164.327 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -64.94 -50.41 66.54 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 118.697 0.68 . . . . 3.19 109.184 -177.089 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -37.02 -57.85 0.81 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.149 1.38 . . . . 2.28 110.097 166.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.49 -55.6 23.99 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 121.917 -0.489 . . . . 3.12 110.75 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -55.84 -41.94 75.05 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 120.658 -0.417 . . . . 4.22 111.505 -177.414 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -49.94 -44.09 50.34 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 118.159 0.436 . . . . 2.9 111.022 177.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.512 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 9.6 tp -66.47 -47.58 72.63 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.831 0.741 . . . . 2.73 109.323 -173.195 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 23.3 m -74.12 -29.13 24.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-N 115.041 -0.981 . . . . 1.66 109.951 -171.58 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 84.8 m -78.05 -47.04 19.27 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.712 0.805 . . . . 2.36 110.263 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 51.9 tt0 -81.39 -59.95 2.44 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.373 1.069 . . . . 2.79 111.93 -171.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.459 HE21 HD12 ' A' ' 41' ' ' LEU . 3.3 mp0 -76.8 -51.8 10.69 Favored 'General case' 0 C--N 1.338 0.083 0 O-C-N 122.101 -0.375 . . . . 4.41 110.206 -169.985 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 mp -81.69 114.44 50.04 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 124.846 1.258 . . . . 1.93 110.033 -171.623 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -84.79 -58.96 0.02 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 122.965 2.444 . . . . 2.11 110.304 -174.34 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -141.26 9.03 2.06 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.068 0.947 . . . . 4.49 113.442 -168.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.4 tp -55.68 -78.88 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 122.073 0.939 . . . . 1.87 109.348 171.148 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.6 mt -79.4 -55.88 4.74 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.539 -0.912 . . . . 3.69 108.539 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 39.79 38.14 0.41 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.467 1.907 . . . . 5.49 112.331 -168.507 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 62.2 t0 -108.37 12.51 26.28 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 130.137 3.375 . . . . 6.15 108.616 -175.769 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 18.8 m -66.25 -22.43 30.2 Favored 'Isoleucine or valine' 0 C--N 1.341 0.207 0 C-N-CA 124.738 1.215 . . . . 2.28 112.172 -171.781 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.6 -32.55 46.63 Favored Glycine 0 CA--C 1.529 0.967 0 N-CA-C 111.009 -0.836 . . . . 3.33 111.009 169.658 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 18.7 m -124.22 60.42 1.14 Allowed 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.186 0.994 . . . . 3.06 108.928 178.591 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -74.37 -38.65 63.12 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.792 1.237 . . . . 1.77 110.172 176.096 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -54.51 -50.84 66.88 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.406 0.682 . . . . 4.37 111.415 -173.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -57.21 -41.44 79.42 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 121.897 -0.502 . . . . 2.8 111.713 177.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.04 -59.33 5.44 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.36 -0.978 . . . . 2.61 108.36 173.122 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -46.84 -51.48 16.5 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.202 0.601 . . . . 1.52 111.001 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -56.99 -47.6 80.42 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.665 0.786 . . . . 3.33 110.72 177.6 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 45.6 m -59.62 -39.67 85.06 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 122.195 -0.316 . . . . 1.85 111.419 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -69.81 -49.43 52.83 Favored 'General case' 0 CA--C 1.53 0.18 0 O-C-N 121.933 -0.479 . . . . 1.79 110.812 176.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -76.85 62.28 2.04 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.661 0.784 . . . . 1.82 110.043 -176.718 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.6 m -56.78 -31.32 35.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 124.698 1.199 . . . . 1.78 112.194 -176.101 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -88.8 -3.0 58.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.558 1.543 . . . . 2.58 112.057 178.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 54.87 63.35 2.16 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 125.6 1.56 . . . . 4.21 111.982 165.042 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.3 p30 -130.41 -1.77 4.42 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.784 1.234 . . . . 2.2 112.894 -173.979 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.2 p 64.3 12.67 7.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.231 1.812 . . . . 2.98 114.062 -175.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -113.37 106.47 14.63 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.614 1.565 . . . . 3.27 108.377 169.043 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.14 81.78 7.25 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 103.414 -2.81 . . . . 1.11 103.414 167.201 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.3 ttmt -67.37 161.15 25.81 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.638 0.775 . . . . 4.44 108.985 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -38.65 -53.57 1.61 Allowed 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.309 1.226 . . . . 5.79 114.309 -169.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -65.06 -40.22 94.4 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 121.53 -0.731 . . . . 2.28 112.637 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -63.8 -52.73 58.92 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.805 -1.183 . . . . 1.99 107.805 178.631 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -52.13 -45.59 65.03 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.55 0.74 . . . . 3.12 110.704 176.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.454 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.4 OUTLIER -40.29 -45.1 2.04 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-O 117.364 -1.303 . . . . 5.25 110.382 173.59 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -39.36 -46.34 1.59 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 120.753 1.615 . . . . 5.45 111.776 -178.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.2 tp -56.25 -45.14 80.17 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.016 0.826 . . . . 0.97 112.989 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.1 mt -69.44 -40.78 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 C-N-CA 125.155 1.382 . . . . 2.29 108.18 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.437 ' HA3' ' CZ2' ' B' ' 77' ' ' TRP . . . -44.45 -57.99 4.82 Favored Glycine 0 N--CA 1.436 -1.337 0 N-CA-C 109.529 -1.428 . . . . 2.14 109.529 172.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -66.57 -50.97 61.37 Favored 'General case' 0 N--CA 1.435 -1.213 0 CA-C-N 112.134 -2.033 . . . . 2.8 107.751 -174.308 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.1 tp -37.26 -53.88 1.06 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.297 1.839 . . . . 3.06 111.747 -178.807 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.02 -34.02 65.46 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.976 0.911 . . . . 1.83 112.802 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -81.84 -48.18 11.9 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.119 0.968 . . . . 2.19 111.637 170.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.25 -26.52 66.5 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 123.743 0.817 . . . . 4.08 112.909 -170.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.6 tp -36.79 -47.27 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 123.5 0.72 . . . . 1.56 111.046 165.44 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.52 -51.54 6.81 Favored 'General case' 0 C--N 1.345 0.382 0 O-C-N 121.472 -0.767 . . . . 5.03 109.979 170.203 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -87.48 101.66 13.82 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.148 1.379 . . . . 3.66 112.177 -170.341 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.419 ' HD2' ' H ' ' A' ' 90' ' ' LYS . 1.2 mptp? -80.38 -60.7 2.22 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 120.441 -1.412 . . . . 7.51 109.786 -176.757 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -176.19 90.6 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 103.679 -2.711 . . . . 10.35 103.679 169.363 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -66.74 80.03 0.11 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.024 0.93 . . . . 6.13 113.001 -147.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.3 tp 174.97 -54.44 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 128.466 2.706 . . . . 9.21 105.184 -170.044 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -68.62 142.53 55.09 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.275 -1.009 . . . . 11.95 108.275 170.001 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 2.28 1.3 mt 137.05 36.61 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 123.717 0.807 . . . . 10.28 111.968 175.613 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 70.8 mtp180 -115.56 -13.93 11.52 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 115.758 1.762 . . . . 13.95 115.758 -144.896 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -175.35 -42.31 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.456 1.102 . . . . 16.47 108.774 -171.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 87.8 tttt . . . . . 0 C--O 1.257 1.496 0 N-CA-C 102.551 -3.129 . . . . 17.12 102.551 127.862 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 81.4 mtp . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 119.693 -0.194 . . . . 7.6 111.365 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.337 . . -79.81 -136.11 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.21 1.804 . . . . 6.19 114.555 -171.246 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 86.04 100.94 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 127.927 2.491 . . . . 6.77 109.253 -171.306 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.434 ' HB3' ' CD ' ' B' ' 5' ' ' PRO . 31.0 tt0 -130.54 -81.7 0.0 OUTLIER Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 125.684 1.594 . . . . 6.1 111.308 -163.805 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 5' ' ' PRO . . . . . 0.434 ' CD ' ' HB3' ' B' ' 4' ' ' GLU . 94.7 Cg_endo -72.09 147.36 48.47 Favored 'Trans proline' 0 C--N 1.352 0.757 0 CA-C-N 122.591 1.961 . . . . 3.07 108.92 176.003 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.428 ' HB2' ' HB3' ' B' ' 10' ' ' GLU . 0.7 OUTLIER -148.89 149.99 32.21 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 118.695 0.68 . . . . 3.76 109.723 -158.071 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.406 HG22 ' HB2' ' B' ' 10' ' ' GLU . 10.7 t -75.33 -166.24 0.5 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.03 0.932 . . . . 2.08 111.907 -172.391 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -73.82 -60.17 2.38 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.049 -0.407 . . . . 2.82 111.091 -171.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mt -47.59 -45.75 27.59 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.169 -0.957 . . . . 1.33 110.363 172.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.428 ' HB3' ' HB2' ' B' ' 6' ' ' LEU . 2.0 tt0 -48.71 -58.78 4.23 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 126.043 1.737 . . . . 3.22 112.981 170.4 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.22 -36.9 83.38 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 120.863 -1.148 . . . . 5.11 109.204 -176.917 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 15.8 m -63.17 -37.07 85.77 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.925 0.49 . . . . 2.22 111.329 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.335 2.9 pp -70.51 -38.99 75.62 Favored 'Isoleucine or valine' 0 C--N 1.343 0.292 0 CA-C-N 118.691 0.678 . . . . 1.53 111.428 167.585 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -55.33 -52.18 64.34 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.421 1.01 . . . . 3.68 110.76 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 11.9 t -55.02 -39.63 69.33 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.42 0.629 . . . . 1.78 111.66 -176.532 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 25.6 m -77.61 -34.8 20.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 120.713 -1.242 . . . . 1.39 110.781 177.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 45.3 t -59.22 -45.54 92.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-N 119.167 0.894 . . . . 1.27 110.366 173.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.2 t -65.59 -42.41 91.73 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.711 0.687 . . . . 1.6 110.412 177.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 34.9 m -55.46 -47.34 76.23 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.089 0.859 . . . . 1.3 110.282 174.367 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -53.44 -56.43 16.93 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.157 -0.965 . . . . 3.8 110.173 172.346 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -49.52 -51.07 38.98 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.498 1.519 . . . . 3.62 111.585 -177.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 32.5 p -64.07 -28.59 69.89 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.184 -0.436 . . . . 2.3 111.736 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -82.17 -34.5 29.04 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-N 118.665 0.666 . . . . 2.98 111.791 170.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.54 -39.48 73.45 Favored 'General case' 0 C--O 1.239 0.531 0 O-C-N 120.949 -1.094 . . . . 1.03 110.475 -172.636 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 5.2 ptt180 -53.97 -44.09 70.5 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.626 -0.715 . . . . 4.22 111.755 174.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.428 ' CB ' ' HG2' ' B' ' 37' ' ' GLU . 0.5 OUTLIER -41.62 -66.24 0.36 Allowed 'General case' 0 N--CA 1.443 -0.792 0 O-C-N 124.249 0.968 . . . . 2.05 113.012 -126.572 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -96.92 -72.84 0.62 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 124.13 1.919 . . . . 6.09 112.385 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.44 80.63 1.51 Allowed Glycine 0 N--CA 1.439 -1.109 0 CA-C-N 112.076 -2.329 . . . . 2.69 109.579 -171.525 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 15.2 ttt180 71.44 111.93 0.06 Allowed 'General case' 0 C--O 1.241 0.647 0 CA-C-N 120.725 2.262 . . . . 6.09 114.026 159.733 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -66.98 64.37 0.05 Allowed 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.886 -1.134 . . . . 4.0 111.727 172.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -132.48 -65.77 0.71 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 125.374 1.47 . . . . 4.96 107.261 172.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 50.0 m -113.93 159.83 19.46 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.18 -0.918 . . . . 2.26 110.812 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 10.5 mp -98.73 123.27 42.85 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.518 1.127 . . . . 2.16 109.036 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 1.1 t -94.87 176.77 6.13 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.509 1.123 . . . . 3.04 109.377 173.402 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 23.3 m -88.55 52.94 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 O-C-N 120.655 -1.278 . . . . 2.89 112.012 -178.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -157.54 58.11 0.5 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 106.103 -1.814 . . . . 2.54 106.103 143.912 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.428 ' HG2' ' CB ' ' B' ' 26' ' ' GLN . 50.4 mt-10 -163.34 -57.21 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 129.578 3.151 . . . . 2.21 103.167 -176.121 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.439 ' CZ ' HD13 ' B' ' 63' ' ' LEU . 4.2 t80 -62.01 -59.94 4.34 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.377 -1.283 . . . . 2.26 109.456 171.426 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -56.82 -40.88 76.8 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 120.27 -0.572 . . . . 3.57 110.749 -174.863 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -50.7 -41.27 55.85 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.188 0.305 . . . . 2.64 111.437 175.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.18 -55.96 26.26 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.674 -1.232 . . . . 2.42 107.674 -175.818 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.2 m -67.94 -44.26 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.674 -0.693 . . . . 0.96 109.574 -170.602 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 87.5 m -62.86 -47.61 82.63 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 124.061 0.945 . . . . 1.58 110.243 -178.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -80.62 -55.79 4.61 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.085 0.402 . . . . 2.92 112.085 -173.428 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -81.19 -41.83 21.74 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 113.798 1.036 . . . . 2.95 113.798 -158.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -62.03 -28.76 4.16 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.186 0.81 . . . . 1.9 113.186 -156.509 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -57.27 -24.55 60.27 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.132 -2.445 . . . . 2.14 111.342 -78.21 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -91.52 -33.24 15.25 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.899 1.679 . . . . 2.93 110.653 -175.892 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 42.8 tp -58.61 -56.4 22.68 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.507 0.323 . . . . 1.32 111.449 -165.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 30.2 mt -87.24 162.69 17.3 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 108.404 -0.962 . . . . 1.97 108.404 161.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.29 170.92 14.75 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 107.557 -1.275 . . . . 4.94 107.557 165.373 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 18.7 t0 55.15 72.63 0.46 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 123.393 1.568 . . . . 4.2 109.25 -161.814 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 28.0 m -87.7 22.21 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 112.643 -2.071 . . . . 1.93 109.786 160.778 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -103.59 -70.74 0.84 Allowed Glycine 0 C--N 1.342 0.89 0 N-CA-C 108.81 -1.716 . . . . 2.61 108.81 -177.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 46.7 t -79.02 50.2 1.01 Allowed 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.619 1.167 . . . . 3.3 109.677 178.248 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -50.94 -41.65 59.16 Favored 'General case' 0 N--CA 1.444 -0.752 0 C-N-CA 125.679 1.592 . . . . 1.44 109.066 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -30.47 -48.18 0.1 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 127.743 2.417 . . . . 4.14 113.526 170.739 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -60.35 -54.55 44.33 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.309 0.576 . . . . 2.85 110.28 178.309 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 59' ' ' LYS . . . . . 0.422 ' H ' ' HE3' ' B' ' 59' ' ' LYS . 0.0 OUTLIER -58.3 -54.29 48.68 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.115 -1.439 . . . . 4.24 107.115 -179.547 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -45.51 -55.05 6.64 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.863 1.265 . . . . 1.76 110.635 178.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -64.43 -39.82 94.56 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.268 0.485 . . . . 3.14 110.855 -177.586 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.4 t -63.89 -30.23 71.33 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 122.833 0.453 . . . . 1.57 111.791 175.549 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.439 HD13 ' CZ ' ' B' ' 38' ' ' PHE . 36.6 mt -80.13 -53.91 6.25 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.595 1.158 . . . . 1.33 110.809 -178.97 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.261 16.8 t0 -54.63 -8.47 0.24 Allowed 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 128.531 2.732 . . . . 1.75 117.324 -168.869 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.8 m -34.17 -20.14 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 130.706 3.602 . . . . 1.92 119.762 -134.95 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -60.35 -25.16 65.64 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 121.281 1.855 . . . . 3.69 111.043 161.804 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 62.33 64.12 0.98 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.939 1.695 . . . . 3.47 109.908 176.147 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 39.4 p30 -104.33 -27.42 11.99 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.029 1.332 . . . . 2.56 111.546 176.363 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 35.0 m 111.35 -21.06 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.337 3.055 . . . . 2.31 111.926 -174.503 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -113.18 114.8 27.27 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 125.882 1.673 . . . . 6.14 108.566 -168.316 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -83.16 104.56 13.44 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.76 1.224 . . . . 1.42 108.336 -176.171 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -84.28 174.32 10.25 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 127.462 2.305 . . . . 5.36 112.339 -165.579 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -80.42 55.2 2.21 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.512 0.725 . . . . 5.5 109.782 167.137 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 8.3 p-10 -167.53 46.68 0.05 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 120.316 -0.554 . . . . 4.76 111.067 102.121 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 69.2 mt-10 -91.33 -60.09 1.98 Allowed 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.473 1.509 . . . . 2.18 108.577 162.094 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -45.2 -41.48 8.31 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 125.011 1.324 . . . . 3.56 111.707 -175.688 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.461 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 1.4 t90 -39.5 -48.93 2.07 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 124.527 1.142 . . . . 4.52 109.312 178.632 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 48.6 mtp85 -42.58 -36.93 1.51 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.197 0.908 . . . . 4.32 113.15 -176.153 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.1 tp -63.69 -45.26 90.83 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.829 1.195 . . . . 0.93 111.177 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 8.2 pt -77.74 -31.52 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 C-N-CA 124.216 1.006 . . . . 3.63 108.664 -177.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -46.83 -59.27 5.62 Favored Glycine 0 N--CA 1.433 -1.563 0 N-CA-C 108.461 -1.856 . . . . 1.78 108.461 165.704 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -74.51 -53.97 8.43 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 113.531 -1.334 . . . . 2.87 110.916 -169.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.515 HD12 HG21 ' A' ' 13' ' ' ILE 0.292 4.5 pp -50.6 -29.28 10.5 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 121.116 1.78 . . . . 1.85 113.157 -175.892 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.63 -46.63 77.39 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.761 0.652 . . . . 1.14 112.761 168.263 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -77.45 -35.21 54.13 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 117.871 -1.062 . . . . 2.04 112.281 172.415 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -52.99 -31.92 43.47 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 120.753 1.615 . . . . 3.22 112.17 -172.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 9.2 tt -43.34 -46.44 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 123.16 0.584 . . . . 1.52 111.61 170.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 9.5 ptm85 -85.55 -49.51 7.98 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.326 1.45 . . . . 3.81 113.699 168.574 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 23.4 tttm -69.67 95.41 0.87 Allowed 'General case' 0 CA--C 1.531 0.247 0 O-C-N 121.128 -0.983 . . . . 6.91 111.659 -174.558 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 90' ' ' LYS . . . . . 0.406 ' NZ ' ' OD2' ' B' ' 92' ' ' ASP . 4.5 ttpm? -57.82 -60.24 4.01 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.718 -0.845 . . . . 5.52 108.718 157.941 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 20.4 tptp -153.89 -14.45 0.14 Allowed 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.666 0.617 . . . . 6.95 112.666 176.677 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 92' ' ' ASP . . . . . 0.406 ' OD2' ' NZ ' ' B' ' 90' ' ' LYS . 0.9 OUTLIER -91.64 48.81 1.5 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.706 0.802 . . . . 4.93 111.22 -140.345 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 36.8 tp -97.9 -69.07 0.77 Allowed 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 108.563 -0.902 . . . . 6.58 108.563 -178.236 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -172.93 154.67 2.92 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 124.46 1.104 . . . . 10.39 108.495 175.888 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 17.1 mm -133.23 59.44 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 106.469 -1.678 . . . . 6.93 106.469 172.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -163.92 149.69 11.05 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.016 -0.735 . . . . 6.62 109.016 -178.252 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -177.56 116.89 0.09 Allowed 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 128.169 2.588 . . . . 7.08 104.596 178.358 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 6.0 tmtt? . . . . . 0 C--O 1.25 1.117 0 CA-C-O 117.36 -1.305 . . . . 7.54 108.672 -161.397 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.6 mtt . . . . . 0 N--CA 1.471 0.585 0 N-CA-C 105.188 -2.152 . . . . 6.51 105.188 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.77 174.3 0.84 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 119.292 0.951 . . . . 3.36 110.466 161.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.0 89.83 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 129.057 2.943 . . . . 3.13 109.735 -173.872 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -93.76 121.9 63.49 Favored Pre-proline 0 N--CA 1.451 -0.385 0 C-N-CA 125.019 1.327 . . . . 4.93 109.031 -178.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -72.06 154.46 57.56 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 122.174 1.916 . . . . 2.13 108.754 175.202 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 73.6 mt -109.33 169.68 8.54 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.187 0.995 . . . . 1.32 108.577 -174.459 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.5 t -75.18 159.97 30.97 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 120.885 -1.134 . . . . 1.75 110.504 -176.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -46.45 -56.85 5.32 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.193 -0.942 . . . . 2.79 113.164 -175.811 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 mt -61.08 -44.44 97.37 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.532 -0.747 . . . . 1.57 111.085 -178.307 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -54.36 -53.14 57.9 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.536 2.334 . . . . 2.66 112.208 173.65 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -53.26 -55.7 22.43 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.406 1.082 . . . . 3.58 109.274 172.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.0 t -53.08 -51.84 60.54 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.581 0.752 . . . . 1.72 112.076 -178.768 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.4 pp -65.56 -39.32 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-O 118.472 -0.775 . . . . 0.68 110.155 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -56.06 -58.08 9.42 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 119.138 0.881 . . . . 2.45 109.653 177.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.2 t -54.7 -40.86 69.59 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.351 0.596 . . . . 1.25 111.726 -172.219 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.4 m -74.28 -35.54 40.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 O-C-N 120.929 -1.107 . . . . 0.61 111.401 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 37.4 t -60.6 -48.4 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 119.285 0.948 . . . . 0.52 110.114 175.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.1 t -62.52 -42.08 99.27 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.077 0.853 . . . . 0.68 110.623 177.104 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 48.4 m -57.52 -53.45 57.98 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 118.736 0.698 . . . . 0.73 110.226 176.125 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -45.61 -54.1 8.18 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.109 0.964 . . . . 3.02 109.98 171.535 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -60.93 -50.19 74.39 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.578 0.751 . . . . 3.21 111.772 -173.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.0 t -63.94 -30.8 71.85 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.95 -0.469 . . . . 1.94 110.836 -178.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -69.71 -42.64 73.75 Favored 'General case' 0 C--O 1.221 -0.406 0 O-C-N 121.631 -0.668 . . . . 2.81 111.13 166.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.81 -22.48 66.93 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 125.259 1.423 . . . . 0.76 112.747 -170.283 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.253 0.0 OUTLIER -80.66 -15.73 55.82 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 117.112 -1.423 . . . . 4.08 113.543 175.046 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.69 -66.09 0.33 Allowed 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 120.071 1.305 . . . . 2.21 112.595 178.182 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -117.44 172.73 7.14 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 126.621 1.968 . . . . 2.47 107.219 -173.972 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -3.52 112.5 0.01 OUTLIER Glycine 0 CA--C 1.531 1.059 0 C-N-CA 127.906 2.67 . . . . 1.62 114.454 172.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.5 mtp180 62.99 106.54 0.03 OUTLIER 'General case' 0 C--O 1.236 0.387 0 N-CA-C 114.309 1.226 . . . . 6.09 114.309 175.618 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 51.56 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.835 1.654 . . . . 4.67 112.263 157.099 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -148.14 -53.13 0.19 Allowed 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 125.746 1.618 . . . . 3.99 107.505 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -118.96 162.71 18.07 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 124.533 1.133 . . . . 1.65 111.339 -175.727 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 mp -112.92 170.17 8.39 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 124.547 1.139 . . . . 2.36 110.461 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.6 t -153.77 179.48 8.82 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.991 1.716 . . . . 3.33 106.794 175.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.7 t -37.28 -62.85 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 125.768 1.627 . . . . 2.46 113.619 -166.349 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -66.2 -56.29 12.05 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.647 0.658 . . . . 2.18 109.951 -174.52 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -38.84 -45.89 1.22 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.238 1.415 . . . . 1.72 112.704 171.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -67.53 -58.02 5.45 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 122.996 0.519 . . . . 2.76 110.304 176.824 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -54.17 -39.98 67.1 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.071 0.396 . . . . 2.84 111.11 -174.215 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -47.76 -40.43 20.65 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 112.741 0.645 . . . . 3.03 112.741 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 tp -66.22 -45.92 79.01 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-N 119.404 1.002 . . . . 2.63 108.787 -175.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.8 m -68.15 -53.6 28.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 N-CA-C 108.66 -0.867 . . . . 1.35 108.66 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 93.9 m -53.08 -48.9 67.39 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.983 0.913 . . . . 1.23 111.983 179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -80.39 -52.88 7.16 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.751 0.42 . . . . 2.03 111.433 -174.663 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -106.0 6.55 31.36 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.523 1.129 . . . . 3.39 113.087 -162.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 tp -136.28 84.03 30.7 Favored Pre-proline 0 CA--C 1.537 0.457 0 O-C-N 121.079 -1.013 . . . . 1.96 108.36 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.07 -29.23 48.49 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.431 2.088 . . . . 2.35 111.696 -170.554 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -141.22 -99.52 0.14 Allowed 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 118.901 -0.571 . . . . 3.86 109.556 173.347 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.466 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 5.8 tp 51.39 -87.99 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.785 1.634 . . . . 1.5 113.127 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.4 mt -73.62 -29.52 62.41 Favored 'General case' 0 N--CA 1.458 -0.034 0 C-N-CA 125.743 1.617 . . . . 3.1 110.66 177.373 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 49.4 -173.26 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.948 2.099 . . . . 6.64 113.057 -179.097 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 46.64 42.59 11.6 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 125.958 1.703 . . . . 6.41 111.482 170.106 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -61.74 2.08 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 127.985 2.514 . . . . 2.54 113.613 -177.497 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.17 -70.15 0.97 Allowed Glycine 0 CA--C 1.53 1.0 0 N-CA-C 109.502 -1.439 . . . . 1.74 109.502 164.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -81.9 63.81 6.31 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 122.664 1.221 . . . . 1.97 110.156 -174.855 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -73.23 -28.93 62.44 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 124.553 1.141 . . . . 1.62 109.706 175.85 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 29.7 p-10 -42.02 -52.89 4.08 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.537 1.535 . . . . 4.76 112.371 173.229 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -49.2 -50.75 36.81 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.647 0.779 . . . . 4.27 110.082 176.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.45 -47.53 75.84 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.8 -0.444 . . . . 3.12 109.8 -177.259 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 16.2 tmm? -52.41 -43.69 64.95 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 123.284 0.634 . . . . 3.28 109.466 176.625 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.6 tptt -70.17 -38.32 75.38 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 122.663 0.385 . . . . 4.89 111.658 178.569 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.2 m -58.97 -34.87 72.3 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.807 0.443 . . . . 2.44 110.443 172.691 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 83.8 mt -69.37 -78.27 0.07 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 109.433 -0.58 . . . . 2.4 109.433 168.553 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.62 80.13 4.1 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 122.012 0.91 . . . . 2.55 110.443 -178.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.2 m -65.19 -19.16 25.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-N 115.617 -0.72 . . . . 3.59 111.318 165.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -69.42 -58.36 4.09 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 118.92 -0.562 . . . . 4.02 112.232 -168.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 121.85 -35.39 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 130.503 3.521 . . . . 3.99 110.322 -167.653 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' ASP . . . . . 0.434 ' C ' ' H ' ' A' ' 70' ' ' GLU . 4.0 p-10 -62.54 99.99 0.17 Allowed 'General case' 0 C--N 1.347 0.464 0 N-CA-C 105.711 -1.959 . . . . 4.22 105.711 169.852 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.0 m -78.94 36.15 0.27 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.222 1.409 . . . . 2.83 111.664 -166.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . 0.434 ' H ' ' C ' ' A' ' 68' ' ' ASP . 12.1 mp0 -121.27 121.11 37.0 Favored 'General case' 0 N--CA 1.426 -1.656 0 C-N-CA 131.647 3.979 . . . . 5.92 102.898 -178.544 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -93.15 101.25 13.54 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 106.734 -1.58 . . . . 0.98 106.734 -177.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.95 160.05 15.67 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.51 1.124 . . . . 3.72 108.575 169.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -40.45 -60.02 1.2 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.587 1.155 . . . . 5.27 111.667 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -69.14 -25.7 64.51 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.565 0.746 . . . . 1.74 112.036 -176.679 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -68.04 -59.61 3.12 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 108.497 -0.927 . . . . 1.93 108.497 172.547 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -55.44 -43.11 75.09 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.643 0.377 . . . . 3.18 110.496 -175.695 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 8.2 t-105 -39.97 -37.2 0.55 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.688 1.195 . . . . 4.17 112.171 173.578 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 44.2 mtt180 -39.49 -48.0 1.93 Allowed 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 120.302 1.41 . . . . 3.84 112.12 173.191 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.7 tp -51.52 -38.85 56.08 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.703 0.801 . . . . 0.97 111.492 -178.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 84.5 mt -67.05 -32.19 56.76 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 108.269 -1.011 . . . . 1.94 108.269 -176.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.556 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -69.61 -46.19 55.76 Favored Glycine 0 CA--C 1.485 -1.822 0 N-CA-C 110.025 -1.23 . . . . 1.24 110.025 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -61.79 -57.2 12.77 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 105.716 -1.957 . . . . 2.41 105.716 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.466 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 4.4 mp -38.39 -59.99 0.84 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 120.074 1.307 . . . . 2.75 112.339 172.476 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.46 -28.13 69.6 Favored 'General case' 0 C--O 1.225 -0.231 0 N-CA-C 113.153 0.798 . . . . 1.28 113.153 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.0 ttmt -81.45 -62.4 1.66 Allowed 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.814 1.246 . . . . 1.56 110.522 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -39.85 -49.5 2.39 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 126.489 1.915 . . . . 2.44 110.536 -174.007 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.513 HG21 HG21 ' B' ' 17' ' ' VAL . 12.2 tt -37.12 -43.71 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 125.513 1.525 . . . . 1.19 113.128 177.074 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.31 67.36 1.08 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.392 1.077 . . . . 6.66 109.86 165.457 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -75.42 158.57 32.49 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 124.389 1.075 . . . . 4.25 109.252 170.753 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -79.04 -52.98 7.49 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 109.408 -0.59 . . . . 16.8 109.408 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 24.2 ttpt -73.65 -5.49 40.81 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 119.011 -0.519 . . . . 12.93 112.341 -177.792 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -72.56 69.67 0.88 Allowed 'General case' 0 C--N 1.343 0.291 0 N-CA-C 106.999 -1.482 . . . . 6.91 106.999 160.769 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 33.5 tp -90.41 -76.33 0.43 Allowed 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 105.241 -2.133 . . . . 8.34 105.241 -171.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -139.46 131.32 27.61 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 105.907 -1.886 . . . . 11.01 105.907 176.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 17.6 tt -140.45 -57.83 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-O 118.568 -0.73 . . . . 11.82 111.224 -178.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -161.96 14.49 0.09 Allowed 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 115.114 1.524 . . . . 16.04 115.114 -178.894 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.5 mmtm -178.27 59.37 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 105.351 -2.092 . . . . 14.39 105.351 173.24 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 48.3 mttm . . . . . 0 C--O 1.258 1.552 0 CA-C-O 116.558 -1.686 . . . . 12.1 107.402 -141.608 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.387 2.6 ttp . . . . . 0 N--CA 1.476 0.841 0 N-CA-C 115.891 1.812 . . . . 6.46 115.891 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 65.61 176.16 0.21 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 115.571 1.693 . . . . 5.16 115.571 160.173 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 66.39 100.13 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.234 1.814 . . . . 4.23 115.837 161.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -156.87 161.76 28.9 Favored Pre-proline 0 CA--C 1.544 0.734 0 C-N-CA 125.061 1.345 . . . . 8.8 107.962 171.134 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -74.49 170.6 19.9 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.77 2.313 . . . . 3.32 112.427 -171.422 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 46.7 mt -132.02 140.2 48.84 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.114 0.966 . . . . 2.92 111.536 -153.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.494 HG23 ' N ' ' B' ' 8' ' ' GLU . 6.1 t -76.27 -68.52 0.58 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.38 1.472 . . . . 2.72 114.276 178.431 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.494 ' N ' HG23 ' B' ' 7' ' ' THR . 43.6 tt0 -169.57 -71.69 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.09 1.356 . . . . 2.19 108.702 -164.238 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.1 mt -51.58 -45.32 63.07 Favored 'General case' 0 C--N 1.341 0.199 0 O-C-N 121.37 -0.831 . . . . 1.14 109.243 166.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.463 ' OE1' HG22 ' B' ' 7' ' ' THR . 47.0 mt-10 -51.55 -47.27 63.49 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.514 1.526 . . . . 3.17 111.621 172.318 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -59.4 -48.46 81.56 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.224 -0.923 . . . . 3.69 110.072 176.504 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 14.4 p -62.93 -40.79 98.71 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.284 -0.885 . . . . 1.25 111.282 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.617 ' O ' HG23 ' B' ' 17' ' ' VAL 0.358 2.9 pp -62.15 -37.87 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 O-C-N 121.159 -0.963 . . . . 1.0 110.525 174.15 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -59.04 -46.07 89.16 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 119.189 -1.004 . . . . 3.3 111.961 170.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . 0.29 1.3 t -56.03 -36.7 68.27 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 120.2 1.363 . . . . 1.38 112.002 -177.056 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 8.8 m -76.17 -35.82 29.18 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 O-C-N 120.414 -1.429 . . . . 0.81 111.578 174.464 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.617 HG23 ' O ' ' B' ' 13' ' ' ILE . 94.1 t -57.63 -46.69 86.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 119.188 0.903 . . . . 1.29 110.254 174.653 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.8 t -64.54 -40.84 96.32 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.411 -0.805 . . . . 1.58 110.474 177.908 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 27.6 m -57.25 -54.87 41.89 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.478 1.036 . . . . 1.21 109.355 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -42.15 -60.79 1.33 Allowed 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 124.799 1.239 . . . . 4.43 110.582 171.877 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -57.78 -54.18 49.79 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.035 0.934 . . . . 3.72 111.683 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 36.9 p -57.33 -43.34 83.29 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 122.842 0.457 . . . . 2.37 110.908 -177.639 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -68.49 -43.64 76.46 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 118.565 0.62 . . . . 2.88 111.591 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.87 -32.77 63.96 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 125.48 1.512 . . . . 1.01 110.33 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.14 -26.34 66.2 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 117.781 -1.104 . . . . 4.2 112.581 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.484 ' CB ' ' HG2' ' B' ' 37' ' ' GLU . 1.1 tp60 -52.96 -64.15 0.91 Allowed 'General case' 0 C--N 1.343 0.323 0 N-CA-C 114.799 1.407 . . . . 2.26 114.799 -153.783 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -89.43 -72.86 0.53 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.891 0.853 . . . . 2.89 110.535 -170.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.88 155.74 22.64 Favored Glycine 0 C--N 1.336 0.54 0 C-N-CA 126.634 2.064 . . . . 1.83 110.594 164.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 39.06 105.23 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 116.367 1.988 . . . . 4.59 116.367 131.891 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -72.74 15.33 0.2 Allowed 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.816 1.784 . . . . 4.73 115.816 -171.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 27.7 p-10 -90.99 -39.9 11.96 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 126.238 1.815 . . . . 4.64 110.205 175.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 11.6 p -99.67 141.33 32.62 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 127.889 2.475 . . . . 2.52 108.951 -164.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -89.25 179.62 6.07 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 107.779 -1.193 . . . . 2.1 107.779 147.091 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 17.0 t -155.66 -168.32 2.77 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 123.279 1.514 . . . . 2.35 112.191 -144.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 5.2 t -69.36 -157.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 N-CA-C 100.807 -3.775 . . . . 3.08 100.807 135.936 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -76.66 57.74 1.3 Allowed 'General case' 0 CA--C 1.549 0.915 1 O-C-N 116.153 -4.092 . . . . 2.93 112.866 -136.181 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.484 ' HG2' ' CB ' ' B' ' 26' ' ' GLN . 36.9 mt-10 -80.21 -44.53 19.6 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 127.504 2.322 . . . . 2.07 108.259 125.359 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.413 ' CZ ' HD13 ' B' ' 63' ' ' LEU . 0.2 OUTLIER -65.33 -54.35 30.2 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 122.071 -0.393 . . . . 2.45 111.756 -170.041 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 28.6 tttt -59.69 -32.5 70.55 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 118.706 -1.198 . . . . 3.25 110.367 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -57.56 -33.48 68.18 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 112.59 0.589 . . . . 2.79 112.59 172.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -63.46 -55.5 23.71 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 107.836 -1.172 . . . . 2.81 107.836 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -69.66 -38.91 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 CA-C-N 116.028 -0.533 . . . . 0.85 110.1 -171.988 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 98.1 m -62.57 -54.57 37.74 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.77 0.828 . . . . 0.84 110.684 175.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -72.36 -60.07 2.42 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.107 -0.371 . . . . 3.02 110.755 -172.655 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -80.02 -58.41 3.17 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 122.301 -0.249 . . . . 3.37 111.38 -159.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 46' ' ' LEU . . . . . 0.441 HD11 HD22 ' B' ' 83' ' ' LEU . 2.0 mm? -50.53 -38.57 42.16 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 124.729 1.211 . . . . 2.02 114.242 -155.422 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -52.54 -49.15 18.45 Favored 'Trans proline' 0 N--CA 1.452 -0.914 0 C-N-CA 119.783 -3.007 . . . . 2.09 109.021 -76.745 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -51.34 -52.6 44.02 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 126.915 2.086 . . . . 3.22 112.129 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.412 HD23 ' HB2' ' B' ' 83' ' ' LEU . 21.6 tp -54.52 -46.9 73.6 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.607 0.242 . . . . 1.02 110.941 -163.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 91.9 mt -106.16 68.03 0.76 Allowed 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 124.913 1.285 . . . . 1.62 110.046 165.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.29 0.49 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 129.084 2.954 . . . . 6.15 117.715 158.108 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -107.15 90.88 3.44 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 105.233 -2.136 . . . . 3.55 105.233 162.406 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 30.2 m -97.38 21.0 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 115.391 -0.822 . . . . 2.23 109.133 164.468 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -95.17 -76.12 1.31 Allowed Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 108.239 -1.944 . . . . 2.51 108.239 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 11.5 m -79.4 52.25 1.34 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 126.637 1.975 . . . . 2.42 111.465 -164.736 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -67.98 -28.48 67.47 Favored 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 124.129 0.972 . . . . 1.28 109.4 178.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -65.12 -48.12 74.75 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.023 0.829 . . . . 4.01 109.993 173.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -53.66 -53.0 58.15 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.673 0.789 . . . . 2.87 109.126 173.829 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -57.75 -46.26 84.74 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 118.849 -0.596 . . . . 3.99 110.231 178.344 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -53.07 -52.72 57.64 Favored 'General case' 0 N--CA 1.462 0.137 0 C-N-CA 124.215 1.006 . . . . 1.9 109.604 178.941 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -55.73 -44.2 77.32 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.004 0.522 . . . . 3.51 110.119 176.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 16.1 m -66.89 -30.78 71.03 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.028 0.751 . . . . 1.87 113.028 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.413 HD13 ' CZ ' ' B' ' 38' ' ' PHE . 37.4 mt -80.47 -56.41 4.2 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 125.307 1.443 . . . . 1.43 109.641 -177.248 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -67.24 -10.18 48.03 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 127.626 2.37 . . . . 1.58 115.607 -167.345 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 21.4 m -33.01 -20.79 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 C-N-CA 130.349 3.46 . . . . 1.4 119.613 -133.713 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -57.35 -27.86 62.64 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 121.117 1.78 . . . . 2.76 110.978 160.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 64.88 60.93 0.81 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.397 1.479 . . . . 3.08 110.589 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 44.6 p30 -107.22 -13.21 15.2 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.064 1.746 . . . . 1.98 111.656 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 14.3 m 69.41 15.14 8.42 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.412 1.485 . . . . 1.77 113.526 -173.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -114.48 101.12 8.83 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 106.185 -1.783 . . . . 3.11 106.185 160.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -78.11 104.16 8.5 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.975 -1.861 . . . . 1.05 105.975 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -81.43 176.8 9.4 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 121.476 0.655 . . . . 4.69 109.742 -171.452 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -80.57 82.71 6.52 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 107.809 -1.182 . . . . 5.14 107.809 -174.854 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 97.68 50.21 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.325 1 C-N-CA 133.666 4.786 . . . . 2.44 108.126 -172.593 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -89.05 -59.48 2.21 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 120.698 -1.251 . . . . 2.16 108.521 107.168 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -38.49 -51.75 1.58 Allowed 'General case' 0 C--N 1.345 0.384 0 C-N-CA 126.525 1.93 . . . . 3.52 112.338 -172.296 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 46.2 t90 -44.61 -34.33 2.12 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 125.737 1.615 . . . . 3.62 112.807 -176.083 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 78' ' ' ARG . . . . . 0.404 ' HB2' HD23 ' B' ' 63' ' ' LEU . 7.8 mmm180 -40.8 -45.51 2.48 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.947 0.899 . . . . 4.09 111.7 172.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 6.1 tp -54.58 -44.49 73.03 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 118.547 0.612 . . . . 0.88 111.402 178.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 34.5 mt -64.08 -30.26 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.806 0 N-CA-C 107.302 -1.37 . . . . 1.49 107.302 -178.034 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.577 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -68.07 -44.43 77.35 Favored Glycine 0 CA--C 1.497 -1.057 0 C-N-CA 124.765 1.174 . . . . 1.5 112.088 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 82' ' ' GLU . . . . . 0.41 ' OE2' ' NZ ' ' B' ' 85' ' ' LYS . 2.3 mm-40 -65.57 -61.89 1.83 Allowed 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 107.203 -1.406 . . . . 2.7 107.203 178.257 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.441 HD22 HD11 ' B' ' 46' ' ' LEU . 3.8 pp -56.85 -34.64 68.0 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.038 0.835 . . . . 1.88 112.062 -178.016 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.67 -61.49 2.55 Favored 'General case' 0 C--N 1.34 0.188 0 O-C-N 121.611 -0.681 . . . . 1.53 110.315 172.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 85' ' ' LYS . . . . . 0.41 ' NZ ' ' OE2' ' B' ' 82' ' ' GLU . 0.1 OUTLIER -60.66 -33.85 73.43 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 118.291 -0.862 . . . . 1.73 110.138 -175.316 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -50.67 -33.75 23.83 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 125.457 1.503 . . . . 2.98 112.046 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 4.3 tt -56.95 -38.66 60.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 119.091 0.859 . . . . 1.16 110.634 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -82.19 -41.59 20.12 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.779 1.632 . . . . 4.22 110.225 175.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -108.48 101.58 10.74 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 125.018 1.327 . . . . 4.81 111.254 -166.057 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -39.65 -14.94 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.081 0 N-CA-C 117.432 2.382 . . . . 6.66 117.432 166.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? 86.74 59.91 0.01 OUTLIER 'General case' 0 C--N 1.341 0.221 0 C-N-CA 128.983 2.913 . . . . 5.51 109.001 -161.629 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -76.36 -144.64 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.49 1.116 . . . . 5.09 108.64 166.981 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 5.3 tp -52.88 114.15 1.33 Allowed 'General case' 0 N--CA 1.434 -1.248 0 C-N-CA 125.746 1.618 . . . . 8.74 111.904 -176.764 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.22 137.13 0.39 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.494 1.518 . . . . 6.98 112.578 159.244 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 5.7 pt -125.18 89.42 1.43 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 C-N-CA 125.243 1.417 . . . . 9.16 109.504 -177.17 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 5.5 ttp180 -155.92 153.38 29.53 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 107.527 -1.286 . . . . 8.8 107.527 173.576 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.09 137.8 0.23 Allowed 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 105.844 -1.91 . . . . 6.72 105.844 -178.14 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 10.7 tptp . . . . . 0 C--O 1.257 1.474 0 N-CA-C 103.617 -2.735 . . . . 7.52 103.617 169.689 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.9 mtp . . . . . 0 N--CA 1.472 0.67 0 N-CA-C 105.251 -2.129 . . . . 7.3 105.251 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.07 -153.77 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 124.072 0.857 . . . . 3.92 110.274 165.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.16 57.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 125.132 1.373 . . . . 5.39 108.484 -129.049 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -75.4 116.36 54.0 Favored Pre-proline 0 CA--C 1.54 0.574 0 C-N-CA 126.638 1.975 . . . . 5.66 109.68 -176.66 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -76.97 101.32 1.5 Allowed 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.507 2.138 . . . . 3.23 109.853 -178.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 94.7 mt -70.54 157.75 37.34 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 121.66 0.743 . . . . 2.04 110.742 175.456 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.1 m -48.44 136.89 12.11 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.307 1.843 . . . . 2.26 111.47 172.042 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -45.31 -54.17 7.49 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 119.027 0.83 . . . . 2.79 112.59 174.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.1 mt -57.67 -43.95 85.37 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 119.534 -0.867 . . . . 1.66 111.167 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -58.96 -51.31 70.62 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.928 0.785 . . . . 2.5 112.132 175.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -50.36 -55.7 14.52 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.703 0.764 . . . . 3.15 109.608 176.104 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.5 p -62.94 -42.22 99.74 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.625 -0.716 . . . . 1.44 112.395 -175.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.54 -33.28 48.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 119.651 1.114 . . . . 1.01 111.006 177.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -61.3 -57.24 13.16 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 118.196 -0.907 . . . . 3.23 109.86 176.673 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.1 t -51.13 -41.29 59.98 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.712 1.142 . . . . 2.36 111.876 -173.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.9 m -71.78 -37.35 61.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 O-C-N 120.945 -1.097 . . . . 0.99 111.317 178.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 40.3 t -60.25 -52.29 62.98 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 119.542 1.064 . . . . 0.72 110.693 172.69 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.1 t -59.53 -45.13 92.66 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.182 -0.949 . . . . 0.9 110.376 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 88.5 m -57.44 -46.91 83.05 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.877 0.762 . . . . 1.17 111.041 176.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -49.63 -56.69 9.15 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.232 -0.655 . . . . 3.55 109.232 171.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -57.43 -48.43 79.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.976 0.51 . . . . 3.84 111.478 -175.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.6 p -60.47 -56.54 20.16 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.451 -0.574 . . . . 2.33 109.451 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -55.03 -39.15 68.82 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.729 0.695 . . . . 2.63 111.469 178.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.52 -19.32 61.96 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 125.47 1.508 . . . . 0.96 111.878 -177.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.05 -30.74 70.02 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 118.308 -0.854 . . . . 4.31 111.618 175.836 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -45.73 -63.98 0.84 Allowed 'General case' 0 C--N 1.346 0.439 0 N-CA-C 113.493 0.923 . . . . 2.05 113.493 -159.996 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -98.97 80.17 2.45 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 104.155 -2.535 . . . . 3.08 104.155 177.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 34.96 -150.62 0.01 OUTLIER Glycine 0 CA--C 1.525 0.678 0 C-N-CA 127.746 2.593 . . . . 2.21 112.866 -177.505 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 72.2 mtp85 34.16 81.91 0.02 OUTLIER 'General case' 0 C--O 1.24 0.577 0 C-N-CA 126.122 1.769 . . . . 4.9 110.513 164.487 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -74.23 29.64 0.08 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.703 2.001 . . . . 3.65 113.681 -163.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -145.0 -45.77 0.23 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.068 1.347 . . . . 3.63 107.624 -170.341 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.7 p -84.7 134.04 34.36 Favored 'General case' 0 C--O 1.244 0.798 0 O-C-N 121.366 -0.833 . . . . 1.84 111.15 171.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.418 ' HB2' ' HB2' ' A' ' 71' ' ' LEU . 2.3 mm? -90.61 120.73 31.93 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.181 1.392 . . . . 2.21 107.896 171.464 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.3 t -85.55 -179.94 7.0 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.283 1.833 . . . . 2.18 110.921 170.267 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.3 t -57.29 -58.17 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 124.925 1.29 . . . . 2.47 111.532 -176.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -63.26 -48.3 78.77 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 108.138 -1.06 . . . . 3.24 108.138 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -39.15 -52.44 1.91 Allowed 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 124.965 1.306 . . . . 2.0 112.921 172.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.417 ' CZ ' HD21 ' A' ' 56' ' ' LEU . 2.3 t80 -61.98 -53.82 50.23 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 120.941 -0.304 . . . . 2.85 110.215 175.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.3 tttt -58.23 -36.99 74.01 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 122.047 -0.408 . . . . 3.56 111.337 -172.877 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -53.72 -40.59 66.21 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.497 1.519 . . . . 2.39 110.887 173.482 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 tp -66.83 -44.02 82.2 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 119.35 0.977 . . . . 2.67 109.51 -176.771 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.424 ' HB ' HG12 ' A' ' 53' ' ' VAL . 5.8 m -76.79 -27.27 16.64 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 CA-C-N 115.914 -0.585 . . . . 1.43 111.264 -174.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.3 m -73.37 -54.85 7.33 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.158 0.583 . . . . 1.77 110.013 172.331 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -82.68 -58.78 2.75 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.232 1.413 . . . . 2.7 112.778 -167.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -83.57 -49.65 9.01 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.583 0.753 . . . . 3.3 110.901 -167.186 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.68 121.58 85.39 Favored Pre-proline 0 CA--C 1.541 0.611 0 N-CA-C 109.089 -0.708 . . . . 3.38 109.089 175.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.475 ' HD3' HG21 ' B' ' 7' ' ' THR . 97.9 Cg_endo -84.25 -37.4 0.14 Allowed 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.784 2.322 . . . . 3.31 111.627 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -151.74 -47.94 0.11 Allowed 'General case' 0 C--N 1.34 0.166 0 CA-C-O 118.335 -0.84 . . . . 4.5 111.863 -166.073 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.467 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 9.6 tp -20.76 -78.26 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 127.43 2.292 . . . . 1.89 113.409 -178.513 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.645 ' O ' HG13 ' A' ' 53' ' ' VAL . 49.8 mt -77.82 69.1 4.01 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.444 0.698 . . . . 2.6 109.489 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.38 -8.68 0.14 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.084 1.354 . . . . 5.47 114.091 175.691 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.4 -8.92 56.94 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 128.09 2.556 . . . . 5.2 110.679 176.097 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' VAL . . . . . 0.645 HG13 ' O ' ' A' ' 50' ' ' LEU . 33.4 m -39.74 -37.24 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.404 0 C-N-CA 124.395 1.078 . . . . 1.99 113.44 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -46.53 -39.64 10.54 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 124.087 0.851 . . . . 2.1 112.728 176.781 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.1 t -120.39 43.92 2.59 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.771 1.228 . . . . 2.53 109.374 174.164 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.481 HD13 ' C ' ' A' ' 56' ' ' LEU . 2.1 tm? -43.55 -44.98 6.4 Favored 'General case' 0 C--N 1.339 0.111 0 CA-C-O 122.144 0.973 . . . . 1.03 110.052 173.59 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.65 -26.04 65.2 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 125.751 1.62 . . . . 4.8 111.805 -172.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -73.02 -43.73 61.72 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.742 1.156 . . . . 3.56 108.934 171.842 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.06 -41.69 79.19 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 108.605 -0.887 . . . . 2.61 108.605 176.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -52.09 -50.28 61.91 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.038 0.535 . . . . 1.72 110.775 175.246 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.85 -43.21 94.75 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.427 0.558 . . . . 4.21 110.768 178.452 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.0 t -58.96 -40.09 83.67 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.938 0.399 . . . . 1.86 110.929 174.656 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.844 ' HB3' HD11 ' A' ' 71' ' ' LEU . 1.4 tp -65.5 -56.45 12.32 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.635 0.774 . . . . 2.74 109.884 -178.648 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -79.09 75.0 5.63 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.256 0.55 . . . . 1.89 110.576 -177.907 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.7 m -52.48 -25.59 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 123.293 0.637 . . . . 1.76 112.616 177.233 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -79.23 -29.16 42.59 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.625 0.648 . . . . 2.49 112.003 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 54.98 55.1 8.11 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.692 0.797 . . . . 3.68 110.114 -160.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 56.4 p30 -110.28 -8.26 14.75 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.229 1.811 . . . . 2.34 112.353 177.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.5 m 67.16 18.23 10.39 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.227 1.411 . . . . 2.15 112.86 -175.685 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -123.53 118.58 27.69 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.877 1.271 . . . . 3.32 108.023 166.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.844 HD11 ' HB3' ' A' ' 63' ' ' LEU . 4.1 mm? -83.22 100.94 10.9 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 106.194 -1.78 . . . . 1.24 106.194 165.203 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -62.79 164.99 7.11 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 109.19 -0.671 . . . . 3.24 109.19 169.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -39.5 -58.96 1.17 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.913 1.285 . . . . 4.76 111.218 176.565 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -70.4 -31.32 68.49 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.156 0.982 . . . . 1.69 111.357 -170.434 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -69.07 -56.77 6.71 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.876 -0.787 . . . . 1.96 108.876 173.899 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -55.04 -42.22 72.4 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 110.058 -0.349 . . . . 3.65 110.058 -178.136 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.658 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 37.3 t90 -46.18 -36.55 6.11 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 124.325 1.05 . . . . 4.6 112.286 176.186 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 8.5 mtm180 -45.71 -42.94 12.33 Favored 'General case' 0 C--N 1.346 0.427 0 CA-C-N 119.129 0.877 . . . . 4.28 111.023 174.48 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.4 tp -48.07 -50.09 29.3 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 123.398 0.679 . . . . 0.82 111.045 176.76 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 19.5 mm -65.25 -27.85 43.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 108.091 -1.077 . . . . 2.18 108.091 -175.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.538 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -61.13 -50.88 62.46 Favored Glycine 0 CA--C 1.494 -1.23 0 N-CA-C 109.429 -1.469 . . . . 1.56 109.429 173.345 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -76.95 -32.31 57.22 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-O 117.8 -1.095 . . . . 2.3 109.028 -171.254 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.467 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 7.0 mp -51.67 -58.02 7.56 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 120.297 1.408 . . . . 2.34 109.9 161.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.46 -29.62 67.93 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.792 0.837 . . . . 1.55 112.032 -176.588 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.11 -60.09 2.42 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-O 118.587 -0.72 . . . . 1.89 110.022 167.495 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -47.12 -48.63 23.06 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 127.103 2.161 . . . . 3.2 111.41 -168.97 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.5 tt -51.24 -33.54 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 112.477 0.547 . . . . 1.6 112.477 175.843 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.05 -46.44 6.81 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.597 2.359 . . . . 5.53 111.603 -174.452 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -81.91 -49.49 10.26 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 128.035 2.534 . . . . 3.38 112.959 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 12.1 tptm -65.48 -24.47 67.16 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.186 -0.946 . . . . 9.26 112.423 -158.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -118.9 31.53 6.6 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.806 1.242 . . . . 11.17 110.74 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -53.92 -53.75 48.31 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 115.809 1.781 . . . . 6.94 115.809 -154.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 19.0 tp -29.74 -52.48 0.13 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 130.809 3.643 . . . . 10.4 115.952 -160.594 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -55.15 121.27 8.43 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.878 -0.514 . . . . 12.64 111.616 -169.42 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 48.6 pt -67.2 171.28 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.101 0.96 . . . . 15.13 111.161 177.77 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? 66.88 -139.83 0.14 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 105.812 -1.921 . . . . 19.51 105.812 -154.831 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.405 ' NZ ' ' O ' ' B' ' 2' ' ' ALA 2.343 0.0 OUTLIER 152.09 -18.28 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 119.327 3.084 . . . . 11.55 119.327 159.23 . . . . . . . . 4 4 . 1 . 008 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.402 ' C ' ' H ' ' A' ' 97' ' ' LYS . 5.5 mtpm? . . . . . 0 C--O 1.247 0.966 0 CA-C-N 125.197 3.635 . . . . 14.86 110.942 54.11 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 87.1 mtp . . . . . 0 N--CA 1.472 0.661 0 CA-C-O 117.321 -1.323 . . . . 8.35 108.76 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ALA . . . . . 0.405 ' O ' ' NZ ' ' A' ' 97' ' ' LYS . . . -126.07 -177.82 4.09 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.68 1.127 . . . . 5.93 113.869 -145.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 86.38 101.16 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.738 2.015 . . . . 5.11 113.681 167.837 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -138.38 174.89 3.77 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 129.403 3.081 . . . . 6.76 104.796 172.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -88.02 133.23 2.9 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 123.348 2.699 . . . . 2.78 110.521 173.085 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.43 HD13 ' HB3' ' B' ' 10' ' ' GLU . 2.1 mt -139.21 -177.63 5.0 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 113.594 0.961 . . . . 2.3 113.594 -154.277 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.475 HG21 ' HD3' ' A' ' 47' ' ' PRO . 10.0 t -81.03 -173.25 4.18 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.758 1.223 . . . . 2.19 110.088 166.432 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 73.8 tt0 -73.11 -54.66 7.93 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.256 0.622 . . . . 3.68 111.875 -173.263 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mt -53.28 -46.66 69.39 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.199 -0.938 . . . . 1.68 109.64 177.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.445 ' OE1' HD13 ' A' ' 49' ' ' LEU . 15.7 mt-10 -51.8 -54.99 22.63 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 113.917 1.08 . . . . 2.94 113.917 169.478 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -60.96 -33.97 74.03 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.882 1.219 . . . . 4.16 110.331 -177.986 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 13.4 m -60.94 -55.74 29.39 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.213 0.605 . . . . 1.32 110.891 173.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.28 2.3 pp -60.49 -39.23 80.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 O-C-N 121.505 -0.747 . . . . 1.31 110.87 179.58 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -61.12 -55.94 26.59 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.75 0.704 . . . . 2.59 110.241 175.269 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.1 t -54.54 -38.53 66.69 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.194 0.906 . . . . 1.43 111.214 -173.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 12.8 m -75.41 -37.42 38.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 O-C-N 121.356 -0.84 . . . . 1.24 111.494 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 25.0 t -58.6 -46.68 90.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 119.759 1.163 . . . . 1.33 110.785 173.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 15.0 t -65.83 -46.87 76.92 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.353 -0.842 . . . . 1.56 110.516 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 86.1 m -59.21 -45.53 90.86 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 120.081 1.309 . . . . 1.3 110.861 176.428 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -47.07 -54.94 9.22 Favored 'General case' 0 C--O 1.225 -0.196 0 N-CA-C 109.231 -0.655 . . . . 4.3 109.231 170.03 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -58.89 -51.66 69.07 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 122.977 0.511 . . . . 2.67 111.697 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 41.5 p -62.15 -35.18 77.99 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.556 -0.715 . . . . 2.23 111.229 -177.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -70.03 -44.11 69.93 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.468 0.576 . . . . 2.98 111.016 170.376 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.93 -27.13 68.63 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.356 1.463 . . . . 1.11 111.0 -173.045 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -55.72 -26.37 44.93 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 118.926 -0.559 . . . . 3.99 110.957 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.61 -70.9 0.14 Allowed 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 116.085 1.883 . . . . 3.37 116.085 -147.542 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -95.14 -76.92 0.48 Allowed 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 122.328 1.061 . . . . 3.08 113.257 -169.421 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.43 112.38 4.22 Favored Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 127.447 2.451 . . . . 2.33 109.557 168.079 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.6 ttt85 66.85 109.07 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 121.027 2.413 . . . . 4.43 115.845 149.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 21.1 pttt -53.35 -13.64 0.6 Allowed 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 116.565 2.061 . . . . 4.15 116.565 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -88.46 -46.41 9.15 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.761 0.824 . . . . 3.87 110.494 -170.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 5.4 p -107.28 163.27 13.17 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 126.69 1.996 . . . . 1.9 109.512 -175.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 mp -120.78 140.75 51.26 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-O 121.718 0.771 . . . . 2.78 112.743 170.183 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 5.1 t -86.33 -170.06 2.92 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 128.473 2.709 . . . . 2.7 110.427 174.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 67.7 t -66.65 -108.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.384 1 C-N-CA 132.056 4.142 . . . . 2.66 100.215 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -75.42 58.01 0.96 Allowed 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 124.068 3.122 . . . . 2.62 112.511 -175.154 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -123.97 -47.5 1.92 Allowed 'General case' 0 CA--C 1.542 0.639 1 C-N-CA 131.897 4.079 . . . . 2.11 106.301 154.114 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -60.7 -48.02 83.65 Favored 'General case' 0 C--N 1.344 0.336 0 O-C-N 121.282 -0.886 . . . . 2.84 109.925 166.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 13.7 ttmt -59.57 -31.84 69.82 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.217 0.532 . . . . 2.99 110.121 -171.513 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -54.73 -41.37 70.29 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 123.461 0.705 . . . . 2.93 112.241 173.901 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.1 tp -63.89 -47.24 81.41 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 120.391 1.45 . . . . 2.07 109.403 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 16.9 m -69.66 -41.0 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 CA-C-N 115.346 -0.843 . . . . 0.9 109.477 -172.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 85.4 m -68.13 -55.55 11.99 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 123.401 0.68 . . . . 1.12 110.519 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -81.84 -58.84 2.81 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.627 1.571 . . . . 2.45 111.635 -163.941 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.33 -41.23 25.19 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 122.017 -0.427 . . . . 3.91 111.093 -172.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.9 tp -82.59 -14.55 0.21 Allowed Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 119.129 3.011 . . . . 2.09 119.129 -158.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -38.96 -56.73 1.1 Allowed 'Trans proline' 0 CA--C 1.535 0.572 1 C-N-CA 125.601 4.201 . . . . 2.33 116.274 -133.725 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -71.44 -26.58 62.79 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.741 -0.6 . . . . 3.41 112.439 -169.013 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 39.0 tp -62.33 -77.01 0.05 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.081 0.552 . . . . 1.44 111.402 -166.144 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.81 97.68 8.75 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.293 -1.003 . . . . 1.63 108.293 168.695 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 15.6 pttp -63.54 179.33 0.47 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.007 0.432 . . . . 5.27 110.209 167.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 57.65 34.98 25.18 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.248 1.019 . . . . 5.77 109.882 177.347 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -55.55 -22.08 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 125.933 1.693 . . . . 3.1 112.999 -173.823 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -46.01 -41.95 11.35 Favored Glycine 0 CA--C 1.531 1.075 0 N-CA-C 111.316 -0.714 . . . . 2.34 111.316 168.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 82.5 p -76.28 43.11 0.29 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 117.723 0.761 . . . . 4.23 112.179 -178.993 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.426 HD13 ' C ' ' B' ' 56' ' ' LEU . 3.2 tm? -74.94 -50.16 17.7 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 120.98 -1.075 . . . . 1.16 109.055 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.46 -14.17 62.74 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.91 -0.494 . . . . 4.36 112.327 -161.003 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -80.54 -41.42 24.17 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.702 0.801 . . . . 2.91 111.517 165.288 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 59' ' ' LYS . . . . . 0.422 ' O ' HD12 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -55.37 -49.64 71.77 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 107.584 -1.265 . . . . 3.54 107.584 171.238 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -39.62 -53.83 2.09 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 124.033 0.933 . . . . 1.96 110.978 176.846 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -60.74 -37.61 82.34 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.361 0.504 . . . . 2.78 112.361 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.0 t -67.18 -30.44 70.39 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.844 0.683 . . . . 2.42 112.844 175.251 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.422 HD12 ' O ' ' B' ' 59' ' ' LYS . 5.9 mp -80.32 -54.52 5.64 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.455 -0.778 . . . . 1.53 110.385 176.046 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -54.31 -12.04 0.6 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 128.562 2.745 . . . . 1.51 116.051 -170.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -35.66 -21.99 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.408 1 C-N-CA 132.404 4.281 . . . . 2.68 119.681 -130.367 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 16.8 p30 -64.82 -19.1 65.67 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 120.198 1.363 . . . . 2.37 110.949 163.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 65.13 58.8 0.87 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.323 1.049 . . . . 2.9 110.041 169.526 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -108.24 -6.54 16.3 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.395 1.878 . . . . 1.83 110.839 -178.397 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m 67.97 12.66 8.9 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.448 1.499 . . . . 2.16 113.753 -173.515 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -114.93 100.88 8.53 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.372 1.469 . . . . 3.02 107.106 162.249 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.92 100.55 0.21 Allowed 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 106.038 -1.838 . . . . 1.08 106.038 166.992 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.8 tppt? -84.22 167.63 16.48 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.729 1.612 . . . . 4.21 110.199 -167.821 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -92.1 52.44 1.97 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.646 0.736 . . . . 4.35 110.951 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -162.28 49.74 0.19 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 105.925 -1.88 . . . . 2.11 105.925 113.782 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -95.68 -61.08 1.52 Allowed 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 119.914 -1.741 . . . . 2.05 109.097 148.34 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -53.23 -37.73 62.31 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.567 1.147 . . . . 4.27 110.786 -170.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.658 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 17.7 t-105 -39.35 -37.77 0.47 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.129 1.372 . . . . 4.41 111.535 172.608 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 -37.77 -49.39 1.16 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.595 1.558 . . . . 5.47 111.605 173.302 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.8 tp -53.4 -40.79 65.34 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-O 119.741 -0.171 . . . . 0.88 110.582 -176.241 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 76.4 mt -63.75 -28.15 44.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 N-CA-C 108.602 -0.888 . . . . 1.73 108.602 -173.1 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.58 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -76.01 -45.8 15.13 Favored Glycine 0 CA--C 1.487 -1.671 0 N-CA-C 109.857 -1.297 . . . . 1.3 109.857 178.343 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -68.2 -34.63 76.62 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 107.823 -1.177 . . . . 2.28 107.823 -175.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 5.4 mt -49.23 -60.16 3.05 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 120.642 1.565 . . . . 2.14 111.087 169.388 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.46 -50.83 68.83 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 122.092 0.949 . . . . 1.18 110.127 -179.355 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 12.7 ttpp -60.18 -40.15 89.01 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 123.769 0.828 . . . . 1.57 110.329 -177.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -64.37 -43.11 95.54 Favored 'General case' 0 C--O 1.226 -0.144 0 C-N-CA 125.716 1.606 . . . . 2.77 110.417 176.704 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -32.14 47.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 119.545 -0.862 . . . . 1.62 110.836 171.023 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.91 -36.27 42.15 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 113.75 1.019 . . . . 3.54 113.75 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -121.23 150.86 40.71 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.25 1.42 . . . . 6.47 112.285 -168.141 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.53 -35.59 21.02 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 114.588 1.329 . . . . 6.13 114.588 146.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 40.9 tptt -104.6 -41.29 5.74 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 115.427 1.64 . . . . 7.75 115.427 -148.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.64 138.94 51.66 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.186 0.903 . . . . 6.91 109.411 178.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 1.3 pp 171.49 -41.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 128.16 2.584 . . . . 7.22 108.26 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -76.92 142.79 39.94 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.799 -0.815 . . . . 8.69 108.799 174.193 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 14.7 tt -155.94 170.64 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 106.843 -1.54 . . . . 7.25 106.843 -174.856 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 52.7 ttt180 -146.13 170.38 16.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 107.863 -1.162 . . . . 8.1 107.863 -176.292 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.19 136.66 0.29 Allowed 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 126.044 1.738 . . . . 6.46 107.235 179.593 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 53.2 tptt . . . . . 0 C--O 1.252 1.197 0 N-CA-C 104.971 -2.233 . . . . 8.28 104.971 154.133 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.1 mtp . . . . . 0 N--CA 1.472 0.665 0 N-CA-C 106.688 -1.597 . . . . 7.81 106.688 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.03 90.33 0.19 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.397 0.999 . . . . 6.05 112.43 -173.945 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 29.19 93.97 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 127.429 2.292 . . . . 8.12 114.607 153.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -155.34 -62.78 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.548 0 N-CA-C 107.495 -1.298 . . . . 6.6 107.495 -170.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -65.82 164.89 25.24 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 121.359 1.373 . . . . 3.04 111.049 170.684 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.1 mt -112.13 -178.38 3.4 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 127.046 2.138 . . . . 1.77 109.921 -164.298 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.5 t -70.96 167.08 19.91 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.733 -1.229 . . . . 2.03 110.093 176.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -61.56 -54.38 43.85 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.166 -0.959 . . . . 2.24 111.607 -166.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.7 mt -60.97 -44.24 97.6 Favored 'General case' 0 C--O 1.222 -0.357 0 O-C-N 121.344 -0.847 . . . . 1.44 111.232 177.563 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -50.87 -51.47 51.16 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.207 2.203 . . . . 2.4 112.21 174.846 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -49.84 -58.41 5.45 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.569 0.748 . . . . 4.43 109.157 170.393 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.0 m -56.08 -50.65 70.42 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.973 0.909 . . . . 2.38 111.719 -173.828 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.276 2.7 pp -61.92 -43.61 97.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 109.004 -0.739 . . . . 1.14 109.004 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -61.29 -45.69 93.42 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.305 0.957 . . . . 4.21 110.925 175.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.25 -36.53 68.64 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.614 0.766 . . . . 1.83 111.747 -178.403 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . 0.252 31.2 m -79.46 -40.13 21.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 O-C-N 120.926 -1.109 . . . . 1.06 111.5 172.628 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.8 t -51.2 -48.46 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 120.48 1.491 . . . . 1.06 110.989 175.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.2 t -59.55 -40.9 88.79 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.866 -0.522 . . . . 0.75 110.524 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' THR . . . . . 0.782 HG21 HD21 ' B' ' 9' ' ' LEU . 28.7 m -58.94 -50.08 75.39 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.434 0.694 . . . . 1.08 110.039 176.523 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -52.36 -57.25 10.4 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 123.423 0.689 . . . . 6.61 109.191 175.351 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -56.51 -53.38 58.19 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.635 1.174 . . . . 3.62 110.382 -172.233 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.8 t -63.4 -48.5 77.6 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 120.008 -0.677 . . . . 1.83 110.403 -176.909 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -60.62 -42.39 96.74 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 119.458 1.027 . . . . 3.47 110.773 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.2 -17.71 58.94 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 124.804 1.242 . . . . 1.05 111.965 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.7 ptt180 -71.04 -20.14 62.42 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 117.363 -1.304 . . . . 5.03 111.772 173.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -42.35 -63.0 0.83 Allowed 'General case' 0 C--N 1.346 0.456 0 CA-C-N 119.282 0.947 . . . . 2.73 112.009 -175.381 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -120.7 171.42 8.6 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 126.405 1.882 . . . . 2.39 106.781 -176.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -11.1 119.45 0.01 OUTLIER Glycine 0 CA--C 1.53 0.989 0 C-N-CA 127.546 2.498 . . . . 1.38 114.298 175.022 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.6 ttm180 72.56 105.16 0.07 Allowed 'General case' 0 C--O 1.237 0.421 0 C-N-CA 123.446 0.698 . . . . 4.02 112.731 167.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -75.1 50.17 0.47 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.56 1.144 . . . . 3.73 112.868 177.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -147.73 -57.6 0.24 Allowed 'General case' 0 C--O 1.227 -0.121 0 C-N-CA 125.802 1.641 . . . . 3.72 106.914 174.261 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.0 144.66 28.98 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 124.311 1.044 . . . . 1.66 111.181 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.6 mp -99.87 121.76 41.79 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.087 -1.079 . . . . 2.75 108.087 172.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.6 m -79.54 166.82 21.53 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 107.772 -1.195 . . . . 2.58 107.772 177.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -54.88 -44.66 73.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 O-C-N 120.92 -1.112 . . . . 2.04 112.695 -169.58 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -62.04 -58.18 8.83 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.468 -0.568 . . . . 1.91 109.468 176.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -37.76 -52.04 1.27 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.743 2.017 . . . . 1.88 111.744 172.514 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -58.27 -55.59 32.97 Favored 'General case' 0 N--CA 1.442 -0.834 0 C-N-CA 124.764 1.225 . . . . 2.84 109.15 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.6 tttt -59.85 -42.51 93.81 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 119.28 -0.968 . . . . 3.31 112.307 178.701 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 73.2 mt-10 -52.23 -42.46 63.62 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-N 119.172 0.897 . . . . 2.2 110.621 174.711 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.4 tt -66.13 -47.18 74.96 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 107.758 -1.201 . . . . 3.01 107.758 -173.664 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -64.32 -51.85 63.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 118.581 -1.248 . . . . 1.22 109.393 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 95.1 m -48.13 -53.99 14.79 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.446 1.098 . . . . 1.36 111.999 178.239 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -80.23 -54.83 5.38 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.337 1.055 . . . . 2.43 110.641 -172.617 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -83.31 -39.63 20.53 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.634 1.174 . . . . 6.0 110.457 -167.486 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -115.48 68.94 2.82 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-N 119.266 0.939 . . . . 2.46 111.288 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -64.78 -37.53 35.09 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.36 2.04 . . . . 2.46 112.302 -178.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -123.84 -34.08 3.06 Favored 'General case' 0 C--N 1.342 0.257 0 N-CA-C 113.307 0.854 . . . . 6.48 113.307 -174.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.702 HD13 ' CD1' ' B' ' 6' ' ' LEU . 30.2 tp -54.9 -59.85 4.17 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-N 118.471 0.578 . . . . 2.23 110.182 -175.812 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.0 mt -74.92 124.3 26.66 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 105.21 -2.145 . . . . 2.91 105.21 152.741 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.2 -7.37 21.26 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 125.455 1.502 . . . . 7.86 110.039 -176.024 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -110.22 87.89 2.63 Favored 'General case' 0 N--CA 1.435 -1.188 0 N-CA-C 104.844 -2.28 . . . . 4.46 104.844 169.726 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.5 m -98.26 22.63 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 114.59 -1.187 . . . . 2.44 108.865 161.811 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -93.2 -76.02 1.32 Allowed Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 107.319 -2.312 . . . . 2.28 107.319 176.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.7 m -79.22 61.52 3.35 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 126.147 1.779 . . . . 2.35 110.085 -171.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.07 -29.56 64.25 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 125.768 1.627 . . . . 1.48 109.327 178.152 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -53.72 -63.49 1.13 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.869 1.667 . . . . 4.67 112.726 174.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -58.13 -33.66 69.4 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 120.489 -1.382 . . . . 3.03 111.046 177.786 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 -56.76 17.11 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.584 -0.895 . . . . 2.58 108.584 172.276 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -46.99 -50.53 18.97 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 123.877 0.871 . . . . 2.15 110.01 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -60.19 -38.39 83.12 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 117.981 0.355 . . . . 3.85 111.183 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.7 m -68.67 -47.81 65.57 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.642 0.377 . . . . 1.73 111.95 178.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.3 mp -73.94 -48.89 27.45 Favored 'General case' 0 C--O 1.232 0.137 0 O-C-N 121.815 -0.553 . . . . 1.91 111.122 -176.1 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -75.7 78.44 2.66 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.48 0.712 . . . . 2.42 109.961 -169.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 17.5 m -47.63 -37.4 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 124.152 0.981 . . . . 2.35 113.412 -170.461 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -96.06 -8.51 33.29 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.059 0.763 . . . . 2.78 113.059 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 54.39 55.03 8.58 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 125.969 1.708 . . . . 3.04 111.329 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.3 p30 -87.43 -42.83 12.53 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.57 0.748 . . . . 2.09 110.22 174.999 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.5 m 101.9 13.96 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 130.088 3.355 . . . . 1.66 112.727 -171.043 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -112.93 111.35 22.04 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 105.514 -2.032 . . . . 3.25 105.514 162.154 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -79.93 89.93 5.32 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 103.421 -2.807 . . . . 1.08 103.421 175.286 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.3 ttpt -71.26 160.27 33.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.441 1.097 . . . . 3.37 108.349 -178.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -40.09 -60.71 0.99 Allowed 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.561 1.144 . . . . 5.03 112.975 -168.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -69.66 -20.02 63.59 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.195 0.813 . . . . 1.91 113.195 -177.97 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -76.7 -61.35 2.0 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-N 119.866 1.212 . . . . 1.83 108.288 172.796 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -45.33 -39.75 7.04 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 125.586 1.554 . . . . 2.89 110.792 176.685 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.489 ' HE1' ' HA3' ' B' ' 81' ' ' GLY . 11.6 t90 -39.07 -43.59 1.04 Allowed 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 125.243 1.417 . . . . 4.71 114.686 174.296 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.53 -38.92 32.58 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 109.793 -0.447 . . . . 6.58 109.793 178.251 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 tp -57.06 -42.39 80.51 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.862 -0.59 . . . . 1.08 111.278 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 14.9 mm -70.76 -41.07 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 107.195 -1.409 . . . . 1.75 107.195 -177.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.521 ' HA2' ' CD2' ' B' ' 77' ' ' TRP . . . -60.97 -38.35 95.34 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-N 115.24 -0.891 . . . . 1.24 111.687 178.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -81.02 -49.36 11.02 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-O 117.789 -1.1 . . . . 3.59 111.331 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.464 HD12 HG21 ' B' ' 13' ' ' ILE 0.258 4.0 pp -55.34 -34.0 63.84 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 120.885 1.675 . . . . 2.44 110.881 174.735 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.42 -40.34 78.13 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.219 -0.925 . . . . 2.04 112.52 168.389 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.3 -48.42 75.74 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 125.068 1.347 . . . . 2.89 111.484 173.793 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -62.38 -28.11 69.54 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.679 1.592 . . . . 2.84 111.936 -158.778 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.0 tt -50.73 -38.05 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 123.497 0.719 . . . . 1.89 111.279 169.073 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . 2.306 0.0 OUTLIER -86.73 -55.13 4.0 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 129.342 3.057 . . . . 5.11 110.472 176.324 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 13.1 tttm -76.03 62.69 1.68 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.465 2.306 . . . . 4.92 112.471 -168.839 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.573 ' HE3' ' HB3' ' B' ' 1' ' ' MET . 1.2 ttpp -80.31 -18.34 49.47 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.245 -0.909 . . . . 8.91 110.364 151.493 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 91' ' ' LYS . . . . . 0.568 ' HD3' ' HB2' ' B' ' 1' ' ' MET . 16.7 pttt -125.22 -41.2 2.08 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.941 1.296 . . . . 12.09 113.263 -158.743 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 54.36 -76.95 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 108.071 -1.085 . . . . 7.37 108.071 -144.334 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -162.33 29.49 0.11 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.123 1.769 . . . . 10.95 110.879 169.628 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -154.75 170.75 20.87 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.229 -0.919 . . . . 12.98 112.722 -164.261 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 0.33 0.3 OUTLIER 52.91 71.35 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 127.847 2.459 . . . . 10.76 114.41 167.06 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 34.1 mmm-85 69.39 134.74 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.566 1.947 . . . . 14.21 112.876 162.727 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . 2.495 0.0 OUTLIER 151.83 51.06 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.43 1 C-N-CA 132.878 4.471 . . . . 13.09 104.722 -1.663 . . . . . . . . 4 3 . 1 . 009 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp . . . . . 0 C--O 1.249 1.07 1 C-N-CA 131.711 4.004 . . . . 14.43 102.372 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.573 ' HB3' ' HE3' ' A' ' 90' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.998 0 CA-C-O 118.929 -0.558 . . . . 8.15 110.612 . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 160.27 -171.87 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 127.779 2.432 . . . . 4.08 107.493 -177.928 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 104.86 97.05 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 117.268 2.322 . . . . 4.21 117.268 128.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.448 ' HB3' ' CD ' ' B' ' 5' ' ' PRO 0.512 15.3 tt0 120.99 -114.82 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.042 0 CA-C-O 115.322 -2.275 . . . . 6.58 115.071 105.902 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 5' ' ' PRO . . . . . 0.448 ' CD ' ' HB3' ' B' ' 4' ' ' GLU . 65.5 Cg_endo -86.07 124.96 2.59 Favored 'Trans proline' 0 C--N 1.353 0.806 0 CA-C-N 124.562 2.665 . . . . 2.37 112.588 -167.817 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.702 ' CD1' HD13 ' A' ' 49' ' ' LEU . 0.1 OUTLIER -132.24 -92.19 0.39 Allowed 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 115.718 1.747 . . . . 3.54 115.718 -166.57 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.471 ' H ' ' HG2' ' B' ' 10' ' ' GLU . 9.2 t -130.04 -140.97 0.23 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 127.84 2.456 . . . . 2.13 111.409 -171.724 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -87.46 -63.58 1.28 Allowed 'General case' 0 C--N 1.34 0.157 0 C-N-CA 125.448 1.499 . . . . 3.12 107.948 177.206 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 9' ' ' LEU . . . . . 0.782 HD21 HG21 ' A' ' 19' ' ' THR . 0.6 OUTLIER -50.23 -34.13 21.93 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.628 0.771 . . . . 3.28 111.354 -179.395 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.471 ' HG2' ' H ' ' B' ' 7' ' ' THR . 0.0 OUTLIER -46.72 -46.83 20.52 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 122.89 0.476 . . . . 6.53 110.933 175.202 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.402 ' N ' ' HG3' ' B' ' 10' ' ' GLU . 19.8 mt-10 -65.04 -44.15 90.04 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 108.149 -1.056 . . . . 5.02 108.149 -171.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 24.6 p -75.09 -27.09 59.75 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.157 -0.929 . . . . 1.29 111.682 -173.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.464 HG21 HD12 ' A' ' 83' ' ' LEU 0.268 2.0 pp -74.89 -40.66 46.15 Favored 'Isoleucine or valine' 0 C--N 1.34 0.19 0 CA-C-N 119.47 1.032 . . . . 1.5 111.215 166.197 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -53.2 -56.84 13.27 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 119.305 0.957 . . . . 4.01 109.093 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.1 t -52.2 -42.35 63.44 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.048 0.451 . . . . 1.8 111.668 -173.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 19.8 m -79.3 -29.58 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 120.942 -1.099 . . . . 1.21 111.804 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 25.3 t -63.42 -41.65 93.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 119.041 0.837 . . . . 1.63 109.551 172.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . 0.255 9.8 t -67.2 -42.98 83.24 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.091 -0.957 . . . . 1.81 110.482 174.15 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 4.2 m -51.56 -56.63 12.43 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.855 1.661 . . . . 1.25 110.382 171.451 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -40.47 -62.0 0.84 Allowed 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 125.097 1.359 . . . . 4.51 110.189 172.742 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -64.81 -48.42 74.45 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.772 0.32 . . . . 2.43 111.596 -171.001 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 54.8 p -60.29 -35.54 75.79 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.07 0.548 . . . . 2.32 111.754 -178.571 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 -69.66 -54.66 12.82 Favored 'General case' 0 N--CA 1.458 -0.07 0 CA-C-O 121.325 0.583 . . . . 2.86 110.403 168.925 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.62 -18.48 64.96 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 126.199 1.8 . . . . 1.11 112.072 -166.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -52.55 -27.25 15.87 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 118.816 -0.611 . . . . 4.05 111.804 169.991 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.02 -68.9 0.17 Allowed 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 117.677 2.473 . . . . 2.28 117.677 -151.154 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -89.18 -76.85 0.4 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.209 0.913 . . . . 2.74 111.922 -161.013 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.16 167.43 29.11 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 127.722 2.582 . . . . 1.77 110.472 150.415 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' ARG . . . . . 0.407 ' NH1' ' OE2' ' B' ' 70' ' ' GLU . 36.8 ttm180 53.63 101.13 0.01 OUTLIER 'General case' 0 C--O 1.238 0.458 0 C-N-CA 124.336 1.054 . . . . 3.6 113.81 136.975 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 14.7 pttm -60.5 -39.01 86.18 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 113.479 0.918 . . . . 3.89 113.479 -175.06 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -77.88 -19.25 55.11 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.343 0.868 . . . . 4.6 113.343 -168.755 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 96.8 p -130.32 160.52 33.69 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-N 119.544 1.065 . . . . 1.7 111.639 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.507 HD13 ' CD1' ' B' ' 76' ' ' TYR . 5.2 mp -113.22 161.84 16.71 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.281 1.032 . . . . 2.2 111.717 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 15.2 m -140.97 170.45 15.72 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 127.095 2.158 . . . . 2.46 105.852 -178.519 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 33.0 m -88.91 54.07 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 O-C-N 121.279 -0.888 . . . . 2.87 112.024 -170.346 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -152.12 54.29 0.81 Allowed 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 105.934 -1.876 . . . . 2.13 105.934 141.818 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -160.56 -58.52 0.06 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 127.952 2.501 . . . . 1.73 104.722 -174.764 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -56.36 -60.01 4.13 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.741 -1.118 . . . . 2.12 110.309 177.599 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 41.3 tttm -58.66 -35.03 71.92 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.303 0.573 . . . . 3.75 109.565 -175.675 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . 0.288 16.3 mm-40 -63.01 -18.7 63.6 Favored 'General case' 0 N--CA 1.44 -0.954 0 N-CA-C 112.824 0.676 . . . . 5.27 112.824 -174.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 24.7 tp -62.24 -50.78 70.39 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.573 -0.899 . . . . 1.84 108.573 169.601 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 16.6 m -70.72 -42.73 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 109.816 -0.438 . . . . 0.9 109.816 -174.579 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 24.1 m -51.96 -55.22 21.69 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 122.688 0.395 . . . . 1.01 110.275 173.076 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -82.33 -58.72 2.81 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.835 1.05 . . . . 2.37 113.835 -168.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -79.57 -48.53 13.66 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.51 1.3 . . . . 3.89 114.51 -164.332 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 46' ' ' LEU . . . . . 0.434 HD11 HD11 ' B' ' 83' ' ' LEU . 1.5 mm? -52.43 -38.78 59.93 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 115.69 1.737 . . . . 2.14 115.69 -148.725 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -63.94 -39.3 33.43 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.569 -1.846 . . . . 2.31 109.619 -58.888 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -89.09 -30.6 18.54 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.139 1.375 . . . . 3.56 112.365 -168.057 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 19.3 tp -47.57 -63.28 1.1 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.491 1.516 . . . . 1.17 111.405 -175.761 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' B' ' 50' ' ' LEU . 33.0 mt -93.09 72.42 4.65 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.372 -0.973 . . . . 1.66 108.372 163.13 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.9 147.29 0.22 Allowed 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.81 1.244 . . . . 5.53 110.305 174.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 32.0 t0 61.9 41.08 11.86 Favored 'General case' 0 C--N 1.343 0.286 0 N-CA-C 106.856 -1.535 . . . . 4.17 106.856 173.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 5.9 m 32.25 50.54 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 C-N-CA 127.748 2.419 . . . . 3.79 112.924 -172.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 65.07 19.16 65.61 Favored Glycine 0 CA--C 1.525 0.698 0 CA-C-O 118.718 -1.046 . . . . 7.37 114.174 174.094 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 5.6 p 42.22 61.24 2.04 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 118.288 1.044 . . . . 5.03 108.658 -168.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -45.51 -46.75 14.08 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 126.416 1.886 . . . . 2.04 112.648 -148.72 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -40.37 -47.72 2.59 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.598 1.959 . . . . 3.25 112.812 174.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -54.22 -60.47 3.29 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 109.332 -0.618 . . . . 4.63 109.332 176.39 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -44.69 95.84 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 118.458 -0.782 . . . . 5.18 109.242 -175.836 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 9.2 mtp -47.54 -60.89 2.22 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.586 1.085 . . . . 3.79 110.508 175.602 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -63.31 -36.8 84.89 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.382 -0.372 . . . . 3.91 110.546 -175.392 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 14.7 t -62.92 -41.28 99.4 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.015 0.526 . . . . 2.69 111.204 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 29.9 mt -77.19 -51.25 11.29 Favored 'General case' 0 CA--C 1.527 0.079 0 C-N-CA 125.317 1.447 . . . . 1.21 110.394 -172.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -53.39 -14.9 0.85 Allowed 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 116.615 2.08 . . . . 2.18 116.615 -165.834 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 17.8 m -36.43 -32.35 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 129.71 3.204 . . . . 1.93 117.468 -139.983 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -65.55 -12.61 54.49 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.352 0.978 . . . . 2.82 112.393 175.849 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 61.51 41.99 11.89 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 124.363 1.065 . . . . 3.18 113.012 167.336 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 48.9 p30 -91.92 -7.93 47.76 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.456 1.502 . . . . 2.18 111.48 163.103 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.0 m 65.31 10.14 6.24 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.985 1.314 . . . . 2.64 113.78 -172.072 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 70' ' ' GLU . . . . . 0.407 ' OE2' ' NH1' ' B' ' 29' ' ' ARG . 35.5 mt-10 -99.44 154.12 18.46 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 108.447 -0.945 . . . . 2.9 108.447 167.001 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -111.81 93.51 4.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 106.215 -1.772 . . . . 1.11 106.215 168.971 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.69 178.98 7.72 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.412 0.685 . . . . 3.84 110.705 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 40.6 p90 -91.61 52.28 2.02 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.885 0.698 . . . . 4.48 112.885 -171.681 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -155.52 49.84 0.55 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 107.002 -1.481 . . . . 2.79 107.002 114.01 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -90.99 -60.88 1.8 Allowed 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 106.066 -1.828 . . . . 1.9 106.066 140.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.507 ' CD1' HD13 ' B' ' 33' ' ' LEU . 65.3 t80 -52.8 -49.74 65.01 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 124.103 0.961 . . . . 4.02 113.259 -168.323 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.521 ' CD2' ' HA2' ' A' ' 81' ' ' GLY . 0.3 OUTLIER -43.9 -34.32 1.61 Allowed 'General case' 0 C--N 1.341 0.233 0 O-C-N 123.786 0.679 . . . . 5.33 111.206 177.34 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' B' B ' 78' ' ' ARG . . . . . 0.425 ' HA ' ' CH2' ' A' ' 77' ' ' TRP . 45.3 mtp180 -51.84 -52.95 45.69 Favored 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 120.098 -0.641 . . . . 4.97 110.933 -175.835 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.632 ' O ' HD13 ' B' ' 83' ' ' LEU . 3.2 tp -57.56 -28.04 63.2 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 118.251 -1.38 . . . . 1.38 110.811 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 45.1 mt -71.84 -47.89 53.82 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.346 0 N-CA-C 107.041 -1.466 . . . . 2.34 107.041 -168.274 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.489 ' HA3' ' HE1' ' A' ' 77' ' ' TRP . . . -80.95 -27.99 47.74 Favored Glycine 0 N--CA 1.42 -2.37 0 CA-C-O 117.863 -1.521 . . . . 2.71 111.227 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -57.28 -47.45 81.42 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 105.264 -2.124 . . . . 3.39 105.264 -173.092 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.632 HD13 ' O ' ' B' ' 79' ' ' LEU . 7.8 mp -38.54 -47.94 1.36 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.904 1.282 . . . . 2.61 113.173 174.283 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.74 -29.8 70.96 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.87 0.868 . . . . 1.35 111.573 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -80.28 -45.9 17.11 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 123.876 0.87 . . . . 1.47 111.24 167.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.39 -50.39 73.15 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.831 1.196 . . . . 3.57 108.193 -171.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 14.3 tt -50.49 -39.22 17.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 123.454 0.701 . . . . 1.45 111.651 174.506 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.66 -19.11 42.37 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.537 1.535 . . . . 3.71 112.598 -176.27 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 42.3 tttp -137.14 92.02 2.68 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.984 0.914 . . . . 5.38 111.888 -161.626 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 5.2 tmtp? -39.62 -59.45 1.13 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.589 1.956 . . . . 4.52 115.38 -169.085 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 2.4 pptp? -148.91 16.47 0.97 Allowed 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 113.556 0.947 . . . . 8.39 113.556 -165.809 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -125.36 118.22 25.43 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.654 -0.869 . . . . 4.67 108.654 -165.737 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 1.3 pp 176.41 -40.85 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 126.041 1.736 . . . . 5.22 109.321 -173.299 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 10.5 pttm -71.04 68.19 0.44 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.883 1.273 . . . . 7.19 112.043 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 4.9 tp -128.47 116.2 40.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 C-N-CA 124.666 1.186 . . . . 7.22 108.258 172.729 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 30.2 tpt180 -161.29 148.43 14.9 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 107.875 -1.157 . . . . 12.16 107.875 177.559 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 5.0 tmtp? -177.97 138.38 0.2 Allowed 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.08 1.752 . . . . 9.77 106.428 177.375 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 46.9 tptt . . . . . 0 C--O 1.257 1.461 0 N-CA-C 103.756 -2.683 . . . . 6.0 103.756 168.185 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.7 mmm . . . . . 0 N--CA 1.469 0.52 0 N-CA-C 108.324 -0.991 . . . . 7.81 108.324 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 177.87 172.68 0.61 Allowed 'General case' 0 C--O 1.231 0.118 0 C-N-CA 126.527 1.931 . . . . 2.95 106.665 -173.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 70.99 95.23 0.07 Allowed 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 126.349 1.86 . . . . 3.1 111.863 178.23 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -71.49 121.57 84.73 Favored Pre-proline 0 N--CA 1.442 -0.854 0 N-CA-C 108.61 -0.885 . . . . 5.95 108.61 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -70.14 141.15 42.97 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 121.951 1.767 . . . . 2.33 108.133 173.568 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 86.7 mt -99.1 163.73 12.45 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 108.325 -0.991 . . . . 1.33 108.325 -175.062 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.3 t -73.8 153.01 40.14 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 120.739 -1.225 . . . . 1.96 109.898 -175.631 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -45.07 -51.63 9.91 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 121.232 -0.918 . . . . 2.46 112.855 -174.279 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -58.9 -52.08 67.28 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 118.311 -0.852 . . . . 1.54 111.255 178.391 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -48.87 -55.05 12.82 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.083 2.153 . . . . 2.56 111.767 173.554 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -52.52 -52.31 55.29 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.164 0.985 . . . . 3.06 109.932 174.987 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.9 t -57.74 -50.6 72.68 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.385 0.674 . . . . 2.39 111.08 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.279 2.8 pp -62.61 -37.68 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 O-C-N 121.247 -0.908 . . . . 0.66 110.431 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -57.26 -59.4 5.16 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 119.344 0.974 . . . . 2.72 109.965 174.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.6 t -53.92 -40.78 67.02 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 118.986 0.812 . . . . 1.81 111.552 -172.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.1 m -76.34 -30.66 19.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 120.525 -1.359 . . . . 0.78 112.108 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.3 t -64.37 -44.69 97.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 119.679 1.127 . . . . 0.6 110.065 173.224 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.4 t -65.42 -42.25 92.7 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.46 -0.775 . . . . 0.9 110.242 175.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 50.5 m -55.5 -50.62 69.46 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.906 0.775 . . . . 0.97 110.147 173.678 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -48.25 -60.04 2.96 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 123.405 0.682 . . . . 3.26 110.089 172.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -52.93 -51.56 60.91 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.226 1.01 . . . . 3.43 111.571 -173.759 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.1 t -63.78 -25.15 68.05 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 118.493 -0.765 . . . . 2.2 112.17 -176.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -81.54 -42.84 19.59 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 118.951 0.796 . . . . 2.63 111.456 169.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -52.43 -40.25 61.98 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 120.872 -1.142 . . . . 1.1 110.671 -179.09 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -19.21 61.04 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 116.065 -1.921 . . . . 4.98 113.342 -178.804 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -45.0 -61.81 1.48 Allowed 'General case' 0 C--N 1.345 0.395 0 CA-C-N 120.758 1.617 . . . . 2.55 110.133 -168.505 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -128.77 96.74 4.46 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 126.348 1.859 . . . . 5.58 107.613 -177.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.38 149.83 0.11 Allowed Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.425 1.488 . . . . 1.35 114.334 167.325 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 51.92 82.43 0.07 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.134 0.974 . . . . 5.89 110.806 175.203 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -71.27 31.31 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.731 1.382 . . . . 3.62 114.731 -175.368 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -139.57 22.06 2.52 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.604 1.562 . . . . 4.51 108.657 167.828 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.8 m -154.82 140.48 17.99 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.925 -1.109 . . . . 2.71 113.165 -179.017 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.1 mp -103.94 117.36 34.13 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.14 1.376 . . . . 2.58 112.705 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.2 t -83.69 177.04 8.55 Favored 'General case' 0 C--O 1.227 -0.131 0 O-C-N 120.84 -1.162 . . . . 2.72 109.784 171.432 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.5 m -55.43 -50.18 67.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 112.903 0.705 . . . . 2.78 112.903 -163.695 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -62.37 -57.4 11.45 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 118.604 0.638 . . . . 2.53 109.781 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -38.1 -50.87 1.4 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.306 1.442 . . . . 2.15 110.787 173.864 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.405 ' CD2' ' HG ' ' A' ' 71' ' ' LEU . 0.8 OUTLIER -58.64 -53.6 56.5 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 114.728 -1.124 . . . . 3.72 110.226 177.892 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -60.71 -37.21 80.91 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 120.618 -0.433 . . . . 3.24 110.06 -174.2 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -53.81 -37.45 63.56 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 119.076 -0.488 . . . . 3.63 110.937 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.8 tp -68.63 -45.72 71.11 Favored 'General case' 0 C--N 1.339 0.115 0 CA-C-N 119.881 1.219 . . . . 2.38 109.27 -177.948 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 10.2 m -69.42 -38.46 77.18 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.178 0 CA-C-O 121.457 0.646 . . . . 1.22 109.359 -173.668 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 74.8 m -69.42 -43.39 73.48 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 124.276 1.031 . . . . 1.35 110.224 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -80.14 -60.47 2.32 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.095 0.558 . . . . 2.07 111.783 -173.46 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.507 ' O ' HG21 ' B' ' 7' ' ' THR . 3.1 mm-40 -79.45 -37.75 36.24 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 118.407 -0.806 . . . . 3.91 113.011 -167.539 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.84 83.51 0.55 Allowed Pre-proline 0 N--CA 1.469 0.478 0 C-N-CA 125.127 1.371 . . . . 2.29 111.732 -165.119 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -64.81 -32.14 56.46 Favored 'Trans proline' 0 N--CA 1.449 -1.115 0 C-N-CA 122.659 2.239 . . . . 1.62 111.898 178.329 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.37 -3.36 0.42 Allowed 'General case' 0 C--N 1.347 0.487 0 N-CA-C 118.332 2.716 . . . . 4.99 118.332 -174.332 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.653 HD23 ' HB2' ' A' ' 83' ' ' LEU . 10.5 tp -58.89 -64.44 0.94 Allowed 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 120.536 1.516 . . . . 1.21 110.487 174.431 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 45.6 mt -78.67 -42.12 29.45 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 115.952 -0.567 . . . . 3.1 110.97 -175.613 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 28.5 40.66 0.0 OUTLIER 'General case' 0 C--N 1.343 0.305 0 C-N-CA 129.281 3.032 . . . . 4.41 114.603 -170.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -136.06 24.76 3.3 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.405 2.282 . . . . 5.05 109.236 -176.621 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.1 m -58.02 -28.94 35.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 124.405 1.082 . . . . 2.07 110.82 -178.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.16 -41.97 16.15 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 124.047 0.832 . . . . 1.98 111.877 172.61 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 87.3 p -104.43 34.23 3.19 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-N 117.979 0.889 . . . . 3.33 111.166 -177.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -54.47 -35.02 62.59 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 121.001 -1.062 . . . . 1.3 110.567 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -56.07 -40.35 73.44 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.395 -0.816 . . . . 4.16 111.954 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -69.2 -49.83 52.93 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 108.019 -1.104 . . . . 3.24 108.019 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.92 -42.78 65.7 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 109.328 -0.619 . . . . 2.66 109.328 177.111 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.5 tmm? -61.7 -52.53 63.9 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 124.686 1.194 . . . . 2.0 110.093 178.374 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -53.97 -38.93 65.52 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 118.744 -0.646 . . . . 2.99 111.906 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.1 t -60.79 -61.54 2.51 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-N 118.908 0.776 . . . . 2.61 109.198 168.75 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 28.5 mt -53.27 -61.31 2.38 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 125.29 1.436 . . . . 1.4 112.36 -166.769 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -72.13 88.77 1.12 Allowed 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.028 -0.73 . . . . 2.09 109.028 -171.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.9 m -49.07 -28.07 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 C-N-CA 124.299 1.04 . . . . 2.34 113.71 -175.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -104.56 -11.66 16.86 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.031 1.332 . . . . 2.58 112.845 178.407 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 52.69 50.4 18.22 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.473 1.109 . . . . 4.14 111.361 177.848 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.0 p30 -82.33 -20.62 37.0 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 109.077 -0.712 . . . . 1.65 109.077 166.739 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 78.95 26.57 0.45 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.244 1.418 . . . . 2.09 111.449 176.671 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -135.13 120.73 19.37 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 104.313 -2.477 . . . . 5.39 104.313 162.023 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.405 ' HG ' ' CD2' ' A' ' 38' ' ' PHE . 0.8 OUTLIER -93.31 90.99 7.01 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.057 -1.46 . . . . 1.19 107.057 -168.037 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.0 pttt -76.22 169.59 17.93 Favored 'General case' 0 CA--C 1.528 0.113 0 O-C-N 123.147 0.279 . . . . 4.1 110.726 -178.024 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.2 p90 -36.66 -61.63 0.52 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.441 1.275 . . . . 6.26 114.441 -163.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.98 -26.56 54.05 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.539 1.063 . . . . 2.23 111.212 -175.148 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -64.98 -56.75 11.36 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 108.374 -0.973 . . . . 2.08 108.374 174.835 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -48.9 -54.93 13.34 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.871 1.268 . . . . 3.15 109.775 173.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 59.2 t90 -46.85 -41.89 16.44 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.955 0.902 . . . . 4.23 111.956 -168.799 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 23.6 ttp85 -45.06 -40.67 6.91 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 118.305 -0.855 . . . . 3.68 111.357 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 6.6 tp -45.09 -50.35 11.1 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 118.154 -0.927 . . . . 0.95 111.87 177.052 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 92.1 mt -58.81 -32.03 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 108.316 -0.994 . . . . 1.64 108.316 -176.727 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.616 ' HA3' ' CE2' ' B' ' 77' ' ' TRP . . . -70.0 -50.14 30.63 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 127.072 2.273 . . . . 1.24 112.103 177.415 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.444 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 3.0 mt-10 -58.2 -62.9 1.49 Allowed 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 106.775 -1.565 . . . . 2.9 106.775 177.129 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.653 ' HB2' HD23 ' A' ' 49' ' ' LEU 0.262 4.3 pp -53.34 -37.42 62.31 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.301 0.955 . . . . 2.11 112.305 177.23 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.52 -62.11 1.9 Allowed 'General case' 0 C--N 1.342 0.245 0 CA-C-N 119.179 0.9 . . . . 2.19 111.073 173.855 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . 0.275 0.0 OUTLIER -70.2 -20.09 63.13 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 119.095 -1.042 . . . . 1.98 112.042 -174.75 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 5.3 mm-40 -56.31 -31.35 63.6 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 118.144 -0.931 . . . . 2.62 110.676 173.379 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.5 tt -58.81 -12.49 2.64 Favored 'Isoleucine or valine' 0 C--N 1.348 0.501 0 N-CA-C 113.417 0.895 . . . . 1.56 113.417 173.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 5.5 ptm85 -118.75 -38.43 3.11 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 118.918 0.781 . . . . 4.22 112.079 172.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.25 -47.5 10.73 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 116.565 2.061 . . . . 3.31 116.565 -177.028 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 24.3 tttm -65.33 -58.23 6.42 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 120.263 1.392 . . . . 10.43 111.367 -149.611 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.2 ttpm? -152.2 4.02 0.38 Allowed 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.215 1.006 . . . . 8.6 110.524 167.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -7.47 -107.09 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.68 1.592 . . . . 10.08 113.322 -139.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.5 tp -76.68 -65.02 0.99 Allowed 'General case' 0 N--CA 1.44 -0.973 0 C-N-CA 125.95 1.7 . . . . 15.38 106.783 176.531 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -132.38 111.38 11.27 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.975 1.31 . . . . 15.81 108.419 -177.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 0.332 42.5 pt 59.08 -63.96 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 C-N-CA 128.207 2.603 . . . . 9.1 115.965 175.2 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 170.26 96.11 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 105.377 -2.083 . . . . 14.77 105.377 -164.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -174.43 58.5 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 120.165 1.348 . . . . 10.84 114.301 -155.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . 2.426 0.2 OUTLIER . . . . . 0 C--O 1.253 1.25 0 CA-C-O 116.138 -1.887 . . . . 12.72 108.932 165.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.427 1.4 pmm? . . . . . 0 N--CA 1.466 0.339 0 N-CA-C 107.898 -1.149 . . . . 8.13 107.898 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -167.23 117.16 0.85 Allowed 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 118.428 -0.796 . . . . 5.99 109.836 173.131 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 23.14 99.11 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.602 1.334 . . . . 4.76 114.602 118.35 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -75.08 162.04 74.91 Favored Pre-proline 0 CA--C 1.548 0.876 0 CA-C-N 119.098 0.863 . . . . 5.6 109.831 171.027 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -78.56 155.51 27.91 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.819 3.013 . . . . 3.2 111.239 177.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 66.1 mt -155.77 -163.05 1.42 Allowed 'General case' 0 CA--C 1.555 1.141 0 N-CA-C 112.675 0.62 . . . . 3.53 112.675 -151.651 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.688 HG22 ' CG ' ' B' ' 10' ' ' GLU . 2.2 t -66.51 178.04 1.37 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.451 1.501 . . . . 2.05 111.224 178.226 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -59.26 -61.54 2.55 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.436 -0.79 . . . . 2.69 112.387 -175.174 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 14.4 mt -53.63 -43.61 68.84 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.162 -0.961 . . . . 1.28 111.68 175.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.688 ' CG ' HG22 ' B' ' 7' ' ' THR . 69.5 mt-10 -53.73 -48.19 69.87 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 124.761 1.225 . . . . 3.54 111.785 175.45 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -59.15 -46.99 86.93 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 120.609 -1.307 . . . . 4.52 109.772 173.669 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 16.1 m -57.44 -43.78 84.17 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.479 0.712 . . . . 1.67 110.977 -175.433 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.256 2.3 pp -67.05 -41.32 87.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.149 0 CA-C-O 118.479 -0.772 . . . . 1.05 111.385 172.042 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -53.49 -56.75 14.37 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.258 0.935 . . . . 2.4 110.661 178.383 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.9 t -49.33 -45.8 45.97 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 118.996 0.816 . . . . 1.3 111.968 -174.373 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 20.3 m -72.62 -38.18 58.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 O-C-N 120.808 -1.182 . . . . 0.92 111.395 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 43.8 t -58.04 -41.28 80.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 O-C-N 121.823 -0.548 . . . . 1.06 110.218 174.179 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . 0.257 11.9 t -70.64 -41.23 72.43 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 118.205 -0.902 . . . . 1.19 111.257 176.456 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 4.0 m -51.21 -52.43 44.58 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-N 120.649 1.568 . . . . 1.09 109.991 171.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 20' ' ' PHE . . . . . 0.461 ' CZ ' HD23 ' B' ' 33' ' ' LEU . 25.2 t80 -51.9 -61.07 2.49 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.362 0.665 . . . . 4.23 110.09 174.818 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -61.74 -40.92 96.79 Favored 'General case' 0 C--N 1.334 -0.107 0 C-N-CA 123.463 0.705 . . . . 3.31 111.517 -168.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 41.1 p -60.96 -60.09 4.35 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.474 -0.565 . . . . 2.25 109.474 173.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -57.99 -35.12 70.76 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.417 0.553 . . . . 3.66 111.346 -174.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.04 -29.31 43.38 Favored 'General case' 0 CA--C 1.513 -0.448 0 C-N-CA 127.182 2.193 . . . . 1.06 110.929 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -47.06 -34.31 5.71 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 124.241 0.963 . . . . 4.53 111.873 175.527 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.84 -66.55 0.48 Allowed 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 115.963 1.838 . . . . 1.71 115.963 -146.845 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -91.2 -75.89 0.46 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 119.24 -0.984 . . . . 3.03 113.089 -167.637 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.44 156.19 23.18 Favored Glycine 0 C--N 1.338 0.667 0 C-N-CA 127.394 2.426 . . . . 2.39 109.666 160.019 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 47.4 102.37 0.0 OUTLIER 'General case' 0 C--O 1.242 0.684 0 N-CA-C 114.775 1.398 . . . . 4.61 114.775 144.316 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -71.5 47.28 0.12 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.13 1.372 . . . . 4.17 112.867 176.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -157.24 -51.69 0.07 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.674 0.79 . . . . 3.17 109.448 -173.409 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 33.9 p -85.36 146.39 27.03 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 123.126 0.57 . . . . 1.63 110.366 172.461 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.461 HD23 ' CZ ' ' B' ' 20' ' ' PHE . 0.7 OUTLIER -92.5 178.41 5.82 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 108.2 -1.037 . . . . 2.08 108.2 164.013 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 34' ' ' SER . . . . . 0.41 ' C ' ' O ' ' B' ' 35' ' ' VAL . 28.0 m -154.23 -175.98 5.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 122.077 0.941 . . . . 2.9 110.46 -143.553 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.41 ' O ' ' C ' ' B' ' 34' ' ' SER . 21.7 t -73.18 -166.15 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 N-CA-C 100.781 -3.785 . . . . 3.37 100.781 141.275 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.47 51.85 1.93 Allowed 'General case' 0 CA--C 1.552 1.057 0 O-C-N 116.709 -3.744 . . . . 3.71 113.114 -111.038 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -61.58 -59.41 5.25 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 126.796 2.038 . . . . 1.63 108.887 125.479 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.472 ' CE2' HD13 ' B' ' 63' ' ' LEU . 0.4 OUTLIER -54.96 -44.42 74.35 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 119.727 -0.789 . . . . 2.22 111.786 -163.252 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.87 -35.36 68.83 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.477 -0.764 . . . . 2.9 111.806 176.965 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -56.39 -31.98 64.37 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.474 0.579 . . . . 3.1 111.726 177.002 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -64.43 -55.11 23.07 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 119.294 0.952 . . . . 2.66 108.648 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 13.8 m -69.05 -38.47 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 114.486 -1.233 . . . . 0.94 109.256 -170.208 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 85.5 m -63.63 -57.67 9.33 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.328 1.051 . . . . 1.23 110.958 174.09 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -76.01 -60.79 2.17 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 122.136 -0.353 . . . . 2.46 111.025 -165.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.81 -47.37 12.93 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 122.314 -0.241 . . . . 3.06 111.096 -171.596 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 2.1 tp -84.3 -16.44 0.23 Allowed Pre-proline 0 CA--C 1.544 0.738 0 N-CA-C 120.893 3.664 . . . . 2.07 120.893 -151.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -44.4 -50.97 7.45 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 123.51 2.806 . . . . 1.87 116.053 -143.576 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 42.6 t-80 -76.91 48.95 0.62 Allowed 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.777 0.717 . . . . 3.41 112.215 -176.39 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' B' ' 49' ' ' LEU . 13.2 tp -150.99 -61.62 0.18 Allowed 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 124.257 1.023 . . . . 0.96 109.738 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 96.7 mt -109.59 112.37 24.42 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.378 -0.971 . . . . 1.69 108.378 169.334 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.3 -165.06 0.71 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 108.779 -0.823 . . . . 5.03 108.779 170.709 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 64.64 24.84 13.03 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.849 1.26 . . . . 3.97 110.626 169.892 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 33.0 m -61.62 -18.94 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 125.009 1.324 . . . . 1.76 113.03 -168.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.15 -52.85 49.35 Favored Glycine 0 CA--C 1.53 1.016 0 N-CA-C 110.305 -1.118 . . . . 2.77 110.305 168.096 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 22.6 t -81.29 34.66 0.37 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.797 1.239 . . . . 2.39 111.534 -171.026 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -60.03 -25.19 65.12 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.201 1.4 . . . . 1.22 110.246 -174.319 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -52.29 -33.01 40.25 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.113 1.365 . . . . 3.37 113.215 173.04 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -58.25 -44.67 88.44 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 120.044 1.293 . . . . 2.58 109.049 175.17 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -70.73 -49.18 49.73 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 107.419 -1.326 . . . . 4.08 107.419 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 13.9 tpt -39.68 -55.89 1.81 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.687 1.13 . . . . 2.54 110.615 176.032 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -60.92 -52.46 64.95 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.592 -0.276 . . . . 3.32 111.088 178.435 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.2 m -58.62 -30.37 67.21 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.082 0.771 . . . . 1.68 113.082 -178.915 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.472 HD13 ' CE2' ' B' ' 38' ' ' PHE . 60.3 mt -81.67 -55.28 4.75 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 126.183 1.793 . . . . 1.25 109.855 -176.545 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.26 2.9 t70 -68.72 -10.96 59.47 Favored 'General case' 0 C--O 1.218 -0.602 0 N-CA-C 115.083 1.512 . . . . 2.23 115.083 -170.163 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 18.9 m -31.98 -23.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 N-CA-C 120.069 3.359 . . . . 1.71 120.069 -134.888 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -51.43 -34.38 34.67 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 121.106 1.776 . . . . 2.98 110.223 157.455 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 65.48 47.5 2.25 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.993 1.317 . . . . 2.93 109.163 174.132 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 27.2 p30 -76.9 -29.13 55.6 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.188 -0.915 . . . . 1.93 108.815 168.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 4.0 m 96.14 -5.98 0.08 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 128.25 2.62 . . . . 2.36 113.503 178.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -101.68 119.13 38.29 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 107.094 -1.447 . . . . 2.77 107.094 170.389 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.23 112.33 20.65 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.696 -1.224 . . . . 1.27 107.696 178.752 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.43 173.35 11.58 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.932 2.093 . . . . 2.95 110.719 -177.034 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -82.72 52.73 2.18 Favored 'General case' 0 C--N 1.345 0.407 0 O-C-N 121.08 -1.013 . . . . 3.85 111.004 176.675 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -169.58 48.07 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 106.498 -1.667 . . . . 2.54 106.498 125.655 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -97.38 -64.18 1.06 Allowed 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 119.841 -1.787 . . . . 1.98 109.265 152.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.455 ' CD2' ' CZ ' ' B' ' 38' ' ' PHE . 22.6 t80 -49.07 -48.71 43.89 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 125.327 1.451 . . . . 3.45 110.138 -177.039 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 0.7 OUTLIER -53.28 -31.64 44.76 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.494 -1.23 . . . . 4.76 110.886 -169.626 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 78' ' ' ARG . . . . . 0.469 ' HB2' ' CD2' ' B' ' 63' ' ' LEU . 28.4 mmt180 -40.16 -46.71 2.27 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.951 0.9 . . . . 4.49 112.283 170.863 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 2.8 tp -54.45 -37.18 64.87 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 117.908 0.322 . . . . 0.98 110.886 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 84.3 mt -63.85 -32.93 58.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 108.31 -0.996 . . . . 1.36 108.31 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.54 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -72.24 -40.88 54.78 Favored Glycine 0 CA--C 1.491 -1.459 0 C-N-CA 124.523 1.059 . . . . 1.46 110.688 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 82' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' B' ' 86' ' ' GLU . 1.2 mm-40 -64.67 -64.92 0.75 Allowed 'General case' 0 N--CA 1.433 -1.308 0 N-CA-C 106.075 -1.824 . . . . 2.25 106.075 177.085 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 3.8 pp -55.44 -34.58 64.58 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 118.533 0.606 . . . . 1.82 112.341 -173.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.65 -62.13 2.08 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 118.346 0.521 . . . . 1.49 111.042 170.127 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.302 0.0 OUTLIER -63.41 -30.63 71.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 118.219 -0.896 . . . . 1.83 111.428 -173.574 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' B' ' 82' ' ' GLU . 12.1 mm-40 -54.21 -26.14 26.79 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.15 0.98 . . . . 2.86 111.952 177.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 3.5 tt -59.4 -38.28 74.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 119.802 1.183 . . . . 1.24 110.834 172.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -82.35 -41.84 19.49 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.6 1.96 . . . . 3.78 110.583 176.747 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.32 114.61 26.42 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 126.442 1.897 . . . . 5.05 111.011 -165.981 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -63.98 -39.27 93.75 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.735 -0.603 . . . . 5.25 110.61 167.961 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -162.82 -2.62 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.21 1.004 . . . . 6.23 113.434 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -80.56 56.58 2.64 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.894 1.225 . . . . 4.75 111.598 -177.229 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.46 ' CG ' ' H ' ' B' ' 94' ' ' LYS . 0.3 OUTLIER -84.16 -94.11 0.07 Allowed 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 107.805 -1.183 . . . . 5.28 107.805 168.869 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 94' ' ' LYS . . . . . 0.46 ' H ' ' CG ' ' B' ' 93' ' ' LEU . 0.0 OUTLIER 68.47 159.09 0.16 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 127.422 2.289 . . . . 8.21 111.615 176.176 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -145.49 147.38 18.66 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 106.908 -1.515 . . . . 7.89 106.908 173.74 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -167.03 119.54 0.95 Allowed 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 107.386 -1.339 . . . . 6.31 107.386 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -176.62 136.02 0.24 Allowed 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 106.186 -1.783 . . . . 8.72 106.186 -178.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 10.8 tptp . . . . . 0 C--O 1.253 1.239 0 N-CA-C 104.36 -2.459 . . . . 6.28 104.36 166.201 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.8 mtt . . . . . 0 N--CA 1.469 0.478 0 N-CA-C 109.477 -0.564 . . . . 6.24 109.477 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.73 62.35 7.41 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.325 0.65 . . . . 4.35 110.669 -175.106 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 51.59 57.32 6.69 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.258 1.423 . . . . 6.05 113.202 170.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -91.42 -66.3 0.13 Allowed Pre-proline 0 CA--C 1.538 0.502 0 C-N-CA 124.431 1.092 . . . . 7.59 110.969 -173.127 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -71.64 161.98 43.57 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 CA-C-N 121.05 1.411 . . . . 3.91 109.727 170.406 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.5 mt -130.62 -157.9 0.85 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.716 1.606 . . . . 1.92 108.344 -171.351 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 57.3 m -60.55 144.79 50.75 Favored 'General case' 0 C--O 1.224 -0.243 0 O-C-N 120.506 -1.371 . . . . 3.82 109.909 176.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -35.58 -66.86 0.18 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.948 1.299 . . . . 3.7 111.756 170.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.21 -32.69 74.15 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.377 -1.297 . . . . 2.09 113.022 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -52.91 -49.5 65.82 Favored 'General case' 0 C--N 1.347 0.477 0 CA-C-N 120.855 1.661 . . . . 2.25 111.515 168.107 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -49.5 -51.77 34.04 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 108.493 -0.929 . . . . 3.08 108.493 175.22 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.5 m -60.43 -53.14 61.1 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.647 -0.706 . . . . 1.99 111.862 -175.667 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.272 2.7 pp -64.88 -38.49 82.9 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 O-C-N 121.577 -0.702 . . . . 0.8 109.741 -176.513 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -62.47 -50.13 72.65 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.645 -0.66 . . . . 3.03 111.222 175.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 t -58.93 -34.65 71.96 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.073 0.851 . . . . 1.2 111.749 -173.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 23.0 m -77.13 -41.44 30.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 O-C-N 121.171 -0.956 . . . . 0.73 110.878 174.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.9 t -53.91 -47.7 63.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 118.923 0.783 . . . . 0.76 110.81 175.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.9 t -62.67 -43.16 99.51 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.454 -0.779 . . . . 0.88 110.897 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 39.1 m -59.9 -50.2 74.7 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.877 -0.514 . . . . 1.05 109.689 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -47.73 -56.93 6.26 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.461 0.705 . . . . 3.07 110.585 169.35 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -60.3 -45.32 93.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.077 0.551 . . . . 3.29 111.178 -169.757 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.4 t -61.31 -32.36 72.22 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 120.061 -0.656 . . . . 2.53 110.789 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -70.19 -43.95 69.69 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-N 119.432 1.015 . . . . 3.03 110.72 168.395 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.13 -38.59 39.76 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 124.748 1.219 . . . . 1.05 111.797 -171.271 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.8 ptt85 -75.63 -20.45 58.5 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 117.563 -1.208 . . . . 4.57 113.877 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -47.77 -57.9 5.01 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 120.1 1.318 . . . . 2.33 112.898 -166.537 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -120.66 93.57 4.08 Favored 'General case' 0 C--O 1.242 0.704 0 C-N-CA 128.541 2.736 . . . . 3.13 106.08 -171.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 48.59 -174.19 0.03 OUTLIER Glycine 0 CA--C 1.526 0.736 0 C-N-CA 125.699 1.619 . . . . 1.71 112.37 -176.361 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.3 mmt-85 29.74 97.46 0.0 OUTLIER 'General case' 0 C--O 1.24 0.596 0 C-N-CA 126.09 1.756 . . . . 4.75 112.846 164.629 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.53 40.87 0.38 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.598 1.559 . . . . 5.6 109.167 177.749 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -154.81 -51.87 0.09 Allowed 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 106.285 -1.746 . . . . 4.97 106.285 -145.305 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.5 p -115.16 139.3 50.03 Favored 'General case' 0 C--O 1.246 0.889 0 C-N-CA 125.566 1.546 . . . . 2.24 111.097 172.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -101.4 117.64 35.35 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 113.727 -1.579 . . . . 2.5 108.241 -176.846 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 19.0 m -88.35 174.98 7.84 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.074 1.75 . . . . 2.12 110.999 178.776 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.5 m -58.82 -48.82 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 O-C-N 121.395 -0.816 . . . . 2.68 112.979 -172.654 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -68.35 -47.38 67.62 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-O 118.4 -0.81 . . . . 2.95 109.518 -178.262 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -41.81 -46.91 4.04 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.059 0.845 . . . . 2.1 112.02 168.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.401 ' CZ ' HD13 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -56.71 -59.99 4.21 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.168 0.587 . . . . 2.9 110.602 172.986 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -57.93 -41.18 82.23 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.491 0.716 . . . . 2.69 111.32 -172.621 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -47.84 -40.63 21.85 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.137 0.975 . . . . 3.19 112.122 174.057 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.32 -52.47 65.49 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 119.617 1.098 . . . . 3.18 108.113 -178.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.1 m -72.94 -50.87 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 CA-C-N 114.919 -1.037 . . . . 1.61 109.703 -169.498 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.2 m -57.36 -44.31 84.27 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 125.401 1.48 . . . . 1.6 111.656 178.67 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -60.22 -62.34 1.94 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.78 0.718 . . . . 3.74 110.999 -173.284 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -145.15 38.53 1.17 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.493 0.923 . . . . 4.69 113.493 -173.033 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.58 HD21 HD22 ' A' ' 83' ' ' LEU . 0.6 OUTLIER -129.13 31.75 0.22 Allowed Pre-proline 0 CA--C 1.549 0.934 0 N-CA-C 116.074 1.879 . . . . 2.24 116.074 178.857 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -62.38 -60.52 0.19 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.852 2.368 . . . . 2.51 114.232 -165.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -66.3 -37.96 86.63 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 121.337 -0.852 . . . . 4.26 111.421 -175.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.459 HD13 HD12 ' B' ' 6' ' ' LEU . 22.5 tp -65.66 -54.32 29.11 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.993 0.517 . . . . 1.48 110.027 -173.46 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.5 mt -107.63 87.71 2.56 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-O 121.841 0.829 . . . . 2.1 109.533 169.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.69 160.35 0.66 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 113.981 -1.463 . . . . 5.53 111.645 170.999 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 57.53 39.66 27.62 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.205 1.002 . . . . 5.39 111.098 168.185 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -41.28 -34.57 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 128.186 2.594 . . . . 2.63 112.658 177.073 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -39.75 -48.69 3.23 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.153 0.883 . . . . 1.71 112.006 174.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.6 t -91.95 20.72 5.49 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.763 0.825 . . . . 1.91 113.226 -172.509 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.498 HD13 ' C ' ' A' ' 56' ' ' LEU . 1.5 tm? -39.2 -46.38 1.48 Allowed 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 125.642 1.577 . . . . 1.72 111.897 173.854 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -49.94 -37.5 32.22 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.932 2.093 . . . . 4.56 111.75 -174.443 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -58.49 -52.9 63.67 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 121.535 0.683 . . . . 2.96 109.781 173.456 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -49.51 76.05 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 107.933 -1.136 . . . . 2.93 107.933 -178.8 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -49.51 -54.6 17.02 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.414 0.686 . . . . 1.61 110.651 177.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -59.83 -43.78 94.41 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 122.346 -0.221 . . . . 2.95 111.203 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.6 t -60.24 -44.1 95.53 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.831 0.824 . . . . 1.89 111.185 178.18 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.401 HD13 ' CZ ' ' A' ' 38' ' ' PHE . 11.0 mt -64.69 -46.3 82.96 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.531 1.133 . . . . 2.17 110.601 -179.046 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -69.11 77.0 0.34 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.439 1.096 . . . . 1.64 110.629 -177.04 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.0 m -46.15 -43.35 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 C-N-CA 124.673 1.189 . . . . 1.68 113.648 -172.758 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -96.82 6.6 48.36 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.436 0.694 . . . . 2.24 112.254 -176.239 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 37.5 56.8 1.42 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.831 2.053 . . . . 3.1 112.189 -177.941 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 50.6 p30 -94.42 -5.92 45.22 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.929 1.292 . . . . 1.63 110.565 177.035 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.9 m 67.8 19.94 9.49 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.892 1.277 . . . . 1.73 111.583 -174.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -131.03 109.39 10.47 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.685 -1.598 . . . . 3.03 106.685 174.567 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.422 ' CD2' ' N ' ' A' ' 71' ' ' LEU . 0.1 OUTLIER -83.53 105.39 14.42 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 103.86 -2.644 . . . . 1.23 103.86 171.838 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 164.86 1.24 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 108.71 -0.848 . . . . 4.04 108.71 169.37 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -38.05 -60.55 0.74 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.923 1.289 . . . . 4.7 110.98 175.495 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -67.78 -26.64 66.2 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.229 1.012 . . . . 1.56 112.264 -175.367 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -73.36 -59.07 2.88 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.804 0.729 . . . . 2.16 109.067 174.749 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -51.8 -47.86 64.08 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 109.422 -0.584 . . . . 2.55 109.422 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.675 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 55.4 t90 -46.5 -39.53 10.95 Favored 'General case' 0 N--CA 1.44 -0.94 0 O-C-N 124.312 1.007 . . . . 4.13 111.528 -175.808 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 70.6 mtt180 -43.43 -40.99 4.04 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.676 0.671 . . . . 4.03 112.756 175.014 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 28.7 tp -52.55 -44.64 65.97 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.065 0.546 . . . . 1.05 111.149 179.036 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 55.1 mt -60.23 -28.34 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 N-CA-C 108.0 -1.111 . . . . 1.47 108.0 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.587 ' CA ' ' CZ2' ' B' ' 77' ' ' TRP . . . -68.88 -52.76 22.68 Favored Glycine 0 CA--C 1.492 -1.367 0 C-N-CA 126.547 2.022 . . . . 1.27 111.896 178.978 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.43 -59.71 5.01 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 105.792 -1.929 . . . . 2.38 105.792 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.58 HD22 HD21 ' A' ' 46' ' ' LEU 0.298 4.3 pp -54.35 -38.43 66.07 Favored 'General case' 0 CA--C 1.551 1.015 0 O-C-N 121.339 -0.851 . . . . 1.95 112.768 179.016 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 84' ' ' ALA . . . . . 0.463 ' O ' HG22 ' A' ' 87' ' ' ILE . . . -62.84 -29.01 70.41 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.091 -1.005 . . . . 1.25 113.528 175.016 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -81.06 -44.16 18.42 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.601 1.56 . . . . 1.69 109.691 174.784 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -63.29 -25.73 68.45 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.82 1.248 . . . . 2.59 111.162 -175.346 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 84' ' ' ALA . 12.4 tt -48.23 -34.37 4.85 Favored 'Isoleucine or valine' 0 C--N 1.344 0.34 0 CA-C-N 119.259 0.936 . . . . 1.42 112.825 167.725 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 38.1 ttp180 -96.51 -48.6 5.48 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.611 1.164 . . . . 5.11 108.669 177.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -65.93 -14.61 61.87 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.527 0.936 . . . . 2.86 113.527 -173.197 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 7.0 pttt -49.89 -28.96 7.32 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 120.893 -1.129 . . . . 9.54 111.342 164.061 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . 2.224 26.2 ttmt 7.97 -77.0 0.0 OUTLIER 'General case' 0 C--O 1.235 0.308 0 N-CA-C 118.029 2.603 . . . . 14.24 118.029 135.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -140.16 -83.36 0.24 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.125 -1.398 . . . . 6.07 107.605 -115.787 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 48.7 tp -80.4 67.89 6.39 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 124.228 1.011 . . . . 8.65 108.975 -178.857 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 57.9 mttp 88.47 98.41 0.03 OUTLIER 'General case' 0 C--N 1.334 -0.079 0 C-N-CA 126.982 2.113 . . . . 10.36 110.179 161.411 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.9 mp -51.93 -66.14 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 124.95 1.3 . . . . 8.05 109.116 -175.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 36.55 70.21 0.17 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.496 1.919 . . . . 17.18 111.745 176.357 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.59 136.21 0.15 Allowed 'General case' 0 C--O 1.232 0.144 0 C-N-CA 126.933 2.093 . . . . 11.18 107.143 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.529 -0.748 . . . . 15.85 109.542 171.513 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 83.5 mtp . . . . . 0 N--CA 1.471 0.603 0 N-CA-C 107.375 -1.343 . . . . 9.03 107.375 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.427 . . 54.27 -150.48 0.39 Allowed 'General case' 0 CA--C 1.534 0.364 0 O-C-N 123.545 0.528 . . . . 6.5 110.578 -171.127 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 74.26 101.28 0.07 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.324 1.449 . . . . 5.75 112.025 172.647 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.569 ' HB3' ' CD ' ' B' ' 5' ' ' PRO 0.341 9.5 tt0 -101.83 -115.04 0.0 OUTLIER Pre-proline 0 CA--C 1.558 1.253 0 CA-C-O 114.843 -2.503 . . . . 7.42 110.967 -172.759 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 5' ' ' PRO . . . . . 0.569 ' CD ' ' HB3' ' B' ' 4' ' ' GLU . 22.4 Cg_endo -90.1 163.19 4.79 Favored 'Trans proline' 0 C--N 1.36 1.146 0 CA-C-N 124.554 2.662 . . . . 3.52 110.651 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.81 HD12 ' HG3' ' B' ' 10' ' ' GLU . 5.9 mt -139.81 -53.28 0.53 Allowed 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 113.759 1.022 . . . . 4.24 113.759 -155.385 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 6.8 t -170.09 -175.41 2.0 Allowed 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 120.204 1.366 . . . . 2.25 110.989 -172.937 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 70.8 tt0 -71.42 -67.25 0.53 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.848 1.204 . . . . 2.71 112.118 -167.107 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 11.9 mt -48.97 -42.34 37.31 Favored 'General case' 0 C--N 1.34 0.196 0 O-C-N 121.615 -0.678 . . . . 1.26 110.793 173.815 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.81 ' HG3' HD12 ' B' ' 6' ' ' LEU . 11.3 tm-20 -48.94 -61.29 2.14 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 117.76 -1.114 . . . . 5.84 112.472 169.223 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -51.51 -41.6 61.11 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 121.402 1.91 . . . . 3.75 109.946 178.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.2 t -61.83 -30.4 70.81 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 118.334 -0.841 . . . . 1.63 112.839 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.408 ' CD1' HD12 ' A' ' 87' ' ' ILE 0.284 2.7 pp -80.51 -35.68 15.4 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 119.842 1.201 . . . . 1.09 110.892 167.341 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -52.38 -53.32 46.33 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 108.066 -1.087 . . . . 3.03 108.066 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 7.8 t -55.02 -35.4 64.38 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.115 0.783 . . . . 1.25 113.115 -175.454 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 20.0 m -80.11 -37.09 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 O-C-N 120.807 -1.183 . . . . 0.77 110.172 175.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 43.4 t -58.65 -45.57 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 123.807 0.843 . . . . 0.87 110.593 177.19 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 8.9 t -60.79 -44.08 97.29 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 119.853 1.206 . . . . 1.34 110.609 175.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 23.1 m -57.77 -52.16 66.61 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 119.094 0.861 . . . . 1.06 109.733 178.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -46.83 -60.88 2.13 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.186 1.394 . . . . 3.9 110.968 171.281 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -59.49 -49.72 76.68 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.977 1.311 . . . . 2.83 110.975 -171.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 34.6 p -56.15 -56.68 17.96 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 118.915 -0.564 . . . . 2.19 109.819 177.886 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -52.71 -47.24 67.43 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 119.099 0.863 . . . . 2.83 111.338 175.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.39 -29.7 58.99 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.366 1.467 . . . . 1.2 110.653 -175.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.07 -21.25 58.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 117.435 -1.269 . . . . 5.52 113.289 177.48 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.08 -65.03 0.71 Allowed 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 118.148 -1.421 . . . . 2.03 114.56 -156.703 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -88.41 -80.21 0.29 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 119.279 -0.968 . . . . 3.48 112.774 -162.732 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.34 170.05 29.62 Favored Glycine 0 C--N 1.34 0.774 0 C-N-CA 128.802 3.096 . . . . 2.29 110.834 148.689 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 61.29 87.58 0.09 Allowed 'General case' 0 C--O 1.241 0.622 0 N-CA-C 112.283 0.475 . . . . 4.93 112.283 140.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -74.83 52.72 0.55 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 125.631 1.572 . . . . 3.52 110.833 174.997 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -161.94 -58.74 0.05 OUTLIER 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 107.842 -1.17 . . . . 3.92 107.842 -172.013 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 17.1 m -96.66 142.27 28.9 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 124.135 0.974 . . . . 3.55 110.486 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -83.18 131.96 35.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.313 1.045 . . . . 2.11 109.058 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 1.3 p -114.8 174.44 5.97 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.848 1.259 . . . . 2.53 108.724 171.988 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.81 51.23 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.338 0.087 0 O-C-N 121.255 -0.903 . . . . 2.55 111.143 -170.229 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -155.2 53.74 0.63 Allowed 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 105.416 -2.068 . . . . 2.03 105.416 145.247 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -149.24 -54.45 0.17 Allowed 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 130.683 3.593 . . . . 2.01 104.527 173.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.48 -55.11 28.05 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.174 -0.921 . . . . 2.28 109.192 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 42.5 tttt -61.21 -41.73 97.36 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 120.296 -0.561 . . . . 2.98 111.118 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 83.4 mt-10 -51.41 -40.39 59.22 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 118.134 0.425 . . . . 3.11 111.587 177.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 10.2 tt -67.98 -47.3 68.94 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 109.15 -0.685 . . . . 1.89 109.15 -175.3 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.4 m -68.52 -47.82 75.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 109.873 -0.417 . . . . 0.84 109.873 -176.121 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 55.8 m -60.29 -55.26 35.83 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.381 1.072 . . . . 0.92 111.501 178.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -79.02 -58.81 3.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 118.25 0.477 . . . . 2.46 110.52 -171.851 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -80.98 -50.67 9.41 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 121.203 0.525 . . . . 2.94 110.387 -166.602 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.79 -16.93 0.23 Allowed Pre-proline 0 CA--C 1.543 0.702 0 N-CA-C 120.158 3.392 . . . . 1.86 120.158 -163.53 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -39.91 -50.69 3.26 Favored 'Trans proline' 0 CA--C 1.532 0.386 0 C-N-CA 125.038 3.825 . . . . 2.4 116.841 -134.652 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 13.2 t-160 -66.46 -30.94 71.39 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.968 0.729 . . . . 2.22 112.968 -172.944 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 29.2 tp -67.64 -73.49 0.14 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.573 0.624 . . . . 1.19 110.096 -170.378 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 60.6 mt -79.42 78.96 5.91 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 108.218 -1.03 . . . . 1.67 108.218 170.166 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.18 169.91 0.76 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.67 -0.695 . . . . 4.93 110.243 167.588 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 66.85 40.03 3.23 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.233 1.413 . . . . 4.76 109.602 -167.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 27.3 m -59.78 -24.3 28.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 C-N-CA 124.188 0.995 . . . . 2.0 111.854 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.6 -67.03 2.28 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 109.408 -1.477 . . . . 2.47 109.408 171.636 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.8 m -72.02 61.73 0.44 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 127.032 2.133 . . . . 3.17 111.292 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -80.9 -37.62 29.39 Favored 'General case' 0 N--CA 1.439 -1.019 0 C-N-CA 124.449 1.1 . . . . 1.12 109.178 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -54.63 -49.76 69.75 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.55 0.74 . . . . 3.53 111.342 -175.766 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.63 -38.39 81.22 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 121.872 -0.517 . . . . 3.08 111.348 176.686 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.23 -54.13 48.05 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.352 0.661 . . . . 4.04 109.392 176.595 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -52.75 -52.68 55.44 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 126.321 1.848 . . . . 1.6 110.136 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 77.3 mttt -58.33 -45.96 87.1 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.183 0.593 . . . . 4.3 110.358 178.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 12.3 t -57.96 -44.72 87.2 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.095 0.558 . . . . 1.6 110.551 177.994 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 22.9 mt -63.42 -45.03 92.83 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.136 0.575 . . . . 1.75 111.356 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.328 16.1 t0 -51.66 -8.35 0.06 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 118.799 2.888 . . . . 2.11 118.799 -169.202 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 26.9 m -34.07 -19.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.539 1 C-N-CA 131.982 4.113 . . . . 1.87 119.276 -137.099 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -36.62 62.79 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 120.366 1.439 . . . . 3.18 109.656 160.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 66.62 63.51 0.5 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 125.586 1.555 . . . . 4.33 109.268 -171.226 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 30.0 p30 -120.35 -16.13 8.48 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.859 2.063 . . . . 2.44 112.668 -175.387 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.5 m 70.87 22.37 4.74 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.247 1.819 . . . . 2.69 113.093 -176.85 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -128.5 112.44 14.34 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.16 -1.793 . . . . 3.37 106.16 166.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -81.02 110.57 16.68 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 106.403 -1.703 . . . . 1.41 106.403 174.781 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 10.5 tppt? -79.0 168.66 19.37 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.518 -0.919 . . . . 3.72 108.518 -173.834 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 20.0 p90 -91.26 50.42 1.75 Allowed 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.999 -0.438 . . . . 5.33 110.314 174.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -156.7 48.43 0.46 Allowed 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 106.661 -1.607 . . . . 2.25 106.661 119.158 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -94.65 -62.12 1.38 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.897 1.679 . . . . 2.62 109.078 142.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -44.91 -48.73 11.26 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 125.883 1.673 . . . . 3.74 110.078 -173.451 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.675 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 4.1 t-105 -44.74 -37.13 3.55 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.627 -1.178 . . . . 4.7 111.76 -178.985 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 1.7 ttt85 -40.11 -47.26 2.32 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 119.987 1.267 . . . . 6.8 110.864 174.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 15.8 tp -44.19 -47.07 9.16 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.637 0.775 . . . . 0.86 110.599 -178.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 53.9 mt -62.76 -34.0 63.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.988 0.899 . . . . 1.6 109.559 -173.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.572 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -72.53 -42.81 46.86 Favored Glycine 0 CA--C 1.487 -1.7 0 N-CA-C 109.544 -1.423 . . . . 1.47 109.544 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.262 5.0 mm-40 -67.07 -48.41 68.34 Favored 'General case' 0 N--CA 1.421 -1.882 0 N-CA-C 105.535 -2.024 . . . . 3.29 105.535 -175.819 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 7.7 mt -42.9 -58.07 2.55 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 121.262 1.846 . . . . 2.22 111.896 166.864 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.42 -23.46 49.62 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.618 0.767 . . . . 1.3 112.536 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.01 -57.21 3.74 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.453 1.101 . . . . 2.03 110.581 170.47 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -57.53 -28.03 63.13 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 129.01 2.924 . . . . 2.79 111.68 -168.11 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 2.9 tt -49.58 -44.17 18.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 O-C-N 122.014 -0.429 . . . . 1.14 110.662 168.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -85.56 -61.65 1.71 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.62 1.568 . . . . 3.86 113.67 167.861 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 89' ' ' LYS . . . . . 0.479 ' HG3' ' H ' ' B' ' 92' ' ' ASP . 35.3 tttm -56.33 129.65 41.3 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.75 1.62 . . . . 7.14 110.947 -173.652 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -84.06 -56.59 3.59 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.754 0.788 . . . . 4.91 109.167 164.222 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -147.82 -2.22 0.56 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.833 1.653 . . . . 6.73 112.113 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 92' ' ' ASP . . . . . 0.479 ' H ' ' HG3' ' B' ' 89' ' ' LYS . 1.0 OUTLIER -92.94 54.31 2.16 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 121.736 -0.602 . . . . 4.91 110.477 -138.809 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 53.9 tp -123.68 -72.15 0.69 Allowed 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 124.123 0.969 . . . . 5.45 109.754 -172.445 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.04 168.77 11.69 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 124.17 0.988 . . . . 7.48 108.596 177.223 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 6.3 tp -153.91 43.09 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 123.192 0.597 . . . . 8.89 110.498 177.939 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -162.23 154.63 19.41 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.189 -0.944 . . . . 7.82 109.396 173.224 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 22.3 tptp -177.05 138.09 0.24 Allowed 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 127.471 2.308 . . . . 7.75 105.1 -171.788 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 9.5 tptp . . . . . 0 C--O 1.253 1.251 0 N-CA-C 103.402 -2.814 . . . . 10.13 103.402 161.542 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.4 mtt . . . . . 0 N--CA 1.474 0.761 0 N-CA-C 105.019 -2.215 . . . . 8.26 105.019 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.32 175.13 0.6 Allowed 'General case' 0 C--O 1.237 0.444 0 N-CA-C 109.057 -0.72 . . . . 3.29 109.057 136.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.39 99.11 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 129.108 2.963 . . . . 3.67 109.686 -175.048 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -70.56 126.17 92.18 Favored Pre-proline 0 N--CA 1.45 -0.426 0 C-N-CA 123.877 0.871 . . . . 4.66 110.565 -174.215 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.51 113.1 3.63 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 122.346 2.031 . . . . 2.43 109.269 178.394 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 61.5 mt -69.23 164.2 23.25 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.076 0.55 . . . . 1.44 110.312 177.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.4 t -76.63 162.21 27.93 Favored 'General case' 0 CA--C 1.528 0.109 0 N-CA-C 108.992 -0.744 . . . . 2.0 108.992 176.928 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.91 -53.28 59.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.171 0.988 . . . . 3.18 111.216 -169.21 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.5 mt -62.77 -49.87 73.29 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 118.046 -0.978 . . . . 1.42 112.563 178.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -51.1 -54.46 24.81 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 119.687 1.13 . . . . 2.12 110.683 175.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -49.26 -56.18 10.22 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.066 1.347 . . . . 3.84 110.161 174.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.3 t -53.5 -46.97 70.24 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.999 0.92 . . . . 2.15 111.392 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.311 2.8 pp -70.04 -35.49 64.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 O-C-N 120.966 -1.084 . . . . 0.99 111.42 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -59.14 -51.84 68.26 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.2 0.909 . . . . 2.79 109.977 176.11 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . 0.256 12.5 t -53.26 -38.94 63.49 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 121.801 -0.562 . . . . 1.87 112.177 -176.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 m -72.92 -39.35 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 O-C-N 120.461 -1.399 . . . . 0.9 111.226 175.666 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.4 t -55.22 -47.3 77.76 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.112 0 CA-C-N 118.252 0.478 . . . . 0.81 110.184 175.613 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . 0.253 10.2 t -62.11 -48.57 79.56 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 117.937 -1.03 . . . . 1.23 111.334 178.502 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 16.4 m -49.92 -52.26 34.6 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 120.395 1.452 . . . . 1.51 110.803 173.019 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -50.92 -60.0 3.55 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.228 0.611 . . . . 3.01 110.163 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -61.89 -45.16 94.95 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.96 0.504 . . . . 3.13 111.384 -170.663 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -65.3 -19.22 65.86 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 119.252 -0.404 . . . . 2.16 111.902 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.526 ' HB3' HD21 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -81.54 -44.11 17.78 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 118.401 0.546 . . . . 3.11 111.899 164.947 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.17 -33.11 67.12 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.453 1.501 . . . . 0.78 111.655 -168.191 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 34.2 ptt180 -62.73 -34.96 78.27 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.545 1.138 . . . . 4.66 112.439 177.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -40.86 -64.69 0.5 Allowed 'General case' 0 C--N 1.344 0.365 0 CA-C-O 122.139 0.971 . . . . 1.9 113.255 -160.039 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -106.08 81.93 1.7 Allowed 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 103.889 -2.634 . . . . 3.16 103.889 -178.076 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 48.06 -172.94 0.04 OUTLIER Glycine 0 CA--C 1.53 1.012 0 C-N-CA 126.835 2.16 . . . . 2.17 114.518 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 34.73 88.54 0.01 OUTLIER 'General case' 0 C--O 1.235 0.333 0 C-N-CA 127.267 2.227 . . . . 4.75 112.367 169.05 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -75.97 57.84 1.11 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.955 1.302 . . . . 3.99 112.784 -166.779 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -163.53 -44.79 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 126.646 1.979 . . . . 4.37 106.906 174.539 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 m -82.08 113.39 19.91 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 125.479 1.512 . . . . 1.86 109.59 -179.113 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.645 HD22 ' CE1' ' A' ' 76' ' ' TYR . 4.8 mp -84.33 136.62 33.82 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.149 -0.478 . . . . 2.72 110.05 168.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.9 t -81.2 174.59 11.4 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.519 1.928 . . . . 2.86 108.625 172.541 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 11.5 p -62.21 -43.01 97.4 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 O-C-N 122.079 -0.388 . . . . 2.17 110.01 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -67.58 -57.29 6.72 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 118.182 -0.913 . . . . 2.05 109.113 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.408 ' HB3' HD23 ' A' ' 33' ' ' LEU . 5.5 mt-10 -37.6 -49.16 1.08 Allowed 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.361 1.464 . . . . 1.83 112.072 169.735 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -60.03 -59.99 4.53 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.967 -0.458 . . . . 3.36 110.597 174.271 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -52.92 -40.67 63.78 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.281 0.491 . . . . 3.2 111.671 -176.451 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -51.82 -39.97 59.68 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 123.968 0.907 . . . . 3.28 110.574 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 57.5 tp -68.58 -45.8 71.08 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 119.543 1.065 . . . . 2.37 109.435 -176.699 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.491 HG12 HD22 ' A' ' 46' ' ' LEU . 35.6 m -69.62 -28.1 36.27 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.123 0 CA-C-O 120.99 0.424 . . . . 1.89 110.4 -175.699 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 63.7 m -81.09 -40.23 24.42 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 124.383 1.073 . . . . 1.8 111.105 177.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -82.78 -55.86 4.18 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 124.176 0.991 . . . . 2.56 110.067 -172.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.2 mp0 -96.71 -146.51 0.29 Allowed 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 107.616 -1.253 . . . . 3.97 107.616 169.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.537 HD21 HD11 ' A' ' 83' ' ' LEU . 8.0 mp 38.63 44.95 0.68 Allowed Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 126.243 1.817 . . . . 2.53 113.15 -167.284 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.456 ' HD2' HG21 ' B' ' 7' ' ' THR . 58.3 Cg_endo -59.93 -32.86 95.77 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 122.55 2.167 . . . . 1.92 111.966 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.94 -6.33 3.11 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 114.485 1.291 . . . . 3.2 114.485 179.461 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.567 HD23 ' HG ' ' A' ' 83' ' ' LEU 2.134 10.8 mp -2.05 -144.83 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 120.989 3.7 . . . . 2.17 120.989 129.485 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.422 ' C ' ' H ' ' A' ' 52' ' ' ASP . 6.2 mt -82.73 88.13 6.74 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 113.33 -1.759 . . . . 2.06 107.714 174.8 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.73 18.88 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.899 1.444 . . . . 5.07 114.899 177.445 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.422 ' H ' ' C ' ' A' ' 50' ' ' LEU . 64.9 m-20 -115.57 20.67 14.55 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 128.192 2.597 . . . . 5.67 109.289 -172.653 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.0 m -53.33 -15.18 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 126.681 1.992 . . . . 2.69 114.833 -172.197 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -56.33 -51.85 53.47 Favored Glycine 0 CA--C 1.529 0.936 0 N-CA-C 110.048 -1.221 . . . . 2.38 110.048 170.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.8 t -84.92 60.45 6.23 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 122.361 1.077 . . . . 2.89 109.826 -173.179 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -77.38 -36.5 53.46 Favored 'General case' 0 N--CA 1.438 -1.057 0 O-C-N 121.628 -0.67 . . . . 1.6 109.79 -176.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -59.61 -46.7 88.19 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.783 0.719 . . . . 4.67 110.496 178.917 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -45.04 -57.92 3.53 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.576 1.15 . . . . 3.33 109.413 170.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 6.0 mmpt? -60.28 -45.15 94.32 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 118.735 -0.65 . . . . 5.34 110.78 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -51.34 -54.94 21.4 Favored 'General case' 0 C--N 1.334 -0.087 0 CA-C-N 119.428 1.013 . . . . 1.51 109.59 178.84 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 44.6 mtmt -57.57 -37.64 73.48 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 122.584 0.354 . . . . 3.15 111.001 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 14.5 m -62.9 -47.75 81.95 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.863 -0.523 . . . . 1.88 112.165 175.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.418 HD21 ' HB2' ' A' ' 79' ' ' LEU . 7.2 mp -66.77 -60.24 2.86 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 121.27 -0.894 . . . . 2.03 109.32 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -75.98 74.7 2.88 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.175 1.39 . . . . 1.58 109.683 -168.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.1 m -45.55 -37.19 2.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 124.93 1.292 . . . . 1.75 113.17 -175.971 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 11.0 p-10 -102.37 8.18 40.28 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 113.131 0.789 . . . . 2.84 113.131 -176.159 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 46.81 59.14 4.14 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.76 1.624 . . . . 3.36 112.359 172.233 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 40.5 p30 -108.69 -9.57 15.25 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.36 1.464 . . . . 2.0 111.76 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.2 m 62.47 25.7 15.31 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.173 0.989 . . . . 1.66 111.9 -170.663 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -122.81 100.91 7.15 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 126.194 1.798 . . . . 3.23 107.57 169.662 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -86.49 79.97 8.79 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 105.926 -1.879 . . . . 0.97 105.926 170.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -69.24 171.78 7.94 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 122.776 0.43 . . . . 3.96 110.706 174.209 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -37.92 -61.15 0.67 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.563 1.545 . . . . 5.29 112.842 -167.038 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -68.39 -44.5 74.97 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.582 -0.699 . . . . 2.47 111.432 -177.054 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -57.53 -33.15 67.79 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.209 0.603 . . . . 1.86 111.203 178.147 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.645 ' CE1' HD22 ' A' ' 33' ' ' LEU . 35.5 t80 -78.67 -48.19 15.51 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 118.102 0.41 . . . . 3.23 110.363 175.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.622 ' CD1' ' HA2' ' B' ' 81' ' ' GLY . 44.5 t-105 -48.54 -29.09 3.85 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.823 0.849 . . . . 5.08 111.72 176.886 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.406 ' HA ' ' CH2' ' B' ' 77' ' ' TRP . 14.4 mmm180 -37.23 -56.62 0.93 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.347 1.059 . . . . 3.66 110.859 166.766 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.418 ' HB2' HD21 ' A' ' 63' ' ' LEU . 26.0 tp -49.07 -43.33 40.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 123.905 0.882 . . . . 0.8 111.219 -179.588 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mp -80.72 -29.64 11.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 107.925 -1.139 . . . . 1.95 107.925 -168.501 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.43 ' HA3' ' CE2' ' B' ' 77' ' ' TRP . . . -56.22 -51.11 58.04 Favored Glycine 0 N--CA 1.439 -1.141 0 N-CA-C 110.259 -1.137 . . . . 1.13 110.259 164.786 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -63.22 -33.93 76.57 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-O 118.596 -0.716 . . . . 2.43 110.456 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.567 ' HG ' HD23 ' A' ' 49' ' ' LEU . 8.0 mp -57.84 -55.58 33.04 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 119.793 1.179 . . . . 2.4 109.708 173.716 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.12 -48.25 64.91 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.346 0.593 . . . . 1.55 109.914 177.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -55.65 -34.65 65.15 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 117.849 -1.072 . . . . 2.4 112.271 174.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -78.91 -14.22 59.35 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 127.406 2.283 . . . . 2.13 112.624 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -91.5 -26.72 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 N-CA-C 113.773 1.027 . . . . 2.75 113.773 157.803 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -65.5 0.75 Allowed 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 119.851 1.205 . . . . 4.82 111.579 175.277 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt -84.18 -170.29 3.02 Favored 'General case' 0 C--O 1.214 -0.784 0 N-CA-C 104.106 -2.553 . . . . 3.59 104.106 145.345 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 40.4 mttp -49.63 -46.08 49.02 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 124.72 3.418 . . . . 8.64 110.741 -21.117 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . 0.267 1.5 tppt? 153.54 61.77 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.999 1 C-N-CA 141.013 7.725 . . . . 9.68 104.747 -13.544 . . . . . . . . 3 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -113.76 170.91 7.91 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.618 1.567 . . . . 8.55 110.273 162.023 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . 0.292 0.6 OUTLIER 92.97 -93.61 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 129.253 3.021 . . . . 13.37 113.659 171.981 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -147.8 123.6 10.58 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-O 117.343 -1.313 . . . . 15.19 110.188 -169.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -43.09 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 121.572 1.987 . . . . 14.44 111.539 177.173 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 68.95 44.18 1.08 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.887 0.875 . . . . 16.02 110.514 -175.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 10.6 tmtt? -177.65 136.38 0.19 Allowed 'General case' 0 N--CA 1.461 0.096 0 C-N-CA 126.406 1.883 . . . . 18.55 106.045 173.133 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 N-CA-C 103.269 -2.863 . . . . 16.13 103.269 156.142 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.6 tpt . . . . . 0 C--O 1.205 -1.241 0 CA-C-O 115.599 -2.143 . . . . 12.53 106.296 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' ALA . . . . . 0.538 ' CB ' ' HA ' ' B' ' 3' ' ' ALA 0.295 . . -134.74 -144.59 0.22 Allowed 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 124.152 3.16 . . . . 4.71 115.195 -167.046 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 3' ' ' ALA . . . . . 0.538 ' HA ' ' CB ' ' B' ' 2' ' ' ALA 2.361 . . 104.78 101.62 0.01 OUTLIER 'General case' 0 C--N 1.352 0.71 1 C-N-CA 134.404 5.081 . . . . 4.08 112.159 27.453 . . . . . . . . 4 3 . 1 . 012 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' B' ' 3' ' ' ALA 0.279 2.2 mt-10 124.06 175.11 0.0 OUTLIER Pre-proline 0 N--CA 1.48 1.059 1 C-N-CA 135.003 5.321 . . . . 6.8 107.947 -178.386 . . . . . . . . 4 3 . 1 . 012 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.71 147.35 56.59 Favored 'Trans proline' 0 C--N 1.353 0.766 0 CA-C-N 122.462 1.915 . . . . 4.04 112.375 -169.111 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . 2.316 0.2 OUTLIER -90.72 -146.82 0.19 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 127.81 2.444 . . . . 2.44 112.751 -167.217 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.593 HG22 ' HB2' ' B' ' 10' ' ' GLU . 1.1 t -118.51 -109.68 0.35 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.738 2.015 . . . . 1.87 108.001 178.662 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -105.75 -68.72 0.85 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 126.351 1.86 . . . . 5.12 107.483 172.525 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 3.7 mp -65.79 -51.09 61.89 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.807 -0.558 . . . . 2.72 110.032 -177.283 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.593 ' HB2' HG22 ' B' ' 7' ' ' THR . 4.2 mp0 -52.25 -39.58 60.52 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 119.22 -0.419 . . . . 3.84 111.375 173.301 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.57 -56.09 20.12 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.179 -0.675 . . . . 4.95 109.179 172.725 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 35.9 p -71.35 -39.63 71.19 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 119.926 -0.71 . . . . 2.19 110.822 -167.317 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.3 pp -69.67 -35.54 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 O-C-N 121.261 -0.899 . . . . 1.45 109.863 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -60.83 -55.46 32.86 Favored 'General case' 0 C--N 1.342 0.249 0 CA-C-N 119.199 0.909 . . . . 3.1 109.615 171.992 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.4 t -55.43 -38.84 69.5 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-O 121.911 0.862 . . . . 1.58 111.564 -170.787 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 17.0 m -72.89 -39.17 58.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 O-C-N 120.667 -1.271 . . . . 1.17 111.402 174.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 45.2 t -60.85 -44.1 96.98 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 119.447 1.021 . . . . 1.39 111.389 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 10.1 t -62.46 -45.92 90.84 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.725 1.148 . . . . 1.52 110.257 177.702 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 60.3 m -52.93 -55.18 25.31 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.345 0.593 . . . . 1.47 109.73 174.513 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -49.99 -49.83 49.19 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.611 1.164 . . . . 4.2 111.101 175.414 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -62.18 -54.31 42.9 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.889 0.875 . . . . 2.69 110.649 -175.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 15.0 t -62.13 -29.32 70.26 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 119.555 -0.858 . . . . 3.44 110.797 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -63.4 -54.02 43.29 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 118.4 0.545 . . . . 3.16 111.092 167.894 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.57 -30.28 62.97 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 126.336 1.854 . . . . 1.68 110.407 -172.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -54.85 -26.88 38.3 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.01 0.924 . . . . 3.97 112.657 176.603 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.451 ' HB3' ' CG ' ' B' ' 37' ' ' GLU . 11.2 tt0 -62.87 -68.64 0.32 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 114.063 1.134 . . . . 4.35 114.063 -157.083 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 27' ' ' GLU . . . . . 0.469 ' CD ' ' H ' ' B' ' 28' ' ' GLY . 0.0 OUTLIER -90.2 -74.91 0.47 Allowed 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 115.026 1.491 . . . . 5.07 115.026 -163.245 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 28' ' ' GLY . . . . . 0.469 ' H ' ' CD ' ' B' ' 27' ' ' GLU . . . -92.08 170.1 32.76 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 127.943 2.687 . . . . 2.66 109.779 154.965 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 38.41 102.09 0.0 OUTLIER 'General case' 0 C--O 1.24 0.58 0 C-N-CA 125.63 1.572 . . . . 4.04 114.792 142.675 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -71.09 49.73 0.14 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.631 1.572 . . . . 3.36 112.578 176.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -153.84 -53.67 0.1 Allowed 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.072 1.349 . . . . 3.72 108.17 -172.828 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.4 p -104.78 157.58 17.1 Favored 'General case' 0 C--O 1.244 0.799 0 C-N-CA 124.219 1.007 . . . . 2.29 113.305 -177.32 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.416 HD13 ' HB3' ' B' ' 37' ' ' GLU . 1.4 mm? -111.03 151.34 28.13 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 127.86 2.464 . . . . 2.34 109.39 -173.054 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 8.2 t -149.95 178.18 9.16 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.378 1.071 . . . . 3.53 108.323 169.976 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 9.2 p -83.89 53.09 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-O 121.865 0.84 . . . . 2.84 111.127 -171.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.25 56.12 0.51 Allowed 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 105.618 -1.993 . . . . 2.91 105.618 150.668 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.451 ' CG ' ' HB3' ' B' ' 26' ' ' GLN . 1.3 tt0 -173.78 -59.92 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 104.037 -2.579 . . . . 1.83 104.037 -172.677 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -57.55 -56.46 21.6 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.33 -0.85 . . . . 2.08 109.52 172.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.495 ' HE3' HD12 ' B' ' 56' ' ' LEU . 16.3 ttmt -57.05 -37.8 72.31 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 122.074 -0.391 . . . . 3.0 111.179 -177.005 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.74 -30.03 71.12 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.449 -0.782 . . . . 2.93 111.683 177.833 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.25 -52.54 63.32 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 107.978 -1.119 . . . . 2.66 107.978 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.408 ' HA ' HD23 ' B' ' 46' ' ' LEU . 2.6 m -68.17 -42.55 84.9 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 115.125 -0.943 . . . . 0.82 109.969 -174.752 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 96.6 m -54.08 -54.16 43.24 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.941 -0.572 . . . . 1.28 110.054 173.189 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -82.15 -62.78 1.53 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.796 1.035 . . . . 1.96 113.796 -167.015 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -83.19 -36.13 24.91 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 115.932 1.827 . . . . 3.69 115.932 -163.587 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 46' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' B' ' 42' ' ' VAL . 1.5 mm? -46.67 -38.82 12.7 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 114.027 1.121 . . . . 1.79 114.027 -159.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -64.04 -20.87 68.21 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 C-N-CA 122.191 -2.004 . . . . 2.18 109.978 -62.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -93.09 -56.27 3.03 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.058 0.943 . . . . 2.87 110.986 -169.789 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.474 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 7.4 tp -30.56 -72.12 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.133 1.773 . . . . 1.2 113.34 -167.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 79.7 mt -90.24 128.74 36.48 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 106.464 -1.68 . . . . 1.89 106.464 169.794 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.43 -5.28 10.81 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.797 1.239 . . . . 6.76 111.835 -173.745 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -88.74 16.61 6.51 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 128.168 2.587 . . . . 4.75 111.201 -177.634 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 14.4 m -52.42 -28.09 11.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 125.259 1.424 . . . . 1.72 111.404 177.33 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.08 -35.13 8.29 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 124.308 0.956 . . . . 3.39 112.657 172.75 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.6 t -124.77 47.83 2.07 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 117.817 0.808 . . . . 2.75 109.23 171.994 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.534 HD13 ' C ' ' B' ' 56' ' ' LEU . 2.3 tm? -45.63 -39.69 8.06 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.159 0.984 . . . . 1.33 110.134 172.304 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -58.38 -25.62 62.28 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.196 0.998 . . . . 4.27 111.854 -174.561 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -58.53 -54.24 49.22 Favored 'General case' 0 C--N 1.344 0.332 0 O-C-N 121.326 -0.859 . . . . 2.87 109.399 165.872 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -49.29 75.49 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 108.421 -0.955 . . . . 3.23 108.421 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 16.3 tpt -46.23 -60.24 2.43 Favored 'General case' 0 N--CA 1.462 0.13 0 C-N-CA 123.635 0.774 . . . . 2.49 108.953 177.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -57.46 -42.15 81.96 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 122.516 0.326 . . . . 3.67 111.367 -178.859 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.5 m -65.48 -34.83 79.19 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.116 0.566 . . . . 2.71 112.442 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 39.2 mt -80.02 -44.91 19.31 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.884 1.274 . . . . 1.77 109.645 -176.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -49.35 -8.76 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 128.346 2.658 . . . . 2.32 117.17 -175.48 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 19.8 m -33.65 -28.27 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 131.024 3.73 . . . . 2.38 118.923 -124.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -67.4 -20.62 65.56 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 120.724 1.602 . . . . 3.48 110.977 170.869 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 69.85 65.52 0.24 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.059 1.344 . . . . 3.66 110.617 172.226 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 48.9 p30 -119.56 -7.39 10.13 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.37 1.868 . . . . 2.55 112.321 -176.819 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 14.8 m 72.73 18.61 4.17 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.337 1.855 . . . . 2.53 112.673 -174.241 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -126.11 110.28 13.33 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.362 1.465 . . . . 4.12 108.798 170.858 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -80.44 104.08 10.74 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 106.813 -1.551 . . . . 1.55 106.813 170.242 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -91.21 166.64 12.84 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.533 1.933 . . . . 4.07 110.023 -176.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -89.73 56.7 3.61 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.636 -0.665 . . . . 5.77 111.525 179.234 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -158.52 49.26 0.37 Allowed 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 106.861 -1.533 . . . . 2.75 106.861 109.895 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 77.7 mt-10 -95.58 -61.32 1.48 Allowed 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.906 2.083 . . . . 2.56 108.843 145.807 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -48.13 -38.34 17.65 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 125.779 1.632 . . . . 3.48 110.968 -174.042 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.43 ' CE2' ' HA3' ' A' ' 81' ' ' GLY . 23.0 t90 -39.75 -41.94 1.18 Allowed 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 124.228 0.955 . . . . 5.28 111.525 176.637 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 31.8 mmt180 -49.3 -30.28 7.16 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-O 117.666 -1.159 . . . . 5.13 113.095 179.282 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' B' ' 79' ' ' LEU . 18.3 tp -57.66 -44.43 85.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 121.776 2.08 . . . . 1.1 111.184 174.944 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 1.4 mt -80.94 -26.94 10.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 C-N-CA 124.2 1.0 . . . . 1.83 108.832 178.319 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.622 ' HA2' ' CD1' ' A' ' 77' ' ' TRP . . . -37.56 -57.02 1.55 Allowed Glycine 0 C--N 1.347 1.159 0 C-N-CA 127.7 2.572 . . . . 1.8 110.189 159.754 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 82' ' ' GLU . . . . . 0.402 ' C ' ' HG2' ' B' ' 86' ' ' GLU . 45.0 mm-40 -82.46 -63.78 1.31 Allowed 'General case' 0 N--CA 1.421 -1.895 0 CA-C-N 111.644 -2.278 . . . . 2.49 108.252 -172.146 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.474 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 1.7 mp -38.49 -59.6 0.89 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 120.45 1.477 . . . . 2.1 113.428 -169.556 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.34 -36.1 65.92 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 123.148 0.579 . . . . 1.41 111.365 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 22.0 ttpp -80.69 -39.9 26.35 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.031 0.933 . . . . 1.61 112.329 175.756 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.402 ' HG2' ' C ' ' B' ' 82' ' ' GLU . 5.3 mm-40 -60.45 -25.61 66.13 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 119.757 1.162 . . . . 3.19 112.266 -177.039 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 1.5 tp -44.1 -44.44 2.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 N-CA-C 109.566 -0.531 . . . . 1.33 109.566 167.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 -85.71 -60.15 2.1 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.805 2.042 . . . . 4.78 113.198 171.172 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 29.0 tttm -66.25 115.0 5.76 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 125.616 1.566 . . . . 6.34 111.574 -166.9 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 12.2 ttmt -76.09 -61.23 2.01 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.463 -0.569 . . . . 4.71 109.463 170.252 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -176.59 72.41 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 126.271 1.828 . . . . 6.5 108.142 -178.072 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -131.6 151.23 51.77 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 106.085 -1.82 . . . . 5.17 106.085 153.609 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 1.6 pt? 175.12 -51.75 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 128.362 2.665 . . . . 4.55 107.83 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 161.93 174.22 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 128.839 2.856 . . . . 7.17 107.468 -177.919 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 8.5 tp -147.71 50.83 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-O 121.971 0.891 . . . . 8.84 109.723 178.791 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 8.4 ttm180 -165.32 -147.08 0.09 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.38 1.072 . . . . 7.43 108.445 175.125 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -176.66 138.98 0.3 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 128.923 2.889 . . . . 9.87 104.261 -174.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 34.6 tptt . . . . . 0 C--O 1.255 1.381 0 N-CA-C 103.834 -2.654 . . . . 6.88 103.834 172.105 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.7 mtt . . . . . 0 N--CA 1.476 0.839 0 N-CA-C 105.696 -1.964 . . . . 8.16 105.696 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.99 162.32 19.58 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 119.683 1.129 . . . . 3.61 109.885 169.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 62.91 80.0 0.24 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.514 1.526 . . . . 3.46 112.137 177.195 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -81.2 114.44 49.07 Favored Pre-proline 0 N--CA 1.446 -0.625 0 C-N-CA 124.545 1.138 . . . . 4.92 109.685 -178.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -79.53 98.87 1.18 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.559 2.172 . . . . 2.6 109.575 -177.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.61 177.47 7.47 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.586 -0.524 . . . . 2.39 109.586 170.88 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.1 m -58.05 147.07 30.75 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.394 -0.816 . . . . 3.91 110.778 -173.005 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -53.96 -49.38 68.89 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.526 -0.734 . . . . 2.7 110.285 175.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.7 mt -59.22 -39.87 84.07 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 117.98 -1.009 . . . . 1.61 112.891 172.332 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -54.31 -50.27 67.73 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 120.583 1.538 . . . . 2.62 111.465 170.059 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.1 mm-40 -50.48 -53.33 30.66 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.322 -0.622 . . . . 4.15 109.322 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.9 p -67.14 -43.53 82.12 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 121.746 -0.596 . . . . 1.79 111.932 -174.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.482 HG21 HD12 ' B' ' 83' ' ' LEU 0.276 1.8 pp -62.2 -41.04 89.86 Favored 'Isoleucine or valine' 0 C--N 1.342 0.242 0 CA-C-N 119.961 1.255 . . . . 0.8 110.587 176.08 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -58.36 -47.48 83.68 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.285 0.948 . . . . 3.22 110.388 174.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -59.53 -35.32 73.97 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.626 0.602 . . . . 1.22 112.626 -175.582 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.0 m -80.16 -38.83 18.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 O-C-N 120.541 -1.35 . . . . 0.74 111.187 173.143 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.5 t -57.95 -44.12 86.09 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 118.708 0.685 . . . . 0.53 110.528 178.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.6 t -61.08 -46.69 89.62 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.375 -0.828 . . . . 0.66 110.075 177.173 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.7 m -56.68 -49.9 73.73 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.687 0.676 . . . . 0.86 109.778 177.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -47.83 -57.45 5.62 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.986 0.914 . . . . 3.31 110.951 170.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -67.26 -46.83 72.52 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.124 0.57 . . . . 2.71 111.123 -168.163 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 40.1 p -56.67 -28.49 60.81 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.577 0.751 . . . . 2.61 111.517 176.706 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -75.49 -55.18 5.94 Favored 'General case' 0 C--O 1.222 -0.384 0 C-N-CA 123.339 0.655 . . . . 2.51 111.969 165.938 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.61 -28.37 54.82 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 126.907 2.083 . . . . 0.91 112.173 -169.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -74.35 -18.79 60.63 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.563 1.145 . . . . 3.68 113.083 -179.456 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.66 -67.93 0.22 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.204 0.911 . . . . 2.64 112.516 -175.618 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -108.48 172.69 6.7 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 126.861 2.064 . . . . 2.6 106.703 -174.469 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -9.35 116.73 0.01 OUTLIER Glycine 0 CA--C 1.532 1.127 0 C-N-CA 127.481 2.467 . . . . 1.95 114.814 172.715 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? 64.03 107.34 0.03 OUTLIER 'General case' 0 C--O 1.239 0.529 0 C-N-CA 124.701 1.201 . . . . 4.37 113.279 171.658 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -65.57 58.82 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.086 0.954 . . . . 3.61 111.298 164.376 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -166.51 -47.91 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.788 1.635 . . . . 4.46 108.834 -171.374 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 13.9 p -95.85 129.2 43.16 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 125.446 1.499 . . . . 1.8 109.164 173.458 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.412 HD22 ' CD1' ' A' ' 76' ' ' TYR . 6.7 mp -84.11 136.24 34.08 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.018 -1.105 . . . . 2.55 108.018 161.167 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.1 t -80.24 170.91 15.77 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 125.097 1.359 . . . . 2.77 107.808 167.919 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.4 p -58.99 -41.33 82.88 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 O-C-N 121.882 -0.511 . . . . 3.07 109.872 176.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -66.33 -59.6 3.56 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 118.481 -0.771 . . . . 1.8 109.211 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -37.51 -54.16 1.14 Allowed 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 124.145 0.978 . . . . 1.92 112.048 169.822 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -59.88 -51.89 67.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.633 -0.258 . . . . 2.97 111.128 178.441 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.8 tttm -56.9 -38.96 73.55 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.568 0.622 . . . . 3.84 109.67 -176.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -66.32 -19.94 65.95 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 118.816 -0.611 . . . . 5.02 112.125 -176.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -61.52 -55.82 26.86 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-N 119.638 1.108 . . . . 2.71 108.053 169.824 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.0 m -71.0 -44.21 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-O 121.811 0.815 . . . . 1.64 109.605 -169.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 38.2 m -68.38 -42.2 79.45 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 124.979 1.312 . . . . 1.4 110.179 -175.765 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -75.79 -50.76 14.28 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.769 0.713 . . . . 2.59 110.646 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -149.45 73.23 1.18 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.314 0.506 . . . . 3.8 112.185 -173.847 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.8 tp -154.65 45.79 0.27 Allowed Pre-proline 0 CA--C 1.549 0.904 0 N-CA-C 112.766 0.654 . . . . 2.05 112.766 155.093 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -62.59 -74.58 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 124.116 3.211 . . . . 1.98 114.726 -162.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 23.0 t-160 -63.62 -24.4 67.78 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 121.47 -0.769 . . . . 4.53 111.107 -169.116 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.6 tp -74.2 -75.43 0.16 Allowed 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 122.617 0.367 . . . . 1.57 110.447 177.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.6 mt -95.71 65.78 2.64 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 108.636 -0.876 . . . . 2.57 108.636 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.464 ' CD ' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -54.68 -30.75 56.41 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 114.253 -1.34 . . . . 5.77 111.936 178.599 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.421 ' OD2' ' NZ ' ' A' ' 59' ' ' LYS . 33.3 t70 -73.35 72.16 1.29 Allowed 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.988 0.899 . . . . 3.47 108.906 162.731 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.2 t -77.11 -6.52 9.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 127.954 2.501 . . . . 2.99 109.557 161.091 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.89 -69.56 1.36 Allowed Glycine 0 C--N 1.345 1.041 0 C-N-CA 124.745 1.164 . . . . 2.27 110.493 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.54 52.89 1.47 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 123.159 1.457 . . . . 4.15 109.766 -176.347 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.3 -25.61 59.57 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 126.818 2.047 . . . . 2.06 110.049 -174.736 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -42.32 -45.67 4.32 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 126.513 1.925 . . . . 4.5 111.576 169.158 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -45.94 -52.83 10.97 Favored 'General case' 0 C--N 1.346 0.433 0 N-CA-C 108.992 -0.744 . . . . 6.39 108.992 177.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.477 ' HE2' ' H ' ' A' ' 59' ' ' LYS . 1.5 mppt? -74.83 -63.28 1.29 Allowed 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 106.015 -1.846 . . . . 4.24 106.015 -174.598 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -47.5 -55.4 9.2 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 123.56 0.744 . . . . 2.27 110.369 -170.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.2 ttpp -73.22 -19.0 61.18 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 115.252 -0.885 . . . . 5.78 111.557 -169.528 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 44.9 m -82.81 -38.11 23.56 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.365 0.666 . . . . 2.17 112.536 166.125 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 72.0 mt -69.09 -51.1 42.19 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.391 1.476 . . . . 1.92 109.91 -172.733 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -72.74 73.35 1.09 Allowed 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.108 -1.071 . . . . 2.27 108.108 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.6 m -52.58 -40.86 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 124.222 1.009 . . . . 2.72 112.512 -170.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -88.99 -2.79 58.75 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.317 0.488 . . . . 2.47 112.317 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 58.07 55.08 5.44 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.001 1.32 . . . . 3.98 110.958 170.562 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 53.0 p30 -108.48 -3.24 18.31 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.667 1.587 . . . . 2.21 112.378 -177.219 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.8 m 80.35 0.05 1.96 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.66 1.984 . . . . 2.2 113.511 -178.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -110.4 131.23 55.23 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 119.065 0.848 . . . . 3.05 109.023 168.627 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -87.9 90.83 8.53 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 105.898 -1.89 . . . . 1.59 105.898 161.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.94 148.78 7.22 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.568 1.076 . . . . 3.63 108.25 169.26 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -38.78 -49.53 1.62 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.026 1.284 . . . . 4.99 113.494 178.979 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -66.46 -34.9 78.97 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.986 0.736 . . . . 2.28 112.986 177.512 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.53 -55.31 18.48 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 119.272 0.942 . . . . 2.65 109.476 172.951 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' TYR . . . . . 0.412 ' CD1' HD22 ' A' ' 33' ' ' LEU . 30.9 t80 -45.86 -51.63 12.69 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 123.848 0.859 . . . . 3.13 109.664 175.645 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.68 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 2.1 t-105 -45.89 -33.56 3.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 117.41 -1.281 . . . . 4.34 112.275 178.967 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -40.64 -47.97 2.84 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 120.237 1.381 . . . . 6.03 110.471 171.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 28.0 tp -41.7 -50.34 4.23 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 124.528 1.131 . . . . 1.47 111.524 176.132 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 85.5 mt -62.51 -30.7 49.76 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 N-CA-C 108.888 -0.782 . . . . 1.79 108.888 -172.271 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.543 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -74.67 -44.97 24.19 Favored Glycine 0 CA--C 1.491 -1.435 0 N-CA-C 109.996 -1.242 . . . . 1.36 109.996 176.447 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -61.21 -31.03 70.8 Favored 'General case' 0 N--CA 1.436 -1.134 0 N-CA-C 107.752 -1.203 . . . . 2.1 107.752 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.6 mt -71.08 -56.86 5.24 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 119.266 0.939 . . . . 2.19 110.826 172.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.45 -24.75 47.63 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.963 0.905 . . . . 1.32 111.856 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -80.41 -61.01 2.11 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 126.709 2.004 . . . . 1.57 109.013 171.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -50.39 -40.92 51.13 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.978 1.311 . . . . 2.55 111.237 -176.347 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 10.0 tt -54.85 -34.57 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 O-C-N 120.671 -1.268 . . . . 1.37 112.345 177.071 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -93.07 -62.56 1.36 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.46 1.504 . . . . 4.86 108.588 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -73.79 74.93 1.59 Allowed 'General case' 0 C--O 1.222 -0.377 0 C-N-CA 125.491 1.516 . . . . 4.06 108.422 168.079 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . 0.495 65.5 mttt -37.34 -3.55 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.996 1 C-N-CA 132.501 4.32 . . . . 10.65 121.606 -176.207 . . . . . . . . 3 2 . 1 . 013 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . 0.289 1.5 tmtm? 118.24 -0.79 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.819 1 C-N-CA 133.919 4.888 . . . . 10.03 109.652 179.001 . . . . . . . . 3 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.24 72.03 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 129.833 3.253 . . . . 5.72 109.097 172.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 19.8 tp -115.8 -70.71 0.78 Allowed 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 126.006 1.722 . . . . 10.96 108.685 -177.188 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -145.12 134.19 22.66 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 105.648 -1.982 . . . . 16.09 105.648 176.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 2.3 mp 69.01 138.77 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 C-N-CA 125.618 1.567 . . . . 14.56 109.566 -173.749 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.99 163.36 22.41 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.309 -0.869 . . . . 15.91 111.136 179.24 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LYS . . . . . 0.417 ' HG2' ' HA ' ' A' ' 98' ' ' LYS 2.212 9.7 mtpp -179.73 138.34 0.13 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 128.414 2.686 . . . . 15.32 105.141 -152.295 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.42 ' H ' ' HD2' ' A' ' 98' ' ' LYS 2.39 0.2 OUTLIER . . . . . 0 C--O 1.257 1.489 2 C-N-CA 134.215 5.006 . . . . 12.68 110.412 4.016 . . . . . . . . 4 3 . 1 . 013 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.419 23.4 ptm . . . . . 0 CA--C 1.543 0.711 0 N-CA-C 112.185 0.439 . . . . 10.79 112.185 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.23 -165.15 0.07 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.249 0.931 . . . . 8.13 111.727 170.041 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 103.92 107.68 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 127.738 2.415 . . . . 5.12 115.419 -179.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.432 ' HB3' ' CD ' ' B' ' 5' ' ' PRO 0.494 15.1 tt0 -157.56 -111.81 0.0 OUTLIER Pre-proline 0 CA--C 1.547 0.861 0 CA-C-O 115.475 -2.202 . . . . 6.26 112.509 102.424 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 5' ' ' PRO . . . . . 0.432 ' CD ' ' HB3' ' B' ' 4' ' ' GLU . 91.8 Cg_endo -69.89 150.57 67.58 Favored 'Trans proline' 0 C--N 1.35 0.648 0 CA-C-N 124.038 2.478 . . . . 2.72 111.669 -169.722 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 49.3 mt -120.97 -100.22 0.43 Allowed 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 114.338 1.236 . . . . 2.64 114.338 -162.402 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 2.0 t -166.28 -111.02 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 120.944 1.702 . . . . 2.71 112.991 -166.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -125.28 -72.74 0.65 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.762 2.025 . . . . 2.35 110.434 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.9 mt -48.89 -49.51 39.42 Favored 'General case' 0 C--O 1.233 0.209 0 O-C-N 121.656 -0.653 . . . . 1.32 110.798 175.59 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -44.29 -52.74 7.3 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.185 0.994 . . . . 3.89 112.515 171.287 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -57.38 -36.81 71.72 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 119.235 0.925 . . . . 4.61 110.396 178.619 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 3.8 t -63.01 -50.14 71.9 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 122.947 0.499 . . . . 1.86 110.606 178.154 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.3 2.6 pp -61.44 -35.24 65.37 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 O-C-N 121.335 -0.853 . . . . 0.95 110.979 173.873 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -58.95 -57.78 11.57 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.874 -0.584 . . . . 3.11 110.145 174.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.8 t -52.49 -38.54 59.71 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.618 1.099 . . . . 1.31 111.685 -170.756 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 26.2 m -73.93 -39.82 51.96 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 O-C-N 121.414 -0.804 . . . . 0.95 111.492 175.499 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 38.4 t -57.73 -48.34 83.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 119.092 0.86 . . . . 1.1 111.015 173.339 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.1 t -64.38 -38.89 92.61 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.567 1.076 . . . . 1.32 110.856 177.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 85.8 m -58.16 -52.95 63.4 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 120.022 1.283 . . . . 1.23 109.666 174.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -47.26 -54.76 10.07 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.208 1.003 . . . . 3.71 110.279 173.144 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -55.2 -46.47 75.87 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.809 1.244 . . . . 3.91 111.329 -179.149 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 58.8 m -54.45 -44.27 72.36 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.403 0.681 . . . . 3.2 110.052 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -68.04 -47.3 68.76 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 120.457 -0.497 . . . . 3.09 110.959 171.357 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.45 -30.68 65.21 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.77 1.628 . . . . 1.21 111.467 -170.147 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 -19.32 64.79 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 118.153 -0.927 . . . . 3.78 112.665 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.456 ' HB3' ' HG3' ' B' ' 37' ' ' GLU . 2.3 tt0 -56.16 -68.13 0.24 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 117.902 -1.047 . . . . 3.75 111.562 -160.753 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -74.82 0.47 Allowed 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 114.433 1.272 . . . . 4.49 114.433 -162.847 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.77 160.16 27.37 Favored Glycine 0 N--CA 1.442 -0.924 0 C-N-CA 127.637 2.542 . . . . 1.89 109.906 156.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 36.56 104.95 0.0 OUTLIER 'General case' 0 C--O 1.237 0.42 0 N-CA-C 115.961 1.837 . . . . 5.26 115.961 140.556 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -69.01 46.13 0.06 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.866 1.266 . . . . 3.47 114.331 174.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -128.29 -58.2 1.2 Allowed 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 126.481 1.913 . . . . 3.53 106.341 168.726 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 2.1 p -94.15 146.49 23.95 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 125.209 1.403 . . . . 2.21 112.463 -166.101 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -102.95 154.27 19.39 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 126.094 1.757 . . . . 2.1 107.894 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 11.1 t -154.49 176.8 11.92 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 107.512 -1.292 . . . . 2.61 107.512 169.105 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 11.3 p -84.47 53.74 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-O 121.862 0.839 . . . . 2.73 111.188 -170.008 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.65 54.75 0.48 Allowed 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 105.895 -1.891 . . . . 2.5 105.895 149.153 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.456 ' HG3' ' HB3' ' B' ' 26' ' ' GLN . 1.8 tt0 -172.38 -52.61 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.292 1.837 . . . . 2.22 106.532 -170.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.46 ' CZ ' HD13 ' B' ' 63' ' ' LEU . 3.7 t80 -55.96 -57.82 10.47 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.564 -1.198 . . . . 2.03 109.771 173.375 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -56.22 -34.29 66.18 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.882 -0.599 . . . . 4.43 111.302 -175.478 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -54.31 -38.25 65.75 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.337 0.655 . . . . 3.45 110.765 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tt -67.15 -49.43 64.81 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.83 -0.804 . . . . 2.29 108.83 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 10.7 m -70.27 -35.08 61.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.295 -0.866 . . . . 0.93 110.155 -174.054 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 86.7 m -69.93 -50.79 38.58 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.018 0.927 . . . . 0.94 110.619 176.939 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -75.65 -61.52 1.89 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.565 0.746 . . . . 2.44 111.135 -169.696 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -80.79 -53.48 6.45 Favored 'General case' 0 C--O 1.227 -0.101 0 CA-C-O 121.343 0.592 . . . . 4.39 109.715 -175.384 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.61 -16.37 0.23 Allowed Pre-proline 0 CA--C 1.541 0.633 1 N-CA-C 121.857 4.021 . . . . 2.49 121.857 -144.985 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -48.96 -43.22 36.38 Favored 'Trans proline' 0 C--N 1.349 0.576 0 CA-C-N 123.473 2.276 . . . . 3.19 115.56 -149.387 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 65.4 t-80 -75.41 59.5 1.08 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.938 0.79 . . . . 2.62 110.669 173.432 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.566 HD23 ' HB2' ' B' ' 83' ' ' LEU . 10.3 tp -164.13 -91.57 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.209 1.404 . . . . 1.67 107.227 175.414 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 80.5 mt -78.79 86.98 4.68 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 120.968 -1.083 . . . . 2.08 109.126 171.113 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.33 169.51 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.386 -1.279 . . . . 6.42 111.566 153.041 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 88.78 5.12 0.19 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 127.446 2.299 . . . . 5.32 112.025 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 24.7 m -50.6 -34.09 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.96 0.904 . . . . 1.93 112.543 -175.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -49.83 -33.62 20.45 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.623 1.106 . . . . 3.25 112.992 175.657 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 8.3 t -130.71 57.15 1.74 Allowed 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.444 -0.947 . . . . 3.94 108.444 170.102 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -44.23 -39.18 4.25 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 124.645 1.178 . . . . 1.06 109.878 167.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -30.81 -47.68 0.1 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.331 2.653 . . . . 4.06 113.134 168.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -61.75 -52.47 64.08 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.073 0.464 . . . . 3.17 110.505 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.97 -47.97 81.37 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 107.963 -1.125 . . . . 3.6 107.963 177.618 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -50.15 -52.49 34.84 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 123.464 0.706 . . . . 1.72 110.295 179.023 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 17.8 ttmm -60.13 -44.13 95.15 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 122.305 -0.247 . . . . 2.94 110.911 178.717 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 16.1 m -63.22 -28.79 70.28 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.379 0.672 . . . . 2.29 112.394 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.46 HD13 ' CZ ' ' B' ' 38' ' ' PHE . 26.2 mt -80.04 -57.15 3.77 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.353 1.061 . . . . 1.16 110.231 178.686 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -58.34 -9.76 1.72 Allowed 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 126.96 2.104 . . . . 1.63 116.487 -166.315 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 65' ' ' VAL . . . . . 0.403 HG13 ' H ' ' B' ' 65' ' ' VAL . 27.7 m -34.06 -19.47 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 130.869 3.668 . . . . 1.59 119.705 -140.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 7.8 p-10 -61.61 -22.71 65.48 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 121.314 1.87 . . . . 3.12 111.397 162.076 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 61.25 62.18 1.42 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 125.979 1.712 . . . . 2.96 111.099 175.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 38.9 p30 -105.84 -15.94 14.79 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.662 1.585 . . . . 2.25 110.954 174.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 74.31 9.42 4.45 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.366 1.466 . . . . 2.6 111.968 -173.3 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -111.03 101.93 10.43 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 105.915 -1.883 . . . . 3.65 105.915 171.098 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -75.66 108.93 8.84 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 106.653 -1.61 . . . . 1.09 106.653 174.314 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -83.98 160.28 21.07 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.436 1.894 . . . . 4.17 109.356 -176.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -86.05 52.68 2.55 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.775 -0.578 . . . . 4.2 111.933 172.978 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -159.37 48.65 0.31 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.881 -1.155 . . . . 2.24 107.881 114.606 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -93.31 -61.72 1.51 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.685 1.594 . . . . 2.15 107.779 142.904 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -48.54 -46.05 38.28 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 125.816 1.646 . . . . 3.69 111.011 -175.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.68 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 50.1 t90 -49.79 -36.48 26.41 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 123.883 0.74 . . . . 3.56 112.455 -169.812 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -42.24 -40.1 2.3 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.969 0.908 . . . . 4.38 111.91 173.645 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 10.6 tp -53.59 -45.28 69.93 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.212 1.005 . . . . 0.83 111.888 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 59.2 mt -64.3 -31.26 52.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 N-CA-C 107.211 -1.403 . . . . 1.46 107.211 178.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.559 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -64.59 -48.29 74.56 Favored Glycine 0 CA--C 1.492 -1.398 0 C-N-CA 125.894 1.711 . . . . 1.33 112.079 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -66.59 -62.72 1.31 Allowed 'General case' 0 N--CA 1.425 -1.708 0 CA-C-O 117.294 -1.336 . . . . 2.39 107.648 177.026 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.566 ' HB2' HD23 ' B' ' 49' ' ' LEU . 3.4 pp -54.47 -35.29 62.9 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 120.48 1.491 . . . . 1.83 113.041 -175.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.69 -61.63 2.38 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.347 0.522 . . . . 1.64 110.435 170.394 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -65.96 -31.95 73.16 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 117.763 -1.113 . . . . 1.68 111.79 -171.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -42.73 -38.09 1.97 Allowed 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 128.335 2.654 . . . . 2.74 111.226 175.806 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 2.7 tt -50.56 -40.49 19.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 122.622 0.369 . . . . 1.31 110.216 177.099 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.4 -59.51 2.36 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.983 2.113 . . . . 5.2 112.738 166.804 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 14.1 tttt -68.19 63.08 0.09 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 129.247 3.019 . . . . 6.82 111.672 -172.022 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -80.94 -19.84 43.34 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.409 -0.807 . . . . 6.02 111.05 169.053 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.19 -42.36 4.65 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.017 1.727 . . . . 10.51 110.699 -167.195 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.03 72.46 5.55 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.909 1.284 . . . . 4.28 111.357 -160.096 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 12.1 tp -104.05 -55.72 2.32 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 127.693 2.397 . . . . 7.38 109.544 178.611 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 12.0 mttp -74.62 72.14 1.93 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.576 0.75 . . . . 9.22 112.252 -170.435 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 2.3 pp -73.68 168.25 2.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 123.044 0.537 . . . . 6.35 110.567 167.529 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -163.52 166.24 22.8 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 107.025 -1.472 . . . . 7.18 107.025 -178.549 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -176.92 138.11 0.25 Allowed 'General case' 0 C--O 1.235 0.329 0 C-N-CA 126.372 1.869 . . . . 6.77 108.381 178.607 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? . . . . . 0 C--O 1.253 1.243 0 CA-C-O 117.486 -1.245 . . . . 10.14 107.767 159.636 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.8 mtt . . . . . 0 N--CA 1.473 0.725 0 N-CA-C 107.751 -1.203 . . . . 8.62 107.751 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.88 -170.94 0.18 Allowed 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 124.062 0.851 . . . . 4.04 110.24 163.289 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 102.37 80.29 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 128.836 2.855 . . . . 3.22 107.969 -159.527 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -81.78 147.45 58.75 Favored Pre-proline 0 N--CA 1.45 -0.427 0 C-N-CA 124.163 0.985 . . . . 5.36 110.701 -173.658 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.24 103.62 1.43 Allowed 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.761 2.308 . . . . 2.52 109.128 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -61.41 152.82 28.67 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 108.124 -1.065 . . . . 1.3 108.124 169.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.4 t -71.25 173.51 7.64 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 119.867 -0.733 . . . . 1.77 109.564 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -65.45 -59.76 3.67 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 121.536 -0.728 . . . . 3.01 110.101 -171.937 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.6 mp -55.33 -42.26 73.55 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 121.628 -0.67 . . . . 1.47 110.188 -176.817 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -53.25 -54.35 37.5 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.733 2.013 . . . . 2.13 111.655 171.925 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.03 -49.94 70.31 Favored 'General case' 0 C--N 1.341 0.204 0 N-CA-C 108.877 -0.786 . . . . 5.4 108.877 178.927 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.1 m -65.6 -46.85 77.78 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 111.765 0.283 . . . . 1.99 111.765 -175.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 pp -65.51 -34.77 72.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 O-C-N 120.969 -1.082 . . . . 0.91 108.878 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -60.3 -55.0 38.99 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.864 0.757 . . . . 2.99 109.351 170.118 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -51.53 -40.1 58.99 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.857 0.863 . . . . 1.13 111.686 -174.48 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 m -74.8 -41.18 47.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 O-C-N 120.971 -1.081 . . . . 0.71 111.4 173.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 40.2 t -57.53 -48.24 83.45 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 119.588 1.085 . . . . 0.71 111.535 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -59.32 -43.1 92.73 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 119.666 1.121 . . . . 0.63 110.455 178.126 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 60.1 m -59.22 -54.71 43.78 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.179 0.514 . . . . 0.73 109.78 176.886 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.421 ' CE2' HD23 ' A' ' 33' ' ' LEU . 2.2 t80 -44.15 -52.15 7.53 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.994 1.318 . . . . 3.07 110.676 171.144 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 26.9 t80 -66.2 -49.35 67.6 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.908 1.283 . . . . 2.79 110.691 -171.486 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 t -62.91 -36.95 85.07 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 110.093 -0.336 . . . . 2.1 110.093 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -64.52 -48.17 76.11 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 118.539 0.608 . . . . 2.61 111.236 169.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -52.76 -35.37 56.25 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 125.235 1.414 . . . . 0.84 110.998 -171.695 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -59.16 -34.29 71.93 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 126.427 1.891 . . . . 5.53 112.818 177.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -46.17 -61.63 1.69 Allowed 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.451 1.023 . . . . 2.34 112.738 -167.054 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -104.92 114.02 27.97 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 128.524 2.73 . . . . 2.92 106.375 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 40.17 99.99 0.01 OUTLIER Glycine 0 CA--C 1.533 1.204 0 C-N-CA 126.36 1.933 . . . . 1.76 116.432 162.232 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 72.93 106.47 0.07 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.554 0.742 . . . . 4.87 112.899 168.744 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.0 pttt -66.59 18.78 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 115.913 1.82 . . . . 4.54 115.913 178.865 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.3 p-10 -89.16 -34.32 16.74 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.816 1.246 . . . . 4.26 109.53 162.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.7 p -83.86 128.6 34.65 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.471 1.109 . . . . 3.2 110.834 -171.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.421 HD23 ' CE2' ' A' ' 20' ' ' PHE . 2.7 mm? -86.09 123.6 31.58 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 107.338 -1.356 . . . . 1.98 107.338 151.402 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.1 m -109.53 176.05 5.22 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 126.318 1.847 . . . . 3.71 109.074 -171.935 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 71.4 t -63.69 -49.65 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 O-C-N 121.814 -0.554 . . . . 2.69 111.519 -167.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -70.12 -48.89 55.65 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.272 -1.01 . . . . 2.28 108.272 -176.612 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -42.67 -53.54 4.44 Favored 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 124.672 1.189 . . . . 1.81 112.343 173.682 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.01 -56.05 14.41 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.184 -0.673 . . . . 2.45 109.184 176.892 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 30.4 ttmt -58.61 -39.1 79.49 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 120.283 -0.567 . . . . 2.78 111.766 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -54.55 -38.85 67.11 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.615 0.643 . . . . 3.2 111.755 176.302 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -61.07 -54.03 49.77 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 107.582 -1.266 . . . . 2.48 107.582 -177.173 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 16.4 m -68.98 -40.88 81.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 114.581 -1.19 . . . . 1.14 109.852 -170.245 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 98.1 m -59.99 -51.91 67.65 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 124.197 0.999 . . . . 1.9 110.61 174.811 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -74.16 -57.18 4.13 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.425 0.29 . . . . 3.23 110.976 -170.375 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -136.43 68.11 1.44 Allowed 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.669 0.387 . . . . 4.07 111.907 -177.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.3 tp -155.9 56.32 1.28 Allowed Pre-proline 0 CA--C 1.54 0.562 0 O-C-N 121.538 -0.727 . . . . 1.8 111.062 161.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -63.34 -61.12 0.14 Allowed 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 123.835 3.023 . . . . 1.85 112.715 -170.526 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -84.64 -51.62 6.71 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 119.351 0.978 . . . . 3.91 110.38 -172.261 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -31.9 -62.3 0.21 Allowed 'General case' 0 C--O 1.234 0.28 0 C-N-CA 126.402 1.881 . . . . 1.54 113.506 -172.469 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.5 mt -125.59 54.5 1.48 Allowed 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.047 1.339 . . . . 2.06 108.399 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.75 3.6 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 116.913 2.19 . . . . 5.14 116.913 -175.145 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -109.04 46.3 0.99 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.543 1.537 . . . . 4.8 107.331 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.9 m -55.85 -17.52 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 C-N-CA 125.766 1.627 . . . . 2.07 112.567 -176.361 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -44.43 -44.91 8.22 Favored Glycine 0 CA--C 1.532 1.135 0 N-CA-C 110.912 -0.875 . . . . 1.43 110.912 167.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.7 t -91.84 31.55 1.22 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 117.213 0.507 . . . . 2.25 112.088 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.402 HD13 ' C ' ' A' ' 56' ' ' LEU . 3.0 tm? -52.61 -43.75 65.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 121.419 -0.801 . . . . 1.34 109.21 168.118 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -39.9 -57.35 1.61 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.982 1.313 . . . . 3.55 111.565 170.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.2 tp10 -60.12 -51.33 70.05 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 116.485 -0.325 . . . . 5.26 110.253 -178.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.92 -39.88 75.28 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 118.92 -1.112 . . . . 6.36 110.628 -179.259 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -57.3 -57.4 12.81 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 122.848 0.459 . . . . 1.51 110.673 176.277 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.13 -33.48 74.56 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 120.394 -0.522 . . . . 4.0 111.218 -176.502 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.3 t -59.45 -50.93 72.03 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.289 1.436 . . . . 1.79 110.997 172.102 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.8 mp -63.76 -50.09 70.4 Favored 'General case' 0 C--O 1.239 0.547 0 O-C-N 121.385 -0.822 . . . . 1.75 111.562 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -80.07 71.5 6.8 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 121.0 -0.28 . . . . 1.72 110.478 -167.369 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.8 m -49.53 -40.36 14.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.644 1.177 . . . . 2.06 113.525 -174.274 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -82.5 -8.64 59.61 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 123.519 0.728 . . . . 1.9 112.504 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 55.92 50.39 14.03 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.766 1.626 . . . . 3.42 110.426 168.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.5 p30 -100.49 -12.46 19.3 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.766 1.626 . . . . 2.01 110.96 179.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 20.7 m 72.43 17.41 4.76 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 125.893 1.677 . . . . 1.57 111.864 -179.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -116.06 113.26 22.94 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 106.11 -1.811 . . . . 3.96 106.11 163.792 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.82 89.07 7.12 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 104.543 -2.391 . . . . 1.05 104.543 173.38 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.9 tttp -75.87 158.04 32.58 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.921 -0.77 . . . . 4.83 108.921 -176.15 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -38.63 -61.07 0.75 Allowed 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.099 1.148 . . . . 4.76 114.099 -163.551 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -69.23 -26.55 64.85 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.684 -0.635 . . . . 2.26 112.209 -177.156 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -68.52 -59.69 2.97 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.639 -0.874 . . . . 2.07 108.639 171.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -56.37 -38.84 71.99 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 118.786 -0.626 . . . . 3.28 111.057 -175.855 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.495 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 0.1 OUTLIER -38.19 -45.19 0.92 Allowed 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 116.609 -1.662 . . . . 5.56 107.85 174.75 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 48.3 mtm-85 -38.55 -44.96 1.01 Allowed 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.85 1.659 . . . . 5.9 112.529 -179.036 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 23.5 tp -52.05 -56.97 11.01 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 120.593 1.542 . . . . 0.99 111.75 174.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 19.1 mm -59.44 -38.97 77.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 C-N-CA 126.403 1.881 . . . . 1.87 108.245 -179.172 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.58 -56.88 11.7 Favored Glycine 0 N--CA 1.437 -1.245 0 N-CA-C 108.497 -1.841 . . . . 1.93 108.497 172.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -63.51 -49.67 72.62 Favored 'General case' 0 N--CA 1.438 -1.056 0 C-N-CA 125.804 1.642 . . . . 2.65 108.617 -171.906 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 21.5 mt -42.34 -53.53 4.14 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 119.451 1.023 . . . . 2.0 112.12 -173.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.32 -35.18 62.4 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.97 1.308 . . . . 1.29 112.665 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.4 ttpp -77.7 -51.25 10.88 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.461 -0.774 . . . . 1.79 110.233 172.958 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.6 mm-40 -60.99 -30.74 70.46 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.059 0.943 . . . . 4.17 112.243 -171.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 5.2 tt -56.61 -40.21 67.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 119.046 0.839 . . . . 1.29 110.736 170.473 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.92 -55.52 5.69 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.422 -0.955 . . . . 4.98 108.422 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 3.8 tttm -85.11 47.33 1.39 Allowed 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 126.617 1.967 . . . . 3.59 109.897 -170.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.61 -56.99 2.41 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 124.574 1.15 . . . . 7.02 113.388 -163.954 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 62.5 mttt -156.47 53.85 0.54 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 105.565 -2.013 . . . . 8.98 105.565 163.885 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -75.43 61.35 1.25 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.415 1.486 . . . . 5.15 112.085 -165.74 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -164.45 26.07 0.07 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.353 1.061 . . . . 8.93 111.402 174.001 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 5.6 ptpt 177.15 -170.2 0.08 Allowed 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.071 1.748 . . . . 11.03 107.911 -176.269 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 0.402 11.3 tt 49.25 -129.14 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 116.331 -1.795 . . . . 8.91 110.799 -167.964 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -122.98 -67.1 0.97 Allowed 'General case' 0 C--N 1.342 0.28 0 CA-C-N 122.313 2.324 . . . . 13.47 111.768 -172.382 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 49.5 mtmt -175.85 48.81 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 128.194 2.598 . . . . 12.18 105.137 -167.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . 2.438 35.1 tttm . . . . . 0 C--O 1.259 1.599 0 N-CA-C 104.148 -2.538 . . . . 11.64 104.148 -142.55 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 109.092 -0.707 . . . . 6.03 109.092 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.432 . . 76.21 -159.0 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 109.588 -0.523 . . . . 4.22 109.588 -169.939 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.58 93.31 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 128.458 2.703 . . . . 4.93 110.222 -176.722 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.518 ' HB3' ' CD ' ' B' ' 5' ' ' PRO 0.271 30.8 tt0 -102.54 -97.12 0.0 OUTLIER Pre-proline 0 CA--C 1.553 1.078 0 CA-C-O 116.639 -1.648 . . . . 6.22 111.902 -171.114 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 5' ' ' PRO . . . . . 0.518 ' CD ' ' HB3' ' B' ' 4' ' ' GLU . 62.4 Cg_endo -79.25 156.21 25.74 Favored 'Trans proline' 0 C--N 1.352 0.72 0 CA-C-N 123.92 2.436 . . . . 2.83 111.085 -177.391 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 53.2 mt -140.75 163.7 32.19 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.638 1.175 . . . . 2.71 110.474 -166.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 14.0 t -94.39 -167.98 1.76 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 124.642 1.177 . . . . 1.82 108.971 164.389 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -71.83 -63.74 1.07 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.598 0.759 . . . . 2.53 112.765 -169.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 28.0 mt -50.77 -51.32 51.49 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 120.62 1.554 . . . . 1.16 111.26 173.481 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -51.98 -41.37 62.08 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.897 2.479 . . . . 3.39 110.416 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -64.73 -58.57 5.9 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.203 1.401 . . . . 4.35 110.437 171.162 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 86.0 p -53.89 -36.07 62.28 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.409 -0.807 . . . . 1.35 112.292 -172.447 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.9 -32.95 46.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 O-C-N 121.952 -0.467 . . . . 1.07 112.185 174.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.97 -54.11 43.52 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 119.261 0.937 . . . . 3.63 109.047 170.503 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.2 m -38.75 -51.69 1.7 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.498 1.119 . . . . 2.31 111.663 -178.64 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 34.2 m -70.57 -39.46 76.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 121.098 -1.002 . . . . 0.86 111.99 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 55.6 t -57.1 -54.11 34.52 Favored 'Isoleucine or valine' 0 C--N 1.339 0.114 0 CA-C-N 118.655 0.661 . . . . 1.16 109.859 174.842 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -59.24 -46.42 88.53 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.47 0.577 . . . . 1.09 110.798 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 96.7 m -55.26 -51.52 66.37 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.014 -1.054 . . . . 1.17 110.627 174.784 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -51.47 -47.2 63.25 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.67 -0.644 . . . . 6.89 111.442 173.795 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -57.68 -48.36 79.76 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.586 1.154 . . . . 2.61 111.227 -179.235 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 81.4 p -57.27 -37.44 72.37 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.767 -0.583 . . . . 2.09 111.143 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -72.44 -40.67 66.89 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 118.145 0.43 . . . . 3.18 110.568 173.026 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -51.73 -37.56 51.54 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 125.868 1.667 . . . . 1.09 110.025 -176.43 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -55.18 -29.72 58.44 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 118.081 -0.962 . . . . 4.03 112.088 -178.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.431 ' HB2' ' HG2' ' B' ' 37' ' ' GLU . 0.0 OUTLIER -51.73 -65.61 0.53 Allowed 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 114.786 1.402 . . . . 1.86 114.786 -151.921 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -91.02 -77.35 0.42 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 119.082 -1.047 . . . . 3.98 113.521 -166.024 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.71 159.27 24.68 Favored Glycine 0 C--N 1.337 0.593 0 C-N-CA 127.279 2.371 . . . . 1.89 109.86 153.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 80.4 mtt-85 49.51 102.91 0.01 OUTLIER 'General case' 0 C--O 1.242 0.706 0 N-CA-C 115.127 1.529 . . . . 3.76 115.127 142.043 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -67.99 32.62 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.775 2.03 . . . . 3.16 114.473 173.444 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -144.41 -58.47 0.37 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 106.911 -1.515 . . . . 4.12 106.911 -164.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 32.4 p -79.18 111.68 15.64 Favored 'General case' 0 N--CA 1.438 -1.042 0 N-CA-C 107.345 -1.354 . . . . 2.02 107.345 168.6 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -57.55 135.16 56.62 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 106.993 -1.484 . . . . 1.96 106.993 162.061 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 13.0 m -109.65 152.36 25.68 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.84 1.256 . . . . 3.47 108.952 -174.21 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 10.4 p -87.6 49.15 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 O-C-N 120.254 -1.529 . . . . 2.4 110.83 -179.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -157.75 52.71 0.46 Allowed 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 106.08 -1.822 . . . . 2.18 106.08 138.639 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.431 ' HG2' ' HB2' ' B' ' 26' ' ' GLN . 70.2 mt-10 -131.74 -49.32 0.96 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 130.963 3.705 . . . . 1.73 105.233 161.958 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -50.28 -57.16 8.47 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 120.506 -0.478 . . . . 2.91 110.09 171.587 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . 0.292 15.7 ttmt -59.73 -41.81 91.75 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-O 117.94 -1.029 . . . . 2.73 111.522 -178.413 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -50.5 -48.71 56.81 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 119.461 1.028 . . . . 3.26 110.267 173.365 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.97 -46.58 77.55 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.507 -0.923 . . . . 1.73 108.507 -169.997 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.0 m -68.93 -44.41 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 C-N-CA 120.728 -0.389 . . . . 0.78 110.294 -176.637 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 86.1 m -58.63 -50.27 74.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.567 0.747 . . . . 1.26 110.466 178.047 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -80.14 -59.65 2.63 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 123.585 0.754 . . . . 2.01 110.981 -169.286 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -75.54 -50.58 15.22 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 113.143 0.794 . . . . 3.23 113.143 -169.056 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.08 -27.91 3.57 Favored Pre-proline 0 CA--C 1.539 0.523 0 N-CA-C 115.248 1.574 . . . . 1.79 115.248 -151.266 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -63.56 -12.1 29.4 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 121.824 -2.157 . . . . 2.39 111.046 -68.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 35.2 t60 -113.64 -32.44 6.17 Favored 'General case' 0 C--N 1.344 0.347 0 C-N-CA 125.736 1.614 . . . . 2.57 111.373 -174.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 23.3 tp -50.77 -51.99 45.09 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.399 0.545 . . . . 1.37 110.22 -175.298 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 98.1 mt -99.89 140.77 33.62 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 105.694 -1.965 . . . . 2.1 105.694 153.943 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.0 28.29 2.13 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 126.756 2.022 . . . . 4.98 108.273 -167.192 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -142.47 32.22 1.48 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 125.858 1.663 . . . . 6.1 108.562 -156.646 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 11.4 m -74.7 -10.58 13.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 C-N-CA 125.599 1.56 . . . . 1.7 112.711 -173.759 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.91 -65.32 3.48 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 107.165 -2.374 . . . . 2.45 107.165 162.279 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 2.4 p -72.01 40.01 0.07 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.016 2.126 . . . . 3.69 112.724 175.986 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -64.26 -30.01 71.08 Favored 'General case' 0 N--CA 1.441 -0.887 0 O-C-N 120.986 -1.071 . . . . 1.23 108.205 165.876 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.1 -52.78 32.04 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.942 -0.551 . . . . 4.5 110.302 173.823 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -47.17 -59.5 3.11 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 124.023 0.929 . . . . 3.3 109.351 175.376 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 7.6 mmpt? -60.75 -51.38 69.57 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.047 -0.524 . . . . 4.69 109.752 -172.234 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.5 ttp -56.0 -47.05 78.46 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 123.259 0.624 . . . . 2.08 110.419 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -60.62 -40.8 93.2 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.738 1.215 . . . . 4.13 110.355 179.257 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 20.0 m -71.43 -31.21 66.95 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.868 0.867 . . . . 1.48 112.269 175.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 22.2 mt -73.04 -55.33 6.67 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.988 0.915 . . . . 1.52 109.54 179.032 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 64' ' ' ASP . . . . . 0.411 ' O ' ' N ' ' B' ' 66' ' ' ASN . 23.8 t70 -71.04 -10.45 59.77 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.628 2.371 . . . . 1.55 116.892 -161.162 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 24.7 m -33.26 -17.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 131.626 3.971 . . . . 1.69 119.36 -142.222 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 66' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' B' ' 64' ' ' ASP . 2.3 m120 -40.63 -43.69 1.97 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.831 1.196 . . . . 2.27 110.559 151.366 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 65.53 61.16 0.7 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.324 1.45 . . . . 2.86 109.677 -170.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 18.0 p30 -119.63 -16.45 8.83 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.059 2.144 . . . . 2.27 113.0 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 8.2 t 74.44 5.24 4.55 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.384 1.874 . . . . 3.4 114.47 -178.7 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -106.21 109.72 21.74 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 124.991 1.316 . . . . 3.52 107.791 166.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -90.63 89.36 7.5 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.681 0.792 . . . . 1.27 108.918 -179.015 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 3.3 ttpp -84.79 177.48 7.99 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 128.082 2.553 . . . . 3.53 112.08 -171.552 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -82.03 53.42 2.21 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.493 -1.38 . . . . 4.48 113.869 -168.314 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -168.19 51.62 0.05 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 124.841 2.258 . . . . 2.6 106.12 122.624 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -95.6 -63.25 1.18 Allowed 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 126.93 2.092 . . . . 2.07 108.815 150.576 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -68.8 -26.34 65.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.308 -1.315 . . . . 6.51 112.824 -165.409 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.504 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 0.0 OUTLIER -45.13 -50.1 11.46 Favored 'General case' 0 C--N 1.347 0.472 0 N-CA-C 107.58 -1.267 . . . . 4.78 107.58 170.7 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 75.5 mtm-85 -48.12 -36.41 13.27 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-O 117.203 -1.379 . . . . 6.02 113.402 -165.054 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 5.4 tp -53.63 -51.42 63.16 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 120.923 1.692 . . . . 0.99 111.299 174.733 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 24.5 mt -63.74 -40.18 88.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 126.045 1.738 . . . . 1.42 107.587 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -45.27 -54.79 7.04 Favored Glycine 0 N--CA 1.443 -0.85 0 N-CA-C 108.891 -1.683 . . . . 1.94 108.891 171.51 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 82' ' ' GLU . . . . . 0.411 ' OE2' ' NZ ' ' B' ' 85' ' ' LYS . 1.1 mm-40 -68.0 -53.71 23.97 Favored 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 125.964 1.706 . . . . 2.18 109.004 -172.812 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 18.3 mt -40.31 -49.18 2.74 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.18 1.392 . . . . 2.24 111.401 -177.104 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -47.1 -45.17 21.89 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.489 0.716 . . . . 1.66 111.687 177.241 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 85' ' ' LYS . . . . . 0.411 ' NZ ' ' OE2' ' B' ' 82' ' ' GLU . 0.7 OUTLIER -81.06 -37.98 28.14 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.651 0.612 . . . . 1.39 112.651 172.324 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -65.68 -21.14 66.52 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.388 0.994 . . . . 3.3 112.508 -172.388 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 1.9 tp -45.33 -45.31 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 O-C-N 120.92 -1.113 . . . . 1.28 109.217 165.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.4 -54.29 5.59 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.191 0.996 . . . . 6.01 111.035 174.609 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 68.1 mttt -87.9 122.49 31.59 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 125.454 1.502 . . . . 4.73 112.072 -171.563 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 11.0 mptt -83.98 -36.93 22.84 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 120.494 -1.379 . . . . 7.84 110.728 -176.283 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -148.89 -1.5 0.49 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.692 1.197 . . . . 6.07 111.72 -176.351 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -97.68 53.54 1.13 Allowed 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.527 -0.733 . . . . 5.57 110.361 -138.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.419 ' HG ' ' N ' ' B' ' 94' ' ' LYS . 1.6 pt? -125.02 -73.87 0.63 Allowed 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.333 0.864 . . . . 5.57 113.333 -175.556 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 94' ' ' LYS . . . . . 0.419 ' N ' ' HG ' ' B' ' 93' ' ' LEU . 13.5 mptt 23.65 52.71 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 127.038 2.135 . . . . 8.83 113.517 -161.127 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 20.0 tt -76.02 110.05 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 N-CA-C 109.207 -0.664 . . . . 8.73 109.207 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.69 102.61 2.22 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.326 0.651 . . . . 7.92 109.447 -177.484 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 24.7 tptt -176.01 135.06 0.27 Allowed 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 106.845 -1.539 . . . . 6.79 106.845 -174.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 1.3 tmtm? . . . . . 0 C--O 1.254 1.298 0 N-CA-C 103.187 -2.894 . . . . 7.01 103.187 168.22 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.472 0.638 0 N-CA-C 105.913 -1.884 . . . . 8.28 105.913 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.11 167.81 15.3 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.932 0.787 . . . . 3.72 109.245 164.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 89.32 57.73 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 127.931 2.492 . . . . 4.57 108.75 -171.32 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLU . . . . . 0.4 ' CD ' ' H ' ' A' ' 4' ' ' GLU . 1.7 pm0 -68.75 114.74 24.61 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 125.397 1.479 . . . . 4.35 108.747 -175.213 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.77 105.48 2.09 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.407 2.071 . . . . 3.03 110.0 -173.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.72 160.71 26.14 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 108.206 -1.035 . . . . 2.82 108.206 168.427 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.456 HG23 ' H ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -64.15 154.99 32.99 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 121.056 -1.027 . . . . 2.87 110.388 -174.812 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -33.47 -48.29 0.25 Allowed 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 125.287 1.435 . . . . 2.11 112.297 160.666 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.2 mt -67.15 -45.01 78.35 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 118.257 -0.878 . . . . 1.27 110.223 -175.068 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.456 ' H ' HG23 ' A' ' 7' ' ' THR . 63.6 mt-10 -58.12 -53.35 59.24 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.519 1.527 . . . . 2.46 111.013 172.486 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -47.29 -60.35 2.55 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.366 1.066 . . . . 3.36 109.017 176.334 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.4 p -60.67 -49.12 78.79 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.732 0.642 . . . . 1.4 112.732 -177.347 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.254 2.4 pp -62.38 -38.79 82.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 O-C-N 120.854 -1.154 . . . . 0.59 109.99 -177.074 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -62.32 -48.79 78.28 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 119.736 -0.785 . . . . 3.36 110.699 173.226 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -55.98 -40.66 73.63 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.755 0.788 . . . . 1.22 111.652 -176.953 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.8 m -75.2 -36.94 38.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 O-C-N 120.573 -1.329 . . . . 0.78 111.088 176.417 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.4 t -56.42 -46.69 82.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 119.592 1.087 . . . . 0.61 110.648 174.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.3 t -64.76 -43.08 94.47 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.565 -0.709 . . . . 0.79 110.877 178.435 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.8 m -57.55 -51.99 67.25 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.487 0.585 . . . . 0.93 110.068 176.88 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -45.74 -56.6 5.1 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 124.052 0.941 . . . . 3.19 109.883 170.456 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -53.14 -51.61 61.4 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 123.441 0.696 . . . . 3.51 111.543 -175.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.9 t -60.38 -36.72 78.72 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 120.1 -0.64 . . . . 2.4 111.571 -178.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -69.92 -39.91 75.86 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 119.901 1.228 . . . . 2.5 111.096 171.22 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.02 -31.7 71.32 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 121.072 -1.017 . . . . 1.14 111.525 -168.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -80.02 -18.33 50.49 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 117.494 -1.241 . . . . 4.12 113.537 -178.6 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -45.24 -60.97 1.84 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.848 1.204 . . . . 1.69 113.787 -170.732 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -111.42 92.09 3.91 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 127.408 2.283 . . . . 2.93 106.116 -177.848 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 46.14 -168.21 0.05 OUTLIER Glycine 0 CA--C 1.527 0.821 0 C-N-CA 125.697 1.618 . . . . 1.59 112.693 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 48.7 mtm-85 27.65 91.79 0.01 OUTLIER 'General case' 0 C--O 1.24 0.574 0 C-N-CA 126.456 1.902 . . . . 6.16 112.525 166.282 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -79.6 53.28 1.55 Allowed 'General case' 0 C--O 1.232 0.142 0 C-N-CA 128.483 2.713 . . . . 4.48 108.662 -172.683 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -175.51 -60.79 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 106.945 -1.502 . . . . 4.02 106.945 -156.404 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.2 p -84.52 134.12 34.44 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-O 122.34 1.066 . . . . 2.15 112.141 170.671 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 71' ' ' LEU . 1.5 mm? -95.55 124.59 39.65 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.857 1.263 . . . . 2.47 108.506 176.803 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.6 t -82.61 173.83 11.59 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.355 1.462 . . . . 2.33 109.058 173.252 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 32.9 m -70.21 -42.86 79.07 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 O-C-N 122.014 -0.429 . . . . 2.93 110.82 -175.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -67.45 -49.05 65.37 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 118.272 -0.871 . . . . 1.82 109.643 176.224 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -39.77 -50.64 2.37 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.119 1.367 . . . . 2.22 110.307 168.506 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -57.67 -59.11 5.69 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.861 -0.609 . . . . 2.67 110.95 175.21 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -52.09 -42.17 63.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.522 -0.308 . . . . 3.49 111.18 -176.095 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -51.89 -42.37 62.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 123.256 0.622 . . . . 3.17 111.459 177.941 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -63.08 -50.14 71.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 119.303 0.956 . . . . 2.95 108.788 -176.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.2 m -72.48 -32.24 41.08 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.168 0 CA-C-N 115.804 -0.635 . . . . 1.34 110.3 -172.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 92.7 m -75.42 -38.71 59.67 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.169 0.987 . . . . 1.41 110.735 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -79.86 -55.67 4.81 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.285 0.634 . . . . 2.18 110.239 -173.127 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -92.47 -126.74 0.09 Allowed 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.446 -0.946 . . . . 4.33 108.446 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.447 HD22 ' H ' ' A' ' 46' ' ' LEU . 2.9 mm? 29.5 63.46 0.82 Allowed Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 127.578 2.351 . . . . 2.5 114.499 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -71.58 -44.59 1.0 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.602 2.202 . . . . 1.74 112.298 -179.274 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -146.05 61.36 1.25 Allowed 'General case' 0 C--N 1.341 0.233 0 CA-C-N 118.907 0.776 . . . . 3.37 109.956 -172.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.497 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 3.8 tp -144.33 -113.67 0.1 Allowed 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 107.726 -1.213 . . . . 1.36 107.726 -176.483 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 76.9 mt -59.0 162.12 4.49 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.776 0.716 . . . . 2.22 109.186 162.056 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.38 -159.13 0.56 Allowed 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.889 0.875 . . . . 6.42 109.211 -166.018 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 55.07 37.15 28.45 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.828 1.251 . . . . 3.77 108.866 -175.178 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.43 -24.42 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 C-N-CA 126.124 1.77 . . . . 3.12 112.505 -167.679 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.93 -53.72 40.79 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 110.298 -1.121 . . . . 1.77 110.298 171.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 34.0 t -84.17 46.63 1.22 Allowed 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.554 0.742 . . . . 2.29 110.098 -174.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -53.68 -32.54 52.12 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.07 0.948 . . . . 1.44 110.116 -176.494 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -38.04 -47.72 1.13 Allowed 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 127.321 2.248 . . . . 3.71 113.158 175.329 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -64.21 -46.24 84.72 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.861 -0.524 . . . . 4.02 109.992 -175.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.29 -52.66 63.78 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.037 -1.097 . . . . 3.47 108.037 175.417 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -46.52 -56.72 5.57 Favored 'General case' 0 C--O 1.225 -0.196 0 C-N-CA 123.406 0.683 . . . . 1.83 111.061 177.759 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -66.19 -37.57 85.92 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.103 0.411 . . . . 3.35 111.329 -176.017 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.7 t -58.64 -45.17 89.86 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.982 -0.449 . . . . 1.97 110.602 173.711 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 19.2 mt -70.2 -58.93 3.23 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.726 0.81 . . . . 1.58 110.417 -176.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -78.61 75.64 5.12 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 124.074 0.949 . . . . 1.88 109.057 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.5 m -51.32 -28.16 7.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 123.417 0.687 . . . . 2.31 112.184 176.606 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -70.08 -33.6 72.1 Favored 'General case' 0 CA--C 1.529 0.156 0 O-C-N 121.989 -0.444 . . . . 3.11 110.91 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 53.15 53.67 11.54 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.739 1.215 . . . . 4.04 109.29 -161.149 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -102.35 -13.18 17.42 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.429 1.891 . . . . 1.86 111.525 176.1 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.9 m 66.17 17.57 10.77 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.073 1.349 . . . . 1.96 112.837 -177.0 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -111.56 112.12 23.62 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.751 -1.574 . . . . 3.12 106.751 158.351 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 33' ' ' LEU . 2.6 mm? -82.97 93.7 7.6 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 104.256 -2.498 . . . . 1.17 104.256 166.227 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.14 161.96 25.81 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.346 -0.983 . . . . 3.18 108.346 176.383 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.63 -60.54 0.95 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.57 1.148 . . . . 5.59 112.955 -169.073 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -69.15 -22.3 63.95 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.666 0.786 . . . . 1.92 111.68 -175.242 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -72.69 -56.67 4.95 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 118.448 0.567 . . . . 2.4 109.597 173.017 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -52.72 -48.77 66.44 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.301 -0.629 . . . . 2.7 109.301 178.097 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.669 ' HZ2' HG23 ' B' ' 80' ' ' ILE . 58.8 t-105 -46.66 -35.87 6.45 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.693 -1.139 . . . . 5.18 111.257 -179.02 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 77.9 mtt-85 -41.47 -45.86 3.31 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 120.182 1.356 . . . . 4.62 111.568 176.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 7.9 tp -49.94 -40.8 44.76 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 122.764 0.426 . . . . 0.93 110.408 -177.586 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.487 HG21 ' HZ3' ' A' ' 77' ' ' TRP . 25.7 mt -74.79 -26.14 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 N-CA-C 109.09 -0.707 . . . . 1.32 109.09 -174.915 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.434 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -56.37 -43.69 89.89 Favored Glycine 0 CA--C 1.501 -0.786 0 N-CA-C 109.83 -1.308 . . . . 1.17 109.83 164.453 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.411 ' OE2' ' NZ ' ' A' ' 85' ' ' LYS . 24.8 mm-40 -80.6 -30.77 36.83 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 117.687 -1.149 . . . . 3.11 110.546 -178.201 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.497 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 8.6 mp -54.38 -59.86 4.12 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 122.189 2.268 . . . . 2.42 108.391 167.756 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.58 -53.66 51.65 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.978 0.894 . . . . 1.35 110.6 -178.766 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 89' ' ' LYS . 4.6 ttpp -63.36 -40.71 98.02 Favored 'General case' 0 C--O 1.211 -0.954 0 CA-C-O 116.683 -1.627 . . . . 1.68 110.746 -178.261 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -51.09 -51.15 56.19 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 122.233 2.288 . . . . 3.23 108.834 178.091 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.8 mt -52.57 -47.39 48.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 N-CA-C 111.417 0.154 . . . . 2.01 111.417 171.529 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . 2.144 41.6 mtt85 -38.98 -58.38 1.12 Allowed 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 115.462 1.653 . . . . 7.6 115.462 161.393 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 75.3 tttt -81.05 162.02 23.94 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 127.374 2.27 . . . . 4.23 113.737 -127.496 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -45.26 -47.43 12.86 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 127.544 2.338 . . . . 15.15 113.163 -167.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.6 ttpt -133.49 22.97 4.02 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 117.74 -1.124 . . . . 9.13 111.165 -174.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.0 t70 24.36 -114.16 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.033 2.133 . . . . 8.36 111.854 173.323 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 24.9 tp -86.85 -39.23 16.05 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.614 1.565 . . . . 12.73 107.878 160.885 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -141.51 178.67 7.29 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 125.482 1.513 . . . . 11.25 107.483 171.061 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 47.0 mm -55.82 130.14 17.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 N-CA-C 107.191 -1.411 . . . . 9.12 107.191 147.058 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.69 -174.94 4.18 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 126.867 2.067 . . . . 13.79 105.449 -178.166 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -174.13 135.17 0.46 Allowed 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 105.032 -2.21 . . . . 12.85 105.032 -174.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 32.3 tptt . . . . . 0 C--O 1.251 1.133 0 N-CA-C 102.915 -2.994 . . . . 11.97 102.915 159.28 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.393 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.054 0 N-CA-C 109.866 -0.42 . . . . 6.65 109.866 . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -171.69 -169.07 0.65 Allowed 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.984 2.114 . . . . 5.14 107.613 -169.117 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 106.24 101.64 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 129.374 3.069 . . . . 5.82 114.605 -172.714 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.482 ' HB3' ' CD ' ' B' ' 5' ' ' PRO 0.338 8.0 tt0 179.53 -147.65 0.0 OUTLIER Pre-proline 0 CA--C 1.542 0.652 1 C-N-CA 132.227 4.211 . . . . 9.07 107.255 153.397 . . . . . . . . 4 3 . 1 . 015 nuclear build full ' B' B ' 5' ' ' PRO . . . . . 0.482 ' CD ' ' HB3' ' B' ' 4' ' ' GLU . 67.2 Cg_endo -56.29 135.25 69.1 Favored 'Trans proline' 0 C--N 1.353 0.795 0 CA-C-N 125.023 2.83 . . . . 2.89 112.88 -151.27 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -167.08 166.35 15.19 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.912 0.885 . . . . 5.04 109.398 -155.897 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.427 HG22 ' CD ' ' B' ' 10' ' ' GLU . 13.4 t -82.49 -165.45 1.04 Allowed 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 119.306 0.957 . . . . 1.72 111.016 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -72.62 -60.76 2.08 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 123.633 0.773 . . . . 2.13 111.41 -167.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 10.6 mt -56.68 -37.74 71.27 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 120.492 -1.38 . . . . 1.05 110.617 177.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.427 ' CD ' HG22 ' B' ' 7' ' ' THR . 89.1 mt-10 -59.5 -43.48 93.34 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.757 0.823 . . . . 2.94 111.848 174.325 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.01 -46.06 86.2 Favored 'General case' 0 C--N 1.339 0.146 0 O-C-N 120.79 -1.194 . . . . 5.11 108.917 177.531 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -59.03 -46.29 88.58 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.742 -0.663 . . . . 1.72 110.816 -176.877 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.2 pp -66.98 -40.49 85.74 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 O-C-N 121.529 -0.732 . . . . 0.79 110.997 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.51 -55.14 37.07 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.179 0.899 . . . . 3.2 110.541 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.8 t -52.84 -36.56 58.99 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.103 0.865 . . . . 1.15 111.593 -173.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 24.3 m -78.01 -38.29 24.1 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 O-C-N 121.237 -0.914 . . . . 0.78 111.746 175.046 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 26.0 t -56.5 -51.0 70.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 119.395 0.998 . . . . 0.82 110.466 173.333 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 15.3 t -61.36 -40.09 93.02 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.421 1.009 . . . . 1.07 110.85 178.918 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 68.1 m -57.23 -54.63 44.65 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.421 -0.799 . . . . 0.87 110.278 173.491 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -45.53 -53.3 9.16 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 123.814 0.846 . . . . 4.01 109.654 172.663 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -58.73 -52.33 66.14 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.194 1.398 . . . . 2.55 110.721 -174.485 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 4.6 t -66.41 -26.57 67.3 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.995 -0.526 . . . . 2.63 111.684 -177.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -80.15 -36.95 34.43 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 120.033 1.288 . . . . 2.76 111.422 168.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.32 -32.17 72.89 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 120.833 -1.167 . . . . 1.18 109.927 -173.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -19.54 65.27 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 117.421 -1.276 . . . . 4.32 113.44 178.936 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.455 ' HB3' ' HG3' ' B' ' 37' ' ' GLU . 0.8 OUTLIER -51.1 -64.7 0.73 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 115.168 1.544 . . . . 1.69 115.168 -158.909 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -91.27 -77.37 0.42 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 119.757 -0.777 . . . . 2.83 112.581 -169.902 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.99 156.92 23.15 Favored Glycine 0 C--N 1.338 0.652 0 C-N-CA 127.77 2.605 . . . . 2.04 110.368 158.146 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 48.3 101.32 0.01 OUTLIER 'General case' 0 C--O 1.244 0.81 0 N-CA-C 115.772 1.767 . . . . 3.71 115.772 142.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 7.1 pttt -67.73 55.44 0.06 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 128.113 2.565 . . . . 3.55 112.121 172.952 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -155.86 -49.05 0.08 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 126.465 1.906 . . . . 3.51 107.156 -157.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 49.0 p -99.75 149.22 23.56 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 125.524 1.53 . . . . 2.22 111.203 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -93.08 117.68 30.34 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 107.168 -1.419 . . . . 2.26 107.168 139.067 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 4.6 t -83.2 -170.65 3.15 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 126.054 1.741 . . . . 2.52 108.648 161.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.454 ' C ' ' H ' ' B' ' 37' ' ' GLU . 0.1 OUTLIER -64.83 -103.83 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.362 0 C-N-CA 130.252 3.421 . . . . 3.16 102.475 -166.798 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -75.5 55.96 0.85 Allowed 'General case' 0 CA--C 1.551 0.995 0 O-C-N 118.918 -2.364 . . . . 2.76 111.45 -178.206 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.455 ' HG3' ' HB3' ' B' ' 26' ' ' GLN . 2.3 tt0 -116.43 -56.89 2.25 Favored 'General case' 0 N--CA 1.448 -0.561 1 C-N-CA 132.68 4.392 . . . . 2.0 103.716 158.404 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.58 -48.58 66.13 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.757 0.823 . . . . 2.45 109.221 173.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -51.18 -42.53 60.91 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 120.635 -0.426 . . . . 3.72 111.118 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -59.26 -37.87 78.68 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 118.111 0.414 . . . . 2.91 111.778 177.463 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 tt -68.76 -48.96 62.38 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.939 0.79 . . . . 1.98 109.639 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 2.4 m -66.57 -39.5 84.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 120.877 0.37 . . . . 0.72 110.039 -175.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 97.0 m -63.43 -56.5 15.71 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.455 0.702 . . . . 0.89 110.727 174.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -80.36 -57.4 3.62 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.749 0.419 . . . . 1.78 111.617 -164.794 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -79.46 -46.78 16.82 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 111.826 0.306 . . . . 3.1 111.826 -164.178 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 46' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' B' ' 46' ' ' LEU . 4.5 mm? -59.25 -37.55 53.48 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 113.505 0.928 . . . . 2.21 113.505 -166.102 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -60.11 -33.82 94.89 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 121.706 -2.206 . . . . 1.99 110.083 -62.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -84.64 -46.41 11.53 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.254 1.021 . . . . 3.52 112.871 -164.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.412 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 3.5 tp -42.02 -59.15 1.83 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.085 1.354 . . . . 1.23 111.428 -176.99 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 29.7 mt -79.74 66.09 5.1 Favored 'General case' 0 C--N 1.34 0.165 0 CA-C-O 122.111 0.958 . . . . 1.76 110.867 172.108 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -30.32 137.05 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 125.647 1.579 . . . . 5.69 112.257 152.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 27.1 t0 56.2 71.25 0.57 Allowed 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.924 1.689 . . . . 3.52 110.121 -167.262 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 24.8 m -72.4 -1.37 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-N 112.262 -2.245 . . . . 1.57 111.462 159.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -80.7 -56.65 3.07 Favored Glycine 0 C--N 1.342 0.898 0 N-CA-C 109.389 -1.485 . . . . 2.35 109.389 -174.171 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.29 52.04 0.73 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 122.362 1.077 . . . . 2.4 110.618 179.348 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -61.3 -40.18 93.22 Favored 'General case' 0 N--CA 1.439 -0.992 0 O-C-N 120.891 -1.13 . . . . 1.38 108.933 179.251 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -54.09 -53.17 56.88 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.398 1.079 . . . . 3.48 111.547 175.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -50.13 -60.16 3.22 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.862 1.265 . . . . 2.41 109.226 176.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.42 -57.31 13.51 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.427 -0.583 . . . . 4.28 109.427 -175.581 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -43.52 -54.89 4.57 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.912 1.685 . . . . 2.06 110.733 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 16.1 mtpp -56.61 -47.13 80.32 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.767 0.427 . . . . 3.61 111.454 175.429 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.2 t -60.71 -31.9 71.16 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 118.979 -0.534 . . . . 1.64 112.253 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 7.0 mp -75.54 -53.73 8.15 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.06 0.845 . . . . 2.01 110.061 174.458 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -53.65 -9.29 0.2 Allowed 'General case' 0 C--O 1.222 -0.374 0 N-CA-C 117.462 2.393 . . . . 2.19 117.462 -167.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.6 m -35.54 -23.04 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 129.649 3.18 . . . . 1.92 119.119 -127.674 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -51.38 -32.36 25.78 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.429 1.468 . . . . 3.44 111.544 159.072 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 64.01 55.05 1.61 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.579 0.751 . . . . 2.69 109.155 177.342 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 51.7 p30 -91.83 -17.67 24.96 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.519 1.128 . . . . 2.17 110.562 173.836 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 79.95 13.11 1.01 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.455 1.502 . . . . 2.2 112.544 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -124.33 101.81 7.37 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 106.857 -1.534 . . . . 3.0 106.857 167.117 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.13 106.6 7.82 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 106.684 -1.598 . . . . 1.46 106.684 175.854 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 48.9 tttt -83.78 178.84 7.76 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.506 1.522 . . . . 3.57 110.652 -162.652 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -83.53 80.19 9.19 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.994 1.318 . . . . 4.81 110.553 177.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . 0.363 28.4 t-20 123.9 -164.79 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 113.37 -3.205 . . . . 4.84 103.915 -110.082 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -31.86 -37.7 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 124.519 3.327 . . . . 2.39 116.798 -148.762 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -40.53 -53.97 2.59 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 121.112 1.778 . . . . 3.88 111.503 166.307 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.47 ' CH2' ' CD1' ' A' ' 77' ' ' TRP . 58.6 t90 -40.1 -32.03 0.15 Allowed 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 126.768 2.027 . . . . 3.73 114.838 173.542 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -46.54 -45.22 18.51 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 121.114 1.779 . . . . 6.8 110.276 170.532 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.7 tp -44.82 -49.74 10.61 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 124.725 1.21 . . . . 1.07 111.497 177.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 80' ' ' ILE . . . . . 0.669 HG23 ' HZ2' ' A' ' 77' ' ' TRP 0.322 8.7 tt -75.35 -21.84 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 N-CA-C 106.569 -1.641 . . . . 2.6 106.569 -166.789 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.56 ' HA2' ' CE2' ' A' ' 77' ' ' TRP . . . -59.03 -50.62 65.88 Favored Glycine 0 CA--C 1.491 -1.408 0 C-N-CA 125.003 1.287 . . . . 1.49 110.46 167.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -67.62 -47.39 69.75 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 106.871 -1.529 . . . . 2.19 106.871 -176.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.412 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 10.6 mp -44.0 -61.06 1.58 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 120.678 1.581 . . . . 2.02 111.803 171.296 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.31 -44.42 84.12 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.84 0.856 . . . . 1.2 111.561 -177.152 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -65.3 -54.04 35.03 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.977 1.311 . . . . 1.51 110.227 -177.756 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -57.01 -38.91 73.79 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.582 1.553 . . . . 2.46 110.931 -173.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 2.0 tt -51.38 -36.46 17.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 118.814 0.733 . . . . 1.08 111.082 175.293 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.45 -49.82 10.17 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.736 0.815 . . . . 5.78 109.754 174.615 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -115.58 97.0 5.9 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 126.264 1.826 . . . . 5.9 111.927 -160.168 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 90' ' ' LYS . . . . . 0.415 ' NZ ' ' OD2' ' B' ' 92' ' ' ASP . 18.0 pttp -39.49 -43.51 1.27 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.726 1.211 . . . . 5.4 114.038 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? -162.58 42.63 0.12 Allowed 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 119.715 1.143 . . . . 5.7 109.606 154.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 92' ' ' ASP . . . . . 0.415 ' OD2' ' NZ ' ' B' ' 90' ' ' LYS . 1.0 OUTLIER -106.57 78.72 1.29 Allowed 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 122.981 0.512 . . . . 4.81 110.054 -155.968 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 21.8 tp -139.85 -64.46 0.48 Allowed 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 124.001 0.921 . . . . 6.69 108.64 170.151 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.55 171.83 7.36 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.532 0.605 . . . . 8.21 110.235 -178.277 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 40.7 pt -140.77 28.39 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 125.334 1.454 . . . . 8.39 109.984 169.433 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 10.4 tpt85 -161.66 168.41 23.43 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 108.33 -0.989 . . . . 6.1 108.33 -175.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -176.27 137.92 0.31 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 129.952 3.301 . . . . 6.67 103.171 -168.208 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? . . . . . 0 C--O 1.256 1.413 0 N-CA-C 102.887 -3.005 . . . . 6.15 102.887 158.264 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.6 mtt . . . . . 0 N--CA 1.472 0.641 0 N-CA-C 106.169 -1.789 . . . . 6.69 106.169 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.7 171.27 13.59 Favored 'General case' 0 C--O 1.232 0.16 0 O-C-N 124.049 0.843 . . . . 4.0 109.769 168.492 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.66 86.5 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 C-N-CA 129.059 2.944 . . . . 3.19 108.843 -176.334 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.2 mp0 -85.8 123.09 72.76 Favored Pre-proline 0 N--CA 1.448 -0.557 0 C-N-CA 123.864 0.866 . . . . 4.24 110.26 -156.449 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.52 104.81 1.64 Allowed 'Trans proline' 0 N--CA 1.45 -1.032 0 C-N-CA 122.313 2.009 . . . . 2.52 109.564 -179.208 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 64.5 mt -59.28 152.11 21.7 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 108.951 -0.759 . . . . 1.33 108.951 170.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.3 t -70.17 171.76 9.19 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 120.436 -0.505 . . . . 1.76 110.188 -178.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -63.77 -55.58 22.06 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 121.109 -0.995 . . . . 2.89 110.914 -172.634 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.1 mp -57.13 -41.33 78.86 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 118.833 -1.147 . . . . 1.64 110.148 -176.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -57.59 -51.15 70.68 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 127.835 2.454 . . . . 2.01 111.284 175.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -52.87 63.83 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 108.665 -0.865 . . . . 5.12 108.665 177.887 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.9 m -61.09 -46.93 88.65 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 111.805 0.298 . . . . 2.03 111.805 -175.595 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.42 ' CD1' HG13 ' B' ' 87' ' ' ILE . 2.3 pp -64.1 -41.72 93.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 O-C-N 120.822 -1.174 . . . . 0.76 109.923 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -59.47 -49.25 78.51 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.402 1.001 . . . . 3.58 110.494 177.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.2 -40.52 74.15 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.597 0.713 . . . . 1.35 111.032 -175.785 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.4 m -75.45 -36.33 35.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 O-C-N 120.696 -1.252 . . . . 0.62 111.413 175.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 45.7 t -58.56 -46.56 89.93 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 CA-C-N 119.684 1.129 . . . . 0.76 110.064 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -63.43 -44.07 95.61 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.54 -0.743 . . . . 1.04 110.47 177.397 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 76.6 m -54.75 -48.32 72.74 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-N 119.01 0.823 . . . . 0.77 110.262 177.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -54.92 -61.19 2.47 Favored 'General case' 0 C--O 1.226 -0.148 0 N-CA-C 109.818 -0.438 . . . . 3.36 109.818 172.243 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -60.88 -48.76 80.32 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.261 0.624 . . . . 3.2 110.996 -163.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -62.64 -25.4 68.1 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 119.333 -0.365 . . . . 2.55 111.154 179.815 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -82.7 -58.97 2.67 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 123.407 0.683 . . . . 2.89 111.114 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -45.12 -24.28 0.23 Allowed 'General case' 0 C--O 1.238 0.472 1 C-N-CA 132.647 4.379 . . . . 0.92 115.55 178.776 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.53 -23.62 51.38 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 123.918 0.761 . . . . 3.87 112.082 169.261 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -38.49 -66.76 0.24 Allowed 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 127.231 2.213 . . . . 1.66 113.435 -163.7 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -99.99 34.25 2.36 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 108.755 -0.831 . . . . 3.11 108.755 -174.357 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 65.0 -168.04 29.72 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-O 122.374 0.985 . . . . 1.88 110.707 -164.202 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? 53.66 72.96 0.4 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.194 -1.039 . . . . 9.87 108.194 -178.078 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.2 pttt -61.81 -34.9 76.74 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 123.491 0.717 . . . . 4.45 111.876 -170.424 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -83.93 14.1 4.37 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 118.494 -0.765 . . . . 3.54 111.669 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.3 p -125.69 145.45 50.17 Favored 'General case' 0 C--N 1.348 0.542 0 C-N-CA 124.279 1.032 . . . . 2.72 111.601 175.851 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mt -102.75 123.41 46.37 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 108.769 -0.826 . . . . 2.57 108.769 149.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.33 177.74 8.37 Favored 'General case' 0 C--O 1.225 -0.231 0 O-C-N 121.223 -0.923 . . . . 2.49 110.15 167.574 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 93.2 t -46.44 -59.31 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 C-N-CA 123.754 0.822 . . . . 2.24 111.167 178.855 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -58.19 -59.17 5.71 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 118.757 -0.639 . . . . 2.23 109.687 -177.23 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -39.19 -47.94 1.69 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.777 1.231 . . . . 2.23 111.998 171.555 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PHE . . . . . 0.4 ' CE2' ' HG ' ' A' ' 71' ' ' LEU . 0.2 OUTLIER -58.86 -58.06 10.28 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.707 0.803 . . . . 3.47 110.492 177.813 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.409 ' O ' HG22 ' A' ' 42' ' ' VAL . 21.6 ttmt -61.03 -38.66 86.92 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.874 -0.33 . . . . 2.96 110.691 -174.546 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -51.86 -35.05 43.51 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 118.687 -0.673 . . . . 2.58 111.367 173.574 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.82 -43.33 75.77 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 119.978 1.263 . . . . 2.19 108.352 -176.475 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' VAL . . . . . 0.409 HG22 ' O ' ' A' ' 39' ' ' LYS . 13.8 m -65.57 -42.97 94.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 N-CA-C 109.542 -0.54 . . . . 1.59 109.542 -175.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.0 m -57.7 -49.34 76.86 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.807 0.843 . . . . 2.02 111.261 170.743 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -56.46 12.66 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.769 1.228 . . . . 4.34 111.933 -171.046 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -152.48 70.85 0.92 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 119.02 0.827 . . . . 3.74 111.278 -175.719 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.414 ' N ' ' CD ' ' A' ' 47' ' ' PRO . 2.7 tp -156.5 31.41 0.04 OUTLIER Pre-proline 0 CA--C 1.542 0.668 0 N-CA-C 114.855 1.428 . . . . 1.79 114.855 174.372 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.414 ' CD ' ' N ' ' A' ' 46' ' ' LEU . 39.0 Cg_endo -63.03 -64.99 0.06 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 121.916 1.744 . . . . 2.18 113.586 -172.074 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -87.04 41.63 0.98 Allowed 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.096 -1.003 . . . . 3.78 111.611 -160.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.538 HD12 ' HE3' ' A' ' 90' ' ' LYS . 1.5 tp -141.95 -82.5 0.2 Allowed 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.172 0.989 . . . . 1.31 110.844 -172.85 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 32.0 mt -87.96 75.39 8.8 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 107.736 -1.209 . . . . 1.95 107.736 -178.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LYS . . . . . 0.407 ' NZ ' ' OE1' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -43.13 143.61 0.77 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.568 -1.196 . . . . 6.98 110.33 160.437 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.1 t0 65.31 81.5 0.2 Allowed 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.537 1.535 . . . . 4.4 110.042 -159.985 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -88.57 3.7 5.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-N 113.539 -1.664 . . . . 2.39 110.681 163.972 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -94.77 -57.78 1.22 Allowed Glycine 0 C--N 1.342 0.897 0 N-CA-C 109.777 -1.329 . . . . 1.86 109.777 -170.013 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.5 t -90.9 30.19 1.24 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.096 1.359 . . . . 2.56 110.007 173.212 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -40.59 -38.25 0.84 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 126.244 1.818 . . . . 1.83 110.963 166.507 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -42.44 -41.92 3.08 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.328 2.251 . . . . 4.51 111.157 175.906 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -56.42 -54.65 43.09 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.548 1.139 . . . . 2.79 111.089 173.569 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.433 ' HE3' ' H ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -58.1 -53.79 54.24 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 106.735 -1.58 . . . . 3.18 106.735 -179.291 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -45.62 -52.12 11.14 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.081 0.953 . . . . 1.82 111.147 178.501 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -64.52 -29.86 70.89 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.611 -0.68 . . . . 3.87 112.493 178.189 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.8 t -67.83 -48.14 67.05 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.373 0.533 . . . . 1.79 110.438 173.917 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.1 mp -57.97 -48.45 79.95 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.729 -0.607 . . . . 1.97 110.167 177.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -71.8 81.65 0.88 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.515 -0.311 . . . . 2.72 110.272 -172.702 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.1 m -47.8 -36.57 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 124.032 0.933 . . . . 1.78 113.499 -174.119 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.0 p-10 -98.52 -0.12 43.95 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.295 0.85 . . . . 2.31 113.295 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 44.2 58.6 3.64 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 126.985 2.114 . . . . 4.3 112.517 178.004 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 45.4 p30 -100.14 -3.48 31.66 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.888 1.275 . . . . 1.69 112.317 178.271 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 28.1 m 65.17 21.92 12.18 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.977 1.311 . . . . 1.83 113.144 -174.466 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -129.43 100.6 5.62 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 105.329 -2.1 . . . . 4.09 105.329 171.652 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' LEU . . . . . 0.4 ' HG ' ' CE2' ' A' ' 38' ' ' PHE . 0.2 OUTLIER -81.62 88.16 6.24 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 103.151 -2.907 . . . . 1.09 103.151 176.142 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -54.2 155.59 3.61 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.746 -1.205 . . . . 4.25 107.746 176.577 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -37.18 -55.77 0.96 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.239 1.016 . . . . 5.08 112.815 -173.095 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -76.31 -18.27 59.03 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.191 0.812 . . . . 4.04 113.191 -175.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -73.79 -60.05 2.43 Favored 'General case' 0 CA--C 1.529 0.161 0 O-C-N 121.364 -0.835 . . . . 2.07 108.905 166.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -43.09 -47.79 6.11 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 124.387 1.075 . . . . 3.5 110.435 176.587 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.626 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 39.8 t90 -39.77 -41.14 1.06 Allowed 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 124.641 1.176 . . . . 4.42 112.613 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -46.45 -38.33 8.98 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 117.976 -1.012 . . . . 5.57 112.557 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.0 tp -53.2 -48.11 68.35 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 120.082 1.31 . . . . 0.8 110.346 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 53.0 mt -59.14 -30.02 42.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 N-CA-C 108.161 -1.051 . . . . 1.64 108.161 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.569 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -67.13 -50.81 43.09 Favored Glycine 0 CA--C 1.491 -1.444 0 C-N-CA 125.922 1.725 . . . . 1.26 111.399 177.012 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -67.9 -23.84 65.15 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 107.651 -1.24 . . . . 2.21 107.651 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.492 HD22 HD23 ' A' ' 49' ' ' LEU . 13.4 mt -68.01 -54.11 20.88 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 120.636 1.562 . . . . 1.94 111.647 166.237 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.95 -28.4 62.15 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.906 0.883 . . . . 1.1 111.527 -178.386 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -79.87 -52.67 7.59 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.727 1.611 . . . . 1.72 107.459 173.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' GLU . . . . . 0.407 ' OE1' ' NZ ' ' A' ' 51' ' ' LYS 2.099 11.0 pt-20 -31.79 -61.05 0.24 Allowed 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 129.414 3.085 . . . . 2.49 113.42 171.916 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 8.3 tt -56.27 -32.33 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 CA-C-N 115.748 -0.66 . . . . 1.26 112.277 -172.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.33 -57.15 2.88 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.737 0.815 . . . . 4.65 109.506 176.097 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -46.99 -34.5 5.64 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 128.866 2.866 . . . . 2.74 113.065 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 90' ' ' LYS . . . . . 0.538 ' HE3' HD12 ' A' ' 49' ' ' LEU . 11.0 tttt -29.98 -27.82 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 120.01 3.337 . . . . 8.84 120.01 -128.375 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -174.53 35.4 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 126.134 1.774 . . . . 8.83 111.844 163.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -74.08 77.73 1.73 Allowed 'General case' 0 N--CA 1.465 0.315 0 O-C-N 120.882 -1.136 . . . . 6.09 109.076 176.541 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -153.62 -34.35 0.11 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 113.778 1.029 . . . . 8.66 113.778 170.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -159.12 178.03 10.46 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.473 -0.936 . . . . 11.34 108.473 175.37 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 71.9 mt 67.77 -80.22 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 125.313 1.445 . . . . 10.83 108.997 -170.96 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.4 mmm-85 158.24 174.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 128.838 2.855 . . . . 12.19 107.004 -175.284 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 43.8 tttt -177.64 108.35 0.06 Allowed 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.26 1.824 . . . . 11.43 106.392 -178.329 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.33 0 N-CA-C 103.915 -2.624 . . . . 10.12 103.915 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 77.4 mtm . . . . . 0 N--CA 1.478 0.965 0 CA-C-O 117.658 -1.163 . . . . 6.24 109.471 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 76.54 -177.85 0.13 Allowed 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.274 1.43 . . . . 5.08 113.29 -175.965 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.48 67.44 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 129.547 3.139 . . . . 6.53 112.771 179.595 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -76.74 -71.68 0.18 Allowed Pre-proline 0 N--CA 1.444 -0.728 0 C-N-CA 126.967 2.107 . . . . 7.12 114.531 -169.728 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -42.15 133.37 4.53 Favored 'Trans proline' 0 C--N 1.355 0.898 1 C-N-CA 126.398 4.732 . . . . 3.26 115.358 -150.381 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -145.45 149.22 34.3 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 122.56 0.344 . . . . 3.24 110.99 -148.48 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.555 HG22 ' HG3' ' B' ' 10' ' ' GLU . 4.7 t -74.17 -168.35 0.63 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.107 1.363 . . . . 1.86 111.286 174.452 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.516 ' HA ' ' HG2' ' B' ' 11' ' ' GLU . 62.0 tt0 -67.5 -59.99 2.93 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 122.176 0.989 . . . . 2.44 111.989 -173.799 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -53.47 -40.73 65.54 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 120.552 -1.342 . . . . 1.04 110.676 176.49 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.555 ' HG3' HG22 ' B' ' 7' ' ' THR . 42.1 mt-10 -57.81 -49.83 75.31 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.365 0.666 . . . . 2.88 112.208 173.528 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 11' ' ' GLU . . . . . 0.516 ' HG2' ' HA ' ' B' ' 8' ' ' GLU . 13.6 pt-20 -61.44 -38.0 85.56 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 120.463 -1.398 . . . . 3.98 110.552 177.433 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 9.4 t -59.73 -49.29 78.33 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.066 0.546 . . . . 1.76 110.981 177.385 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.268 2.4 pp -62.49 -35.2 68.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 O-C-N 121.035 -1.041 . . . . 0.88 111.069 173.121 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -54.79 -59.93 4.06 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.077 -0.963 . . . . 2.81 111.063 174.027 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 12.8 t -50.65 -43.33 57.15 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.758 1.163 . . . . 1.36 112.052 -171.676 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.3 m -69.74 -43.81 79.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 O-C-N 120.967 -1.083 . . . . 0.89 110.887 177.115 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 41.1 t -55.06 -53.4 34.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-O 118.669 -0.682 . . . . 1.02 110.465 175.933 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 9.3 t -58.86 -45.97 88.87 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.334 0.97 . . . . 1.09 110.801 178.732 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 94.6 m -52.95 -55.29 24.48 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.71 0.686 . . . . 0.98 110.266 177.011 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -54.54 -44.04 72.5 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.751 -0.593 . . . . 7.1 111.482 174.762 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -64.95 -26.9 68.5 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.621 1.168 . . . . 2.36 112.299 -177.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 67.2 p -69.88 -61.29 1.84 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.366 0.985 . . . . 2.37 108.644 167.775 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -54.45 -29.55 49.94 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 113.105 0.78 . . . . 2.96 113.105 -177.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -51.0 -33.02 23.03 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 126.209 1.804 . . . . 1.22 111.017 176.114 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -37.95 76.03 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 117.337 -1.316 . . . . 5.36 110.825 178.616 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.556 ' CB ' ' HG2' ' B' ' 37' ' ' GLU . 1.5 tp60 -39.69 -65.82 0.35 Allowed 'General case' 0 C--O 1.24 0.582 0 O-C-N 124.962 1.414 . . . . 2.59 111.974 -143.542 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -95.24 -73.47 0.58 Allowed 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 125.531 1.769 . . . . 3.72 113.473 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.11 123.43 7.48 Favored Glycine 0 C--N 1.338 0.67 0 CA-C-O 115.584 -2.787 . . . . 2.34 112.811 178.137 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 53.2 ttt85 52.44 102.83 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 121.752 2.776 . . . . 4.89 115.08 149.694 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.61 50.32 0.18 Allowed 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 116.231 1.937 . . . . 6.15 116.231 -172.604 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -137.08 -54.09 0.7 Allowed 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 126.243 1.817 . . . . 3.33 107.618 177.006 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 56.4 p -73.38 145.84 45.59 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.834 1.253 . . . . 2.16 110.568 175.001 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.04 -173.3 4.65 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 108.496 -0.927 . . . . 2.04 108.496 157.029 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . 0.273 3.9 t -157.4 -167.98 2.46 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 122.771 1.272 . . . . 2.42 113.581 -158.351 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 15.9 t -68.17 -131.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.651 1 N-CA-C 98.204 -4.739 . . . . 3.3 98.204 151.319 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 15.2 t30 -75.26 56.1 0.8 Allowed 'General case' 0 CA--C 1.557 1.217 0 O-C-N 118.062 -2.899 . . . . 2.87 112.323 -160.356 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.556 ' HG2' ' CB ' ' B' ' 26' ' ' GLN . 58.0 mt-10 -102.85 -50.81 3.43 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 128.971 2.908 . . . . 1.77 107.688 139.966 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -56.07 -52.16 65.27 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.223 -1.028 . . . . 2.86 108.223 174.023 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 39' ' ' LYS . . . . . 0.433 ' HA ' HG22 ' B' ' 42' ' ' VAL 0.266 53.5 tttm -54.28 -45.7 72.54 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 118.602 -1.239 . . . . 3.95 110.24 -175.113 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -57.93 -39.62 78.48 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 119.116 -0.468 . . . . 2.83 112.219 176.873 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 4.7 tt -66.87 -46.01 76.33 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 119.626 1.103 . . . . 1.68 109.699 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.433 HG22 ' HA ' ' B' ' 39' ' ' LYS . 27.4 m -69.94 -44.27 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-O 121.551 0.691 . . . . 0.66 109.219 -173.566 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 86.8 m -66.0 -49.98 65.88 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.262 1.025 . . . . 1.22 109.855 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -80.52 -62.46 1.67 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.256 0.222 . . . . 1.98 111.173 -171.471 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -83.9 -44.12 14.59 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 122.897 0.479 . . . . 2.7 112.14 -167.867 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.8 tp -82.71 -18.79 0.26 Allowed Pre-proline 0 CA--C 1.548 0.869 0 N-CA-C 118.768 2.877 . . . . 1.78 118.768 -167.54 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -46.2 -44.6 19.53 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 124.091 3.194 . . . . 2.47 117.158 -133.813 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -62.47 -44.26 96.82 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.182 0.808 . . . . 2.2 113.182 -172.222 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.5 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 12.0 tp -57.34 -77.04 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.604 1.162 . . . . 1.18 112.6 -163.654 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 5.8 mt -67.06 -40.75 87.17 Favored 'General case' 0 C--N 1.339 0.144 0 O-C-N 121.728 -0.608 . . . . 3.97 110.336 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 12.1 tptp 62.82 171.28 0.14 Allowed 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.194 0.998 . . . . 7.6 111.611 -174.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 12.9 t0 46.66 62.41 2.34 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 123.812 1.768 . . . . 3.7 108.623 -160.418 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 26.9 m -84.19 28.17 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 112.446 -2.161 . . . . 2.22 109.933 162.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -104.61 -63.75 0.66 Allowed Glycine 0 C--N 1.341 0.821 0 N-CA-C 107.654 -2.178 . . . . 2.57 107.654 172.093 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.75 54.4 1.82 Allowed 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.851 1.261 . . . . 3.34 110.315 -174.73 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -61.26 -35.68 77.94 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 125.134 1.373 . . . . 1.18 110.224 -172.443 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -29.26 -57.88 0.15 Allowed 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 126.367 1.867 . . . . 4.0 114.125 171.178 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -49.09 -60.29 2.91 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.053 0.941 . . . . 2.32 109.528 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 2.9 mtmt -61.1 -49.04 78.91 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.893 -1.049 . . . . 4.53 109.672 -176.948 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -51.8 -51.96 52.61 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.953 0.797 . . . . 2.14 110.83 178.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -64.94 -34.73 79.11 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 122.729 0.412 . . . . 3.83 110.978 -178.593 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 5.3 t -67.72 -37.17 81.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.387 0.675 . . . . 1.64 111.774 174.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 79.5 mt -69.13 -58.81 3.57 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.019 0.928 . . . . 1.44 109.482 177.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 64' ' ' ASP . . . . . 0.417 ' O ' ' N ' ' B' ' 66' ' ' ASN 0.314 2.1 t70 -55.8 -9.51 0.57 Allowed 'General case' 0 C--O 1.221 -0.407 0 N-CA-C 117.461 2.393 . . . . 2.84 117.461 -165.638 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 28.1 m -34.54 -24.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 129.172 2.989 . . . . 1.44 118.717 -127.627 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 66' ' ' ASN . . . . . 0.417 ' N ' ' O ' ' B' ' 64' ' ' ASP . 0.3 OUTLIER -53.2 -34.56 57.54 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.816 1.189 . . . . 3.65 111.232 160.784 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 66.07 56.12 0.86 Allowed 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.751 1.621 . . . . 4.1 111.727 171.078 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -89.96 -33.05 16.53 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 114.651 -1.159 . . . . 3.55 109.374 158.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 4.1 m 101.3 -4.27 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 128.154 2.581 . . . . 2.4 114.005 175.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -101.22 132.54 46.67 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 106.401 -1.703 . . . . 5.28 106.401 164.905 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -99.79 118.5 36.39 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 106.61 -1.626 . . . . 1.15 106.61 -167.75 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 6.9 tptm -79.74 176.37 9.78 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.841 0.856 . . . . 3.12 109.104 -171.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -80.4 76.1 7.23 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 107.911 -1.144 . . . . 4.42 107.911 -174.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 97.91 53.98 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.304 1 C-N-CA 133.589 4.756 . . . . 2.15 108.922 -164.812 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -87.89 -61.84 1.63 Allowed 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 121.092 -1.005 . . . . 1.73 108.6 107.655 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -45.11 -43.64 9.84 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.651 1.18 . . . . 6.01 114.076 -162.176 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.626 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 16.9 t-105 -39.94 -36.62 0.48 Allowed 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.416 1.487 . . . . 4.77 112.495 177.232 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 10.4 mtt180 -38.36 -51.06 1.52 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.434 1.016 . . . . 4.63 111.601 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 2.7 tp -53.36 -38.77 63.6 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 123.099 0.25 . . . . 1.13 110.627 -175.356 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 70.7 mt -63.42 -25.47 38.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-O 121.729 0.776 . . . . 1.55 109.604 -174.063 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.552 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -74.48 -40.88 38.24 Favored Glycine 0 CA--C 1.49 -1.531 0 N-CA-C 109.674 -1.37 . . . . 1.33 109.674 179.076 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.94 -52.93 53.67 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 105.559 -2.015 . . . . 2.34 105.559 178.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.5 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 9.5 mp -42.22 -61.56 1.14 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.646 1.112 . . . . 2.1 111.709 172.232 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.44 -44.38 92.95 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.771 0.796 . . . . 1.16 111.805 -175.614 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 28.8 ttmt -62.69 -55.0 30.87 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.246 1.419 . . . . 1.62 110.426 -179.061 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -57.62 -44.62 85.65 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.056 0.942 . . . . 2.4 109.834 -170.922 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 87' ' ' ILE . . . . . 0.42 HG13 ' CD1' ' A' ' 13' ' ' ILE . 0.2 OUTLIER -39.89 -48.34 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 125.433 1.493 . . . . 1.57 112.67 166.149 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.54 -34.05 31.38 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.234 1.014 . . . . 3.93 110.606 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 43.4 mttm -132.36 103.46 6.22 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 126.353 1.861 . . . . 5.89 110.731 -163.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 54.7 pttt -38.95 -44.3 1.06 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.326 1.05 . . . . 6.47 113.139 173.09 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 32.2 tttt -168.85 28.85 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 121.648 0.737 . . . . 6.57 111.889 162.06 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.3 59.43 5.63 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 124.881 1.272 . . . . 4.73 110.122 -155.459 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 18.0 tp -116.43 -77.02 0.57 Allowed 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 124.776 1.23 . . . . 6.23 108.635 -177.367 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 173.86 177.8 0.12 Allowed 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 126.412 1.885 . . . . 7.59 108.295 179.06 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -128.74 110.43 21.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 105.881 -1.896 . . . . 7.49 105.881 161.2 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 4.9 ttt-85 -177.82 167.72 2.11 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 125.464 1.506 . . . . 6.7 107.891 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -177.33 138.78 0.24 Allowed 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 105.051 -2.203 . . . . 10.1 105.051 -158.621 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.19 0 N-CA-C 105.52 -2.03 . . . . 7.59 105.52 160.938 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.1 mtt . . . . . 0 N--CA 1.474 0.742 0 N-CA-C 109.676 -0.49 . . . . 6.56 109.676 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.55 176.73 11.04 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.681 1.192 . . . . 2.78 108.007 -178.851 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.0 92.45 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 129.142 2.977 . . . . 3.41 109.866 -173.83 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -73.76 131.14 82.3 Favored Pre-proline 0 N--CA 1.443 -0.822 0 C-N-CA 124.834 1.254 . . . . 6.22 109.967 -172.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.97 96.85 0.79 Allowed 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 122.575 2.183 . . . . 2.75 110.308 179.206 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 93.4 mt -57.83 157.52 7.44 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.574 0.75 . . . . 1.71 111.033 173.614 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 10' ' ' GLU . 4.4 t -75.24 159.79 31.13 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 108.806 -0.813 . . . . 2.49 108.806 176.426 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 68.2 tt0 -51.1 -45.95 61.68 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 123.481 0.712 . . . . 4.28 110.803 -177.001 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.4 mt -64.74 -55.97 16.56 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.396 -0.811 . . . . 1.59 111.028 -177.929 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.407 ' H ' HG23 ' A' ' 7' ' ' THR . 97.9 mt-10 -49.24 -54.29 17.44 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.155 1.382 . . . . 2.19 110.678 176.846 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -50.26 -59.89 3.51 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 124.377 1.071 . . . . 3.9 109.609 174.997 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.1 p -56.61 -43.75 80.49 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.558 -0.714 . . . . 1.56 111.296 -174.494 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.308 2.7 pp -66.81 -42.94 89.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-O 118.743 -0.646 . . . . 0.69 110.44 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -61.04 -49.95 75.3 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 119.435 -0.906 . . . . 3.41 109.912 175.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 m -46.02 -51.38 13.69 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.005 1.722 . . . . 1.7 112.64 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 30.1 m -71.64 -40.33 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 O-C-N 120.335 -1.478 . . . . 0.74 110.163 178.634 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 36.2 t -55.07 -43.03 68.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 123.024 0.53 . . . . 0.73 110.586 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.7 t -61.99 -52.61 63.3 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.276 0.944 . . . . 0.92 110.716 178.027 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.9 m -57.69 -50.71 72.29 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.584 1.084 . . . . 1.12 110.529 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -45.21 -55.59 5.66 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 124.965 1.306 . . . . 2.99 110.517 171.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -58.16 -51.93 67.69 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.953 0.901 . . . . 3.95 110.58 -177.527 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 12.4 p -56.69 -38.74 72.69 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 119.41 -0.329 . . . . 2.31 111.306 -179.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -65.32 -52.88 51.01 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 121.386 0.612 . . . . 2.52 110.983 171.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.2 -19.88 65.64 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.143 1.377 . . . . 0.86 112.062 -170.247 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.31 -33.32 75.57 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 117.977 -1.011 . . . . 6.02 110.148 173.463 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.421 ' HB3' ' HG3' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -38.99 -77.17 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.86 0.864 . . . . 2.52 112.411 -173.11 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 27' ' ' GLU . . . . . 0.421 ' HG3' ' HB3' ' A' ' 26' ' ' GLN . 71.9 mt-10 -100.96 173.38 6.51 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 127.203 2.201 . . . . 2.49 106.663 -174.777 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -33.42 141.29 0.08 OUTLIER Glycine 0 CA--C 1.538 1.49 0 C-N-CA 125.978 1.752 . . . . 1.49 115.214 -173.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? 62.2 105.32 0.03 OUTLIER 'General case' 0 C--O 1.237 0.438 0 C-N-CA 125.22 1.408 . . . . 4.65 111.753 -177.996 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -73.34 50.6 0.31 Allowed 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.281 0.845 . . . . 3.6 113.281 176.457 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.7 p-10 -172.31 -32.6 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 127.429 2.292 . . . . 3.47 109.346 171.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.7 m -78.11 130.08 35.96 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.755 -0.831 . . . . 2.3 108.755 170.85 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -83.54 154.12 24.0 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 106.449 -1.686 . . . . 2.07 106.449 162.659 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.4 m -122.46 170.88 9.53 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 107.204 -1.406 . . . . 2.98 107.204 161.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.1 p -48.48 -52.1 9.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 N-CA-C 112.804 0.668 . . . . 2.09 112.804 -165.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -62.82 -57.74 9.83 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.555 -0.736 . . . . 2.53 109.798 -178.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -38.47 -51.1 1.57 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.08 1.352 . . . . 1.66 111.413 174.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.77 -49.02 78.03 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 114.966 -1.016 . . . . 3.15 109.716 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -59.95 -39.57 86.03 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 118.671 -0.68 . . . . 4.01 110.33 -176.574 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -53.66 -44.05 69.33 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 118.259 0.481 . . . . 3.68 110.753 171.755 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.12 -49.61 73.75 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 108.523 -0.917 . . . . 3.21 108.523 -173.154 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.5 m -68.95 -52.21 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 N-CA-C 108.852 -0.796 . . . . 1.24 108.852 -175.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.9 m -52.79 -51.56 60.25 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.5 1.12 . . . . 1.69 111.199 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -72.43 -50.89 23.05 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 122.543 0.337 . . . . 3.59 110.268 -175.041 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -94.69 -26.63 16.23 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.094 0.776 . . . . 4.12 113.094 -161.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.8 mp -107.96 93.42 10.76 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 119.167 0.894 . . . . 2.26 110.11 -175.879 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -72.07 -44.34 0.91 Allowed 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.24 1.96 . . . . 2.36 111.453 -177.97 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.2 t-160 -150.63 44.33 0.84 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.161 0.505 . . . . 3.84 110.692 -174.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 19.8 tp -95.48 -80.98 0.41 Allowed 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.01 -1.478 . . . . 1.95 107.01 167.298 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.3 mt -75.73 84.24 2.72 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.279 -0.637 . . . . 2.3 109.279 172.829 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.01 143.48 1.12 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.664 -0.698 . . . . 5.73 110.718 163.38 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 67.43 39.11 3.0 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 125.774 1.63 . . . . 4.19 110.475 177.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -49.83 -25.59 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 125.96 1.704 . . . . 3.15 113.991 -177.941 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.53 -44.08 21.85 Favored Glycine 0 CA--C 1.532 1.143 0 N-CA-C 111.183 -0.767 . . . . 1.91 111.183 170.449 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 47.1 t -74.66 45.79 0.26 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.113 1.765 . . . . 2.85 111.038 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -66.04 -49.92 66.0 Favored 'General case' 0 N--CA 1.445 -0.725 0 O-C-N 120.846 -1.159 . . . . 1.57 108.347 174.585 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.12 -38.15 56.49 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.797 1.639 . . . . 4.11 111.904 -167.429 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -55.41 -53.69 53.03 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.755 -0.591 . . . . 3.26 110.925 170.993 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.45 -46.06 89.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.974 -0.75 . . . . 2.75 108.974 175.789 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 60' ' ' MET . . . . . 0.432 ' HA ' HD12 ' A' ' 63' ' ' LEU . 18.7 tmm? -44.91 -52.72 8.38 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 123.875 0.87 . . . . 1.88 109.158 179.584 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -68.82 -39.89 79.79 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.843 -0.617 . . . . 4.66 111.423 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.1 t -58.73 -30.04 67.17 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.895 0.702 . . . . 2.59 112.895 175.644 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.542 HD23 ' HB2' ' A' ' 78' ' ' ARG . 0.1 OUTLIER -88.43 -45.26 10.11 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.536 -0.727 . . . . 1.96 109.431 175.717 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -75.2 61.25 1.13 Allowed 'General case' 0 C--N 1.342 0.256 0 C-N-CA 124.775 1.23 . . . . 1.64 111.012 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 25.7 m -58.67 -34.11 50.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.934 0.894 . . . . 1.79 112.281 -174.558 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -82.74 -8.4 59.59 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.347 0.499 . . . . 2.49 112.347 177.189 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . 0.266 2.9 tp60 50.93 66.55 1.14 Allowed 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.878 2.071 . . . . 4.41 113.407 178.25 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.8 p30 -113.17 -4.98 13.69 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.685 1.194 . . . . 2.45 111.774 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.4 m 62.53 15.38 7.84 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.304 1.041 . . . . 1.98 113.454 -171.995 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -112.11 109.6 19.42 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.602 1.561 . . . . 3.47 107.066 165.046 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -88.35 74.86 8.58 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 105.472 -2.047 . . . . 1.36 105.472 170.68 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.68 159.91 33.57 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.008 0.433 . . . . 3.32 110.886 177.488 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 15.5 p90 -37.59 -55.96 1.07 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.888 1.675 . . . . 5.41 114.057 -162.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.11 -40.27 90.59 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.85 0.75 . . . . 2.31 111.721 -177.046 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -76.46 -44.0 37.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 120.087 1.312 . . . . 2.12 109.686 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -44.55 -50.16 9.73 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 118.551 0.614 . . . . 3.35 109.961 167.784 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.634 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 1.2 t-105 -46.51 -32.23 3.23 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 116.938 -1.506 . . . . 4.03 112.418 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.542 ' HB2' HD23 ' A' ' 63' ' ' LEU . 0.5 OUTLIER -38.69 -49.08 1.55 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 120.694 1.588 . . . . 4.68 109.939 172.621 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.8 tp -48.42 -46.04 37.0 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.834 0.854 . . . . 0.82 110.251 -176.545 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 91.3 mt -62.99 -31.77 53.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 109.12 -0.696 . . . . 1.74 109.12 -171.137 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.556 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -67.99 -45.71 71.19 Favored Glycine 0 CA--C 1.488 -1.624 0 N-CA-C 109.656 -1.378 . . . . 1.23 109.656 178.046 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -69.33 -49.03 59.51 Favored 'General case' 0 N--CA 1.422 -1.873 0 N-CA-C 105.825 -1.917 . . . . 2.39 105.825 -173.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 9.5 mt -41.26 -59.1 1.62 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 120.881 1.673 . . . . 2.45 111.631 166.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.36 -30.74 63.05 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.513 0.725 . . . . 1.29 111.716 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 -57.23 4.93 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 123.228 0.611 . . . . 1.8 110.439 171.001 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -50.25 -48.05 54.86 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 128.689 2.796 . . . . 2.22 108.968 -174.06 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.8 tt -61.6 -21.22 24.97 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 113.849 1.055 . . . . 1.96 113.849 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 49.8 ttt85 -96.8 -60.37 1.61 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.303 1.441 . . . . 5.31 109.129 178.861 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 40.5 pttt -70.76 7.12 1.21 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.432 1.093 . . . . 3.92 113.799 -179.381 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 23.1 tttt -50.46 -27.48 6.57 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.561 1.544 . . . . 8.56 114.472 -164.043 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 43.5 tttp -160.95 -35.27 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.68 0.792 . . . . 8.67 111.065 171.875 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.7 t0 20.27 63.48 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 128.873 2.869 . . . . 6.33 115.083 -178.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.2 pp -129.24 -44.53 1.26 Allowed 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 125.46 1.504 . . . . 10.04 107.288 163.822 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 33.7 mttm -64.42 81.55 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 106.887 -1.523 . . . . 13.41 106.887 149.759 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 9.1 tp -48.03 152.26 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 129.921 3.288 . . . . 12.96 114.441 -167.358 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . 0.286 15.9 ptt180 56.9 -160.25 0.23 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 127.023 2.129 . . . . 17.8 112.907 167.213 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -177.78 68.54 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.086 0 N-CA-C 106.943 -1.503 . . . . 13.81 106.943 -161.772 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . 2.406 50.8 mtmt . . . . . 0 C--O 1.252 1.208 0 N-CA-C 105.701 -1.963 . . . . 12.19 105.701 -144.329 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.438 34.2 ttm . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 108.808 -0.812 . . . . 10.17 108.808 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.2 -167.63 2.88 Favored 'General case' 0 CA--C 1.523 -0.093 0 C-N-CA 124.497 1.119 . . . . 5.93 110.001 -165.078 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 103.67 100.68 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 129.721 3.209 . . . . 6.87 111.375 -171.486 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -75.75 -48.37 3.79 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.808 2.043 . . . . 10.07 115.065 -173.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -71.56 107.62 2.21 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 121.503 1.469 . . . . 3.35 110.869 -168.795 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 42.3 mt -135.75 -168.22 2.17 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.419 1.488 . . . . 3.74 109.097 -172.569 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 11.6 t -75.57 178.62 5.87 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 119.123 0.874 . . . . 2.34 109.94 -177.704 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -61.59 -63.09 1.38 Allowed 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.526 0.679 . . . . 3.41 110.508 -172.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 mp -56.48 -44.13 80.33 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 121.447 -0.783 . . . . 2.08 109.783 -175.613 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.41 -46.03 69.59 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.541 1.936 . . . . 3.82 112.244 173.75 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.65 -51.44 69.37 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.468 -0.77 . . . . 4.73 109.225 176.353 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 91.7 p -65.98 -41.01 91.7 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.074 -0.512 . . . . 2.07 110.721 -171.833 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.279 2.4 pp -64.16 -39.46 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 CA-C-O 118.264 -0.874 . . . . 1.26 109.299 174.482 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.0 -45.92 91.48 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 117.564 -1.655 . . . . 4.88 112.469 173.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . 0.266 1.1 t -56.43 -35.27 67.65 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 120.313 1.415 . . . . 1.42 110.98 -174.428 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 20.7 m -77.0 -34.12 21.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 O-C-N 120.684 -1.26 . . . . 1.16 112.34 171.328 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 60.2 t -53.82 -51.22 46.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 120.722 1.601 . . . . 1.27 110.496 169.835 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.3 t -65.03 -43.19 93.23 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.819 0.736 . . . . 1.21 110.348 -177.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 72.0 m -55.94 -53.47 56.42 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.512 0.596 . . . . 1.15 110.28 174.354 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -47.28 -55.34 8.88 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.975 0.91 . . . . 4.21 109.951 172.652 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -56.41 -52.89 62.95 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.764 1.626 . . . . 2.55 110.819 -173.757 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.8 t -63.99 -25.2 68.02 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 122.134 -0.354 . . . . 2.56 111.42 -175.332 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -80.95 -44.1 18.74 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 119.159 0.89 . . . . 2.92 110.921 168.18 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.52 -32.59 70.44 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.712 1.205 . . . . 1.64 110.572 -172.363 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.72 -20.05 63.08 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 117.315 -1.326 . . . . 4.43 113.366 177.721 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.98 -67.16 0.32 Allowed 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 115.462 1.653 . . . . 2.28 115.462 -155.413 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -91.92 -77.03 0.44 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 119.394 -0.922 . . . . 2.77 113.062 -168.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.18 169.05 31.62 Favored Glycine 0 C--N 1.336 0.575 0 C-N-CA 127.555 2.502 . . . . 2.52 110.604 160.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 48.29 98.54 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.949 1.092 . . . . 4.63 113.949 137.219 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 18.0 pttm -77.9 51.18 0.93 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.318 1.847 . . . . 4.46 112.804 -174.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 19.5 p30 -172.36 -51.17 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.102 1.761 . . . . 3.56 108.387 -163.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 53.7 p -74.23 150.06 40.5 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.045 0.538 . . . . 1.79 110.306 170.711 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 mp -123.71 119.73 30.63 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 123.17 0.588 . . . . 2.88 110.044 161.748 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 50.1 m -90.35 175.63 7.03 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.869 -0.789 . . . . 2.56 108.869 170.71 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 11.0 p -84.03 51.77 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 O-C-N 121.004 -1.06 . . . . 2.66 110.709 -175.58 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -159.93 55.1 0.36 Allowed 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 106.084 -1.821 . . . . 3.08 106.084 159.365 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -178.49 -56.12 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 127.9 2.48 . . . . 1.94 104.546 -166.151 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -60.1 -59.38 5.51 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.604 -0.887 . . . . 3.45 108.604 165.228 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 54.3 tttt -58.18 -35.83 72.17 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 119.903 -0.719 . . . . 2.47 111.365 -174.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -49.56 -42.8 45.15 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 119.302 -0.38 . . . . 4.27 111.9 172.694 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 tp -66.42 -49.15 67.73 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.773 -0.825 . . . . 1.92 108.773 -172.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.424 ' HA ' HD23 ' B' ' 46' ' ' LEU . 9.4 m -69.09 -38.16 77.79 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.163 0 CA-C-N 116.083 -0.508 . . . . 0.73 110.016 -174.182 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 94.1 m -61.1 -54.86 39.41 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.124 -0.489 . . . . 1.26 110.134 173.717 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 38.7 tt0 -82.01 -60.35 2.26 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.686 0.794 . . . . 2.03 112.884 -167.724 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -81.23 -38.95 26.12 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 114.276 1.213 . . . . 2.89 114.276 -160.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 46' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' B' ' 42' ' ' VAL . 1.4 mm? -48.93 -44.3 70.23 Favored Pre-proline 0 CA--C 1.532 0.271 0 N-CA-C 114.922 1.453 . . . . 2.12 114.922 -155.287 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -77.51 -36.13 1.35 Allowed 'Trans proline' 0 N--CA 1.448 -1.177 0 N-CA-C 108.92 -1.223 . . . . 2.47 108.92 -44.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -88.79 -35.74 16.47 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 125.231 1.412 . . . . 2.62 110.373 -173.375 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.544 HD23 ' HB2' ' B' ' 83' ' ' LEU . 15.9 tp -42.14 -63.53 0.73 Allowed 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 114.043 1.127 . . . . 1.19 114.043 -172.593 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 35.4 mt -83.39 162.57 21.0 Favored 'General case' 0 C--N 1.338 0.107 0 CA-C-O 121.459 0.647 . . . . 2.04 109.4 175.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 51' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' B' ' 86' ' ' GLU . 0.0 OUTLIER -142.44 154.03 44.21 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 124.762 1.225 . . . . 5.59 108.002 178.315 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 30.2 t0 66.68 82.11 0.19 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 126.486 1.914 . . . . 3.75 109.461 -164.557 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 34.7 m -93.93 11.5 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 CA-C-N 113.735 -1.575 . . . . 1.93 109.485 162.96 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.57 -71.17 1.3 Allowed Glycine 0 C--N 1.339 0.738 0 N-CA-C 106.703 -2.559 . . . . 2.51 106.703 174.807 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.33 55.11 2.16 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 123.13 1.443 . . . . 3.06 109.652 -179.154 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.66 -34.33 74.15 Favored 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 124.235 1.014 . . . . 1.18 108.774 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -44.69 -46.28 10.23 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.4 1.48 . . . . 4.24 112.075 171.841 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -55.49 -48.54 74.42 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.635 0.652 . . . . 2.67 110.215 177.309 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -59.15 -51.67 69.0 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 107.36 -1.348 . . . . 3.38 107.36 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 9.9 tmm? -50.26 -60.57 2.85 Favored 'General case' 0 C--O 1.227 -0.081 0 C-N-CA 124.841 1.256 . . . . 2.89 110.233 -174.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt -59.19 -36.85 76.07 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.591 -0.242 . . . . 4.98 111.6 -175.647 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -68.93 -38.2 79.36 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.943 0.897 . . . . 1.7 111.348 178.53 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 24.0 mt -73.4 -54.26 8.74 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.28 1.032 . . . . 1.53 109.992 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -62.88 -10.2 12.45 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 128.009 2.524 . . . . 2.53 116.244 -166.291 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 21.4 m -33.73 -24.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 119.384 3.105 . . . . 1.67 119.384 -134.08 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -55.17 -27.43 45.66 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 120.894 1.679 . . . . 2.85 111.106 165.063 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 74.35 61.15 0.08 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.557 1.143 . . . . 3.61 110.548 164.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 46.8 p30 -117.92 -16.29 9.92 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.053 1.741 . . . . 1.91 112.587 -177.323 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 1.3 t 69.57 21.33 6.74 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.715 1.143 . . . . 2.58 112.209 -173.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -122.14 99.7 6.57 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 106.124 -1.806 . . . . 3.12 106.124 158.844 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.41 98.09 1.74 Allowed 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.99 -1.856 . . . . 1.21 105.99 172.089 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -84.65 174.99 9.52 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 118.412 0.551 . . . . 4.62 110.484 -179.648 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -92.45 58.8 3.26 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.306 0.642 . . . . 5.62 111.768 -173.701 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -158.28 51.02 0.41 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 108.008 -1.108 . . . . 2.3 108.008 101.248 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -91.04 -62.47 1.44 Allowed 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.043 -1.465 . . . . 2.32 107.043 145.869 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -52.17 -46.98 65.71 Favored 'General case' 0 CA--C 1.512 -0.509 0 C-N-CA 124.595 1.158 . . . . 4.46 111.163 -167.681 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.634 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 56.2 t90 -45.08 -37.54 4.32 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 114.437 -1.256 . . . . 3.9 111.724 -175.341 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -39.69 -45.19 1.65 Allowed 'General case' 0 C--N 1.344 0.33 0 C-N-CA 124.031 0.933 . . . . 4.15 112.483 173.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 17.4 tp -49.59 -45.83 48.44 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.017 0.927 . . . . 1.23 111.551 -178.859 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 70.3 mt -64.53 -26.18 39.66 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.625 0 N-CA-C 108.052 -1.092 . . . . 1.43 108.052 -177.426 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.528 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -70.14 -45.28 56.9 Favored Glycine 0 CA--C 1.503 -0.691 0 C-N-CA 127.066 2.269 . . . . 1.47 112.44 177.549 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -68.53 -53.41 23.27 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 106.73 -1.581 . . . . 2.01 106.73 -177.637 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.544 ' HB2' HD23 ' B' ' 49' ' ' LEU 0.254 3.8 pp -58.22 -37.19 74.38 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 119.962 -0.695 . . . . 1.76 111.585 174.614 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.78 -57.91 10.95 Favored 'General case' 0 C--N 1.34 0.155 0 O-C-N 121.119 -0.988 . . . . 1.5 111.655 175.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 4.5 ptpt -63.08 -36.71 84.48 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.407 -0.806 . . . . 1.9 110.504 -178.449 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' B' ' 51' ' ' LYS . 2.2 mm-40 -44.22 -39.26 4.29 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 124.716 1.206 . . . . 4.9 111.908 -173.449 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 5.2 tt -47.1 -45.32 8.4 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 123.118 0.567 . . . . 1.07 111.677 178.589 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -84.34 -50.63 7.65 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.034 0.534 . . . . 5.13 111.957 166.247 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 27.8 mttp -82.61 86.29 6.85 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 121.263 -0.898 . . . . 5.16 111.638 -169.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -39.57 -45.99 1.7 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.229 1.412 . . . . 5.66 112.754 176.445 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 4.9 pttt 162.47 68.15 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.786 2.435 . . . . 6.82 110.356 163.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 92' ' ' ASP . . . . . 0.404 ' OD2' ' NZ ' ' B' ' 94' ' ' LYS . 2.9 t0 -146.81 154.27 41.16 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.382 -0.97 . . . . 6.43 108.382 157.71 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.532 ' HG ' ' N ' ' B' ' 94' ' ' LYS . 1.8 pt? 167.73 -61.25 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 129.099 2.96 . . . . 5.09 107.695 -171.35 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 94' ' ' LYS . . . . . 0.532 ' N ' ' HG ' ' B' ' 93' ' ' LEU . 0.0 OUTLIER 40.6 -171.94 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.893 2.077 . . . . 7.4 112.519 -158.11 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 6.7 tp -169.32 137.96 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 N-CA-C 106.467 -1.679 . . . . 8.47 106.467 171.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -163.71 96.35 0.83 Allowed 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 107.907 -1.145 . . . . 7.46 107.907 176.931 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.79 135.4 0.3 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 106.742 -1.577 . . . . 8.58 106.742 -162.847 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 10.5 tptp . . . . . 0 C--O 1.254 1.332 0 N-CA-C 105.033 -2.21 . . . . 8.65 105.033 170.052 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.6 mtt . . . . . 0 N--CA 1.473 0.721 0 N-CA-C 107.562 -1.273 . . . . 7.45 107.562 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -169.1 174.41 6.27 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 126.436 1.894 . . . . 2.96 106.48 -176.082 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 85.22 81.45 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 126.743 2.017 . . . . 3.05 110.316 -176.826 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -58.27 124.57 71.49 Favored Pre-proline 0 N--CA 1.448 -0.537 0 C-N-CA 125.766 1.627 . . . . 4.56 110.111 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.65 107.65 2.36 Favored 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 122.467 2.111 . . . . 2.44 109.511 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 77.8 mt -65.47 159.71 23.78 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.554 0.742 . . . . 1.31 110.25 175.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.634 HG22 ' CD ' ' A' ' 10' ' ' GLU . 6.1 t -76.85 170.0 17.29 Favored 'General case' 0 N--CA 1.458 -0.037 0 N-CA-C 109.271 -0.64 . . . . 2.13 109.271 -179.466 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -64.49 -42.85 95.62 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 108.477 -0.934 . . . . 2.86 108.477 -171.058 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.8 mp -63.99 -57.52 9.48 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 118.422 -0.799 . . . . 2.0 111.522 176.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.634 ' CD ' HG22 ' A' ' 7' ' ' THR . 67.4 mt-10 -48.61 -52.6 22.21 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.4 1.48 . . . . 2.76 109.943 178.192 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -51.99 -59.62 4.14 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.794 1.238 . . . . 3.17 109.527 175.011 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.0 p -55.38 -43.35 75.06 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.489 -0.757 . . . . 1.6 111.771 -175.278 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.311 2.7 pp -65.37 -44.23 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 CA-C-O 118.687 -0.673 . . . . 0.63 110.57 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -60.57 -48.79 80.22 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.484 1.038 . . . . 3.87 110.104 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 m -45.65 -46.26 14.51 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.836 1.654 . . . . 2.0 112.613 175.026 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 23.7 m -80.46 -33.55 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 O-C-N 120.817 -1.177 . . . . 0.75 111.712 177.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.5 t -57.7 -39.32 69.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 121.467 -0.77 . . . . 0.77 110.434 175.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.1 t -64.81 -43.14 94.11 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.975 0.807 . . . . 0.64 111.15 175.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.0 m -55.48 -51.55 66.6 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 120.925 -1.109 . . . . 1.14 110.161 173.41 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -48.23 -60.17 2.86 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 109.698 -0.482 . . . . 3.85 109.698 173.221 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -54.16 -53.31 55.2 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.636 0.774 . . . . 3.89 111.225 -173.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 22.0 p -57.08 -60.39 3.66 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 122.551 0.341 . . . . 2.38 110.451 -178.578 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -56.15 -40.58 74.06 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-O 121.178 0.513 . . . . 2.67 111.231 178.346 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.2 -26.92 68.35 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 121.093 -1.005 . . . . 0.85 110.735 -174.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 52.6 ttp180 -79.62 -19.21 49.78 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 117.724 -1.131 . . . . 6.64 112.448 -177.616 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -41.16 -67.34 0.26 Allowed 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.505 1.048 . . . . 1.94 113.623 -173.867 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -98.43 79.81 2.55 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 104.138 -2.541 . . . . 2.56 104.138 178.474 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 38.86 -155.51 0.02 OUTLIER Glycine 0 CA--C 1.525 0.709 0 C-N-CA 127.01 2.243 . . . . 2.78 112.586 -176.364 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 74.9 mtp85 31.66 87.37 0.01 OUTLIER 'General case' 0 C--O 1.24 0.558 0 C-N-CA 126.681 1.992 . . . . 4.87 110.716 165.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' LYS . . . . . 0.55 ' HD3' ' H ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -82.21 43.87 0.83 Allowed 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 127.517 2.327 . . . . 4.96 109.025 -168.603 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -155.51 -52.84 0.09 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 105.521 -2.029 . . . . 4.06 105.521 -142.322 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 16.5 p -106.72 136.78 45.93 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 125.732 1.613 . . . . 1.97 109.917 169.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -83.82 130.31 34.93 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 105.98 -1.859 . . . . 1.91 105.98 157.816 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 21.2 t -81.32 177.39 9.02 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.332 1.453 . . . . 2.47 107.62 169.069 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 76.5 t -62.2 -52.1 64.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 121.728 -0.607 . . . . 2.64 110.03 -174.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -60.67 -55.74 29.58 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 118.701 -0.666 . . . . 2.16 109.62 177.056 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -39.0 -54.24 1.69 Allowed 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 126.028 1.731 . . . . 1.99 111.968 173.601 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -57.0 -54.18 49.63 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.434 0.693 . . . . 2.9 109.291 177.516 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 48.4 tttt -56.81 -39.19 73.71 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.258 0.466 . . . . 2.57 112.258 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -49.9 -33.07 16.16 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 119.41 1.005 . . . . 3.0 111.882 177.568 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -63.38 -46.13 87.88 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 108.256 -1.016 . . . . 2.21 108.256 -178.549 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.4 m -75.77 -38.9 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-N 115.771 -0.65 . . . . 1.32 109.913 -174.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 50.0 m -61.45 -44.47 97.05 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.875 0.87 . . . . 1.83 111.378 174.994 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -76.44 -57.88 3.61 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.88 -0.415 . . . . 2.97 109.88 -170.262 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -100.81 -124.65 0.17 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.074 -0.713 . . . . 3.52 109.074 -175.852 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.4 mp 24.22 64.21 0.41 Allowed Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 127.625 2.37 . . . . 1.99 113.762 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -78.59 -49.49 0.08 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.221 1.947 . . . . 1.77 111.331 -171.655 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -112.48 -28.68 7.77 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.277 1.431 . . . . 3.33 111.335 -173.998 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.684 HD13 ' HG2' ' B' ' 10' ' ' GLU . 6.5 tp -65.03 -79.52 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.061 1.344 . . . . 1.23 110.997 -171.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.1 mt -78.46 165.34 23.88 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 108.345 -0.983 . . . . 2.74 108.345 165.236 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.74 161.1 9.09 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 105.816 -1.92 . . . . 6.51 105.816 -166.635 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 46.7 t0 60.11 78.27 0.28 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 123.057 1.408 . . . . 5.01 108.82 -163.492 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.1 m -85.3 12.42 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 113.552 -1.658 . . . . 2.66 110.089 166.373 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.97 -66.48 1.66 Allowed Glycine 0 C--N 1.34 0.779 0 N-CA-C 106.444 -2.662 . . . . 2.02 106.444 167.426 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.3 t -78.23 61.0 2.62 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 122.291 1.043 . . . . 2.59 110.841 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -79.77 -39.68 30.42 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 125.471 1.508 . . . . 1.36 108.513 169.728 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -40.7 -53.2 2.84 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.853 1.661 . . . . 4.88 112.167 171.045 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -48.81 -56.61 8.18 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.193 1.397 . . . . 3.02 111.094 174.258 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.56 -51.94 65.4 Favored 'General case' 0 C--O 1.225 -0.235 0 N-CA-C 108.406 -0.961 . . . . 3.03 108.406 177.016 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -47.75 -52.24 19.3 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 123.941 0.896 . . . . 1.67 110.12 -176.151 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -62.95 -39.4 94.51 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 118.08 0.4 . . . . 2.93 111.685 178.183 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.4 t -60.13 -37.06 78.92 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.934 -0.479 . . . . 1.77 111.567 175.762 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.6 mp -77.42 -55.56 5.29 Favored 'General case' 0 CA--C 1.528 0.103 0 O-C-N 121.141 -0.975 . . . . 1.94 110.93 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -76.45 69.72 2.94 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.076 0.95 . . . . 1.78 110.035 -174.963 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 20.5 m -49.36 -33.09 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 124.534 1.134 . . . . 1.72 112.827 -176.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -96.44 0.78 50.91 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.196 0.813 . . . . 2.75 113.196 -176.752 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 44.93 65.49 1.08 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.885 1.674 . . . . 5.11 112.541 176.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 30.6 p30 -107.48 -8.34 16.28 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.614 1.166 . . . . 2.09 111.089 171.49 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 44.0 m 61.08 23.82 13.97 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.523 1.129 . . . . 1.57 112.438 -171.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -120.39 108.94 14.74 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 106.691 -1.596 . . . . 3.25 106.691 163.703 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -80.53 89.16 5.64 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 103.686 -2.709 . . . . 1.24 103.686 177.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.8 ttpm? -68.49 161.17 28.35 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.734 1.214 . . . . 3.91 108.945 -174.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -37.7 -62.04 0.57 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.403 1.081 . . . . 5.37 113.279 -168.054 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -70.25 -33.33 71.49 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 111.701 0.26 . . . . 1.92 111.701 -176.597 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -61.84 -60.01 4.29 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 108.826 -0.805 . . . . 1.99 108.826 177.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -48.34 -52.92 19.41 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 124.048 0.939 . . . . 2.62 109.505 174.496 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.554 ' CE2' ' CZ2' ' B' ' 77' ' ' TRP . 12.8 t-105 -51.01 -29.38 12.34 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 117.498 -1.239 . . . . 4.89 111.435 -178.195 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 36.6 ttt180 -43.75 -43.81 6.27 Favored 'General case' 0 C--N 1.351 0.659 0 CA-C-N 120.471 1.487 . . . . 5.63 110.712 171.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.5 tp -44.53 -45.54 9.38 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 122.851 0.46 . . . . 1.0 110.854 178.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ILE . . . . . 0.404 HD12 ' N ' ' A' ' 80' ' ' ILE . 1.5 mp -69.51 -32.74 54.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 108.961 -0.755 . . . . 1.93 108.961 -175.615 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.431 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -58.74 -44.84 95.55 Favored Glycine 0 CA--C 1.506 -0.469 0 N-CA-C 110.175 -1.17 . . . . 1.51 110.175 169.346 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -76.53 -33.61 58.57 Favored 'General case' 0 N--CA 1.438 -1.029 0 N-CA-C 108.653 -0.869 . . . . 2.35 108.653 -169.698 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.414 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 9.1 mp -52.77 -54.71 30.07 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.042 0.837 . . . . 2.25 109.786 161.078 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.36 -26.88 66.94 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.889 0.475 . . . . 1.85 111.9 -178.048 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.409 ' HB2' ' HE3' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -68.63 -61.1 1.97 Allowed 'General case' 0 C--O 1.217 -0.628 0 O-C-N 121.579 -0.701 . . . . 2.29 109.628 162.894 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -53.14 -43.61 67.13 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.634 1.574 . . . . 3.51 112.062 -164.977 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' ILE . . . . . 0.428 HD12 ' OE2' ' B' ' 10' ' ' GLU . 11.7 tt -53.29 -37.12 27.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-O 121.816 0.817 . . . . 1.67 111.366 173.978 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.08 -63.51 1.27 Allowed 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 126.288 1.835 . . . . 5.51 110.167 -171.294 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 35.6 tttp -77.28 49.1 0.67 Allowed 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.609 1.964 . . . . 4.38 113.585 -162.447 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -68.91 -19.61 64.21 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.095 -1.003 . . . . 8.21 112.127 -176.267 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 37.6 tptt -165.82 -35.07 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.045 0.538 . . . . 9.75 112.218 176.055 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 68.54 -32.47 0.22 Allowed 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 126.63 1.972 . . . . 7.37 113.723 -175.702 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 64.1 tp -64.88 -86.07 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.858 0 C-N-CA 124.918 1.287 . . . . 10.27 110.935 -176.076 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -163.03 75.75 0.41 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.707 0.685 . . . . 16.78 110.128 -167.87 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 10.4 tp -152.35 70.26 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 119.517 1.053 . . . . 9.35 113.295 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . 0.405 6.4 ptm180 173.11 -114.64 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 127.838 2.455 . . . . 12.71 107.54 144.944 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -176.79 138.5 0.27 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 120.637 1.562 . . . . 12.98 108.594 -173.859 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 96.3 mttt . . . . . 0 C--O 1.25 1.082 0 C-N-CA 127.338 2.255 . . . . 14.38 113.427 171.741 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 3.9 mpp? . . . . . 0 N--CA 1.469 0.522 0 CA-C-O 118.258 -0.877 . . . . 6.55 109.69 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 2' ' ' ALA . . . . . 0.483 ' HA ' ' CB ' ' B' ' 3' ' ' ALA . . . -50.56 146.23 5.77 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-O 117.116 -1.421 . . . . 5.4 110.56 171.898 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 3' ' ' ALA . . . . . 0.483 ' CB ' ' HA ' ' B' ' 2' ' ' ALA . . . 100.86 98.36 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.778 1 C-N-CA 135.725 5.61 . . . . 5.35 110.163 11.838 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -144.5 132.48 10.69 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 126.664 1.986 . . . . 5.57 107.019 -173.451 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -78.43 149.48 24.42 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 123.924 3.082 . . . . 4.27 111.212 -176.393 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 13.1 mt -138.62 -112.55 0.16 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.791 1.237 . . . . 3.51 112.714 -160.666 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 4.7 t -110.68 -80.83 0.58 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.619 1.34 . . . . 2.51 114.619 -161.508 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -162.58 -72.23 0.05 OUTLIER 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.935 0.894 . . . . 3.25 108.658 -173.134 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.5 mt -56.41 -50.03 72.79 Favored 'General case' 0 C--N 1.338 0.102 0 N-CA-C 109.215 -0.661 . . . . 1.18 109.215 171.554 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.684 ' HG2' HD13 ' A' ' 49' ' ' LEU . 3.3 tm-20 -43.66 -62.6 1.04 Allowed 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 124.269 1.028 . . . . 4.72 111.092 167.2 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -48.42 -42.61 32.65 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.262 0.553 . . . . 4.0 109.768 -177.181 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 14.7 m -62.84 -36.92 84.83 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.154 0.981 . . . . 1.54 112.617 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.272 1.9 pp -75.7 -37.39 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 118.913 0.779 . . . . 1.02 111.029 171.382 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 14' ' ' GLU . . . . . 0.4 ' HG2' HD11 ' A' ' 87' ' ' ILE . 4.9 tm-20 -57.71 -59.09 5.74 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 118.895 0.77 . . . . 2.38 109.602 177.878 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.4 t -47.32 -44.84 23.9 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.005 0.821 . . . . 1.22 112.097 -174.878 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.1 m -73.03 -43.83 57.84 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 O-C-N 120.987 -1.071 . . . . 0.83 110.843 178.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 37.1 t -53.69 -51.28 45.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 O-C-N 121.405 -0.809 . . . . 1.17 110.617 175.131 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 13.7 t -60.05 -48.91 79.74 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 117.457 -1.258 . . . . 1.48 110.355 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 99.0 m -46.14 -57.67 4.3 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 120.634 1.561 . . . . 1.31 109.671 175.287 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 10.5 m-30 -55.63 -61.28 2.46 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.343 0.497 . . . . 6.8 112.343 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -69.49 -33.95 73.62 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 119.165 0.893 . . . . 4.44 112.025 -169.939 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 64.6 p -61.44 -55.53 30.31 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 108.449 -0.945 . . . . 3.57 108.449 170.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -55.44 -38.11 68.59 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.046 0.839 . . . . 2.98 112.038 -177.836 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.32 -19.7 9.44 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 127.417 2.287 . . . . 1.5 112.323 176.511 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -17.54 10.17 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.609 1.163 . . . . 3.44 112.444 170.589 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.497 ' CB ' ' HG3' ' B' ' 37' ' ' GLU . 0.0 OUTLIER -47.68 -65.62 0.54 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 115.082 1.512 . . . . 1.94 115.082 -173.925 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . 0.342 17.4 mt-10 -82.42 -17.65 44.63 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 118.621 2.823 . . . . 3.22 118.621 -161.574 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.21 -107.16 0.58 Allowed Glycine 0 C--N 1.338 0.655 1 C-N-CA 133.601 5.381 . . . . 3.49 114.093 -4.521 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.26 86.6 0.13 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 107.525 -1.287 . . . . 4.61 107.525 -175.467 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 14.6 pttm -81.95 14.47 2.74 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 115.558 1.688 . . . . 3.77 115.558 -157.881 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 21.5 p-10 -120.11 -49.19 2.3 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 124.131 0.972 . . . . 3.09 109.158 171.898 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 85.1 p -68.63 131.38 45.11 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 123.404 0.682 . . . . 1.94 110.458 -179.524 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.6 mp -94.04 112.34 24.16 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 106.675 -1.602 . . . . 3.08 106.675 164.206 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 42.0 m -81.69 -174.36 4.96 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 128.183 2.593 . . . . 3.33 107.775 178.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 75.5 t -68.15 -95.5 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.432 0 N-CA-C 103.575 -2.75 . . . . 3.03 103.575 -171.67 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -72.44 70.12 0.87 Allowed 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 120.659 1.572 . . . . 2.78 108.724 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.497 ' HG3' ' CB ' ' B' ' 26' ' ' GLN . 25.8 tt0 -159.0 -56.0 0.06 Allowed 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 131.54 3.936 . . . . 2.53 104.282 178.719 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 38' ' ' PHE . . . . . 0.405 ' CE2' ' CE2' ' B' ' 76' ' ' TYR . 0.8 OUTLIER -60.19 -51.74 68.31 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.478 -0.934 . . . . 2.37 108.478 166.996 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 50.2 tttt -59.42 -32.64 70.37 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 119.285 -0.966 . . . . 2.65 111.894 -169.9 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -55.3 -34.46 64.15 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.705 -0.622 . . . . 3.31 112.424 174.036 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.4 tt -69.73 -45.17 68.76 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.111 0.869 . . . . 1.89 109.262 -176.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.428 HG11 HD23 ' B' ' 56' ' ' LEU . 30.4 m -68.12 -36.9 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 N-CA-C 109.447 -0.575 . . . . 0.98 109.447 -175.613 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 99.4 m -62.51 -60.51 3.43 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 122.639 0.376 . . . . 1.13 111.268 169.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -82.47 -59.11 2.64 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.759 0.824 . . . . 2.41 112.938 -164.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -81.67 -32.75 31.64 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.022 0.929 . . . . 3.3 112.34 -165.546 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 46' ' ' LEU . . . . . 0.416 HD11 HD21 ' B' ' 83' ' ' LEU . 13.6 tp -82.82 -14.61 0.21 Allowed Pre-proline 0 CA--C 1.545 0.753 0 N-CA-C 118.816 2.895 . . . . 1.51 118.816 -164.016 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -40.14 -62.95 0.32 Allowed 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 125.277 3.985 . . . . 2.29 117.857 -132.846 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 12.4 t-160 -88.8 54.0 2.88 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 119.975 1.261 . . . . 3.61 110.534 -156.338 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 14.2 tp -145.57 -107.24 0.1 Allowed 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 123.727 0.811 . . . . 1.84 109.981 -166.101 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 2.4 mp -69.42 92.95 0.63 Allowed 'General case' 0 CA--C 1.531 0.242 0 O-C-N 120.913 -1.117 . . . . 2.13 110.483 178.649 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.01 149.47 0.04 OUTLIER 'General case' 0 C--O 1.237 0.42 0 C-N-CA 125.443 1.497 . . . . 6.0 113.476 174.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 19.4 t0 54.8 41.65 31.75 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 123.205 1.479 . . . . 5.0 107.335 176.793 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 17.0 m 35.8 45.93 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 C-N-CA 127.739 2.416 . . . . 4.18 113.093 -170.437 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 68.33 8.2 54.47 Favored Glycine 0 CA--C 1.526 0.735 0 C-N-CA 125.414 1.483 . . . . 7.11 114.865 177.742 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . 0.274 0.5 OUTLIER 49.35 66.07 1.22 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 123.493 1.616 . . . . 4.23 110.044 -175.525 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 56' ' ' LEU . . . . . 0.428 HD23 HG11 ' B' ' 42' ' ' VAL . 0.2 OUTLIER -49.32 -26.49 3.14 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.11 1.764 . . . . 2.26 114.123 -178.295 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -50.03 -74.33 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.983 0.913 . . . . 4.15 112.35 166.285 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -50.28 -45.35 54.34 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 119.211 0.914 . . . . 2.58 109.585 173.89 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.23 -39.21 85.86 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 118.834 -0.603 . . . . 2.93 111.644 -172.612 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 5.0 ttt -55.3 -45.15 76.28 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 119.4 1.0 . . . . 2.1 108.744 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.48 -43.13 98.18 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.112 -0.993 . . . . 4.73 111.121 175.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 2.6 m -58.72 -41.67 86.9 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.859 0.754 . . . . 1.73 112.853 176.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 33.3 mt -82.68 -60.13 2.28 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.886 1.674 . . . . 1.38 111.457 -172.797 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.282 4.3 t0 -64.85 -7.21 10.35 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.662 2.385 . . . . 2.48 116.506 -157.702 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.1 m -36.61 -25.36 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 130.985 3.714 . . . . 2.16 117.841 -154.116 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 35.8 p30 -65.8 -20.69 66.35 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 120.088 1.313 . . . . 3.51 112.332 175.263 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 112.57 -43.72 0.0 OUTLIER 'General case' 0 C--N 1.344 0.354 0 C-N-CA 129.331 3.052 . . . . 4.93 111.169 164.042 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -46.56 117.82 1.76 Allowed 'General case' 0 C--O 1.232 0.183 0 C-N-CA 123.763 0.825 . . . . 3.87 109.441 173.085 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 7.8 t -70.04 63.74 0.22 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.515 1.926 . . . . 2.49 110.637 -176.245 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -161.26 118.9 2.32 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 127.769 2.427 . . . . 3.26 105.251 -171.579 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -87.96 110.77 20.82 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.082 -1.081 . . . . 1.66 108.082 174.755 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -82.33 158.76 23.28 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 107.377 -1.342 . . . . 6.64 107.377 170.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -86.04 56.89 4.18 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.171 -0.956 . . . . 4.11 111.566 169.802 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 74' ' ' ASN . . . . . 0.407 ' HB2' ' CD ' ' A' ' 85' ' ' LYS . 1.7 t-20 -152.82 49.3 0.73 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 119.987 -0.685 . . . . 2.52 109.868 111.554 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -93.28 -61.94 1.47 Allowed 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 127.437 2.295 . . . . 2.53 107.678 134.857 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.405 ' CE2' ' CE2' ' B' ' 38' ' ' PHE . 16.2 t80 -46.23 -40.79 11.97 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 127.584 2.354 . . . . 3.93 111.99 -174.306 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.554 ' CZ2' ' CE2' ' A' ' 77' ' ' TRP . 41.7 t90 -50.91 -35.41 32.93 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 112.668 0.618 . . . . 4.06 112.668 -175.348 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -45.18 -33.79 2.44 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 122.893 0.477 . . . . 4.41 111.943 174.486 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 17.7 tp -60.86 -48.12 83.26 Favored 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 124.645 1.178 . . . . 1.18 108.89 -175.156 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . 0.296 5.2 pt -71.78 -18.01 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.376 0 C-N-CA 117.6 -1.64 . . . . 2.96 108.477 -175.384 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.554 ' HA2' ' CE2' ' A' ' 77' ' ' TRP . . . -67.7 -47.49 61.27 Favored Glycine 0 N--CA 1.443 -0.857 0 C-N-CA 125.108 1.337 . . . . 1.6 110.241 172.841 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -56.66 -63.13 1.3 Allowed 'General case' 0 N--CA 1.44 -0.956 0 CA-C-O 117.089 -1.434 . . . . 3.22 107.756 168.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.416 HD21 HD11 ' B' ' 46' ' ' LEU . 8.6 mp -41.76 -56.24 2.74 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 121.0 1.727 . . . . 2.06 113.286 -177.707 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.87 -28.01 63.78 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 125.159 1.383 . . . . 1.24 112.198 -176.487 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.77 -60.84 2.22 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 118.145 -0.931 . . . . 1.92 109.941 164.556 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -59.3 -24.35 63.22 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.807 0.843 . . . . 2.29 112.465 -158.407 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 11.4 tt -45.85 -53.09 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 CA-C-N 118.569 0.622 . . . . 1.88 111.249 164.723 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 49.5 ttt85 -85.21 -61.47 1.76 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.407 1.883 . . . . 5.33 113.957 171.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -64.18 139.11 58.73 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.316 1.046 . . . . 4.71 111.749 -166.803 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -83.79 -61.96 1.69 Allowed 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.028 -0.42 . . . . 5.17 110.953 -168.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -175.31 27.43 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.403 1.881 . . . . 6.99 109.616 176.256 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -103.47 41.33 1.28 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 128.336 2.655 . . . . 4.32 108.478 -165.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.448 ' CG ' ' H ' ' B' ' 94' ' ' LYS . 0.3 OUTLIER -99.18 -104.19 0.22 Allowed 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 125.861 1.664 . . . . 4.86 108.189 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 94' ' ' LYS . . . . . 0.448 ' H ' ' CG ' ' B' ' 93' ' ' LEU . 1.0 OUTLIER 67.12 175.34 0.25 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.029 1.732 . . . . 7.54 110.22 -177.201 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 7.7 tp -164.29 143.72 2.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.148 0 N-CA-C 107.704 -1.221 . . . . 7.92 107.704 176.57 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.74 148.59 14.19 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 105.84 -1.911 . . . . 6.65 105.84 167.482 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -178.31 139.04 0.19 Allowed 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 104.219 -2.512 . . . . 8.38 104.219 -168.759 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.172 0 N-CA-C 106.118 -1.808 . . . . 8.54 106.118 161.143 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.6 mtp . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 107.48 -1.304 . . . . 7.58 107.48 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.7 174.86 2.63 Favored 'General case' 0 C--O 1.232 0.142 0 O-C-N 123.842 0.714 . . . . 4.49 109.896 165.014 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.44 58.94 0.0 OUTLIER 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 129.386 3.074 . . . . 3.41 109.004 -168.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -62.15 135.65 95.03 Favored Pre-proline 0 N--CA 1.446 -0.64 0 C-N-CA 125.741 1.617 . . . . 4.91 110.777 -173.457 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.64 110.52 2.91 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 122.888 2.392 . . . . 2.59 110.452 -177.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.2 mt -70.58 159.72 33.82 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.141 0.976 . . . . 1.45 109.614 173.419 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.6 t -72.89 165.74 24.35 Favored 'General case' 0 N--CA 1.464 0.264 0 O-C-N 121.545 -0.722 . . . . 1.72 109.457 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -57.19 -47.12 82.06 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 118.991 0.814 . . . . 4.07 109.657 -177.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mp -57.45 -58.39 8.48 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 117.755 -1.117 . . . . 1.71 111.222 178.597 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -49.25 -56.03 10.72 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.097 1.359 . . . . 2.56 110.419 177.697 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.1 tp10 -52.55 -52.37 55.23 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.922 1.689 . . . . 3.23 110.379 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.2 p -67.05 -45.2 78.14 Favored 'General case' 0 C--O 1.234 0.245 0 O-C-N 121.762 -0.587 . . . . 1.58 111.261 -176.795 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.296 2.9 pp -62.88 -36.55 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 O-C-N 121.421 -0.8 . . . . 0.72 109.432 177.763 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -60.11 -57.83 11.12 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 118.863 0.756 . . . . 2.84 109.94 171.44 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -54.37 -36.33 63.77 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.42 1.009 . . . . 1.47 111.989 -171.75 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.3 m -73.92 -47.4 43.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 O-C-N 121.467 -0.77 . . . . 0.93 110.833 172.498 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.8 t -50.59 -50.21 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-N 119.309 0.959 . . . . 0.53 111.622 177.382 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.4 t -60.03 -44.28 94.73 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.941 0.791 . . . . 1.18 110.479 176.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 63.7 m -52.67 -51.89 58.26 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.641 1.109 . . . . 1.14 109.215 174.722 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -56.6 -55.67 31.03 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 122.995 0.518 . . . . 6.89 110.732 178.559 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -68.06 -44.49 76.25 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 125.298 1.439 . . . . 2.89 110.646 -166.096 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 66.4 p -56.17 -57.82 10.56 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.389 -0.967 . . . . 3.49 108.389 170.962 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -52.7 -40.91 63.41 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 122.662 0.385 . . . . 2.91 111.959 -178.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.89 -16.83 32.37 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 128.323 2.649 . . . . 1.31 112.802 -178.546 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.5 -28.94 67.49 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 118.24 -0.886 . . . . 3.8 111.625 169.012 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -41.92 -62.89 0.82 Allowed 'General case' 0 C--N 1.344 0.348 0 C-N-CA 124.289 1.035 . . . . 1.95 113.055 -167.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 63.5 mt-10 -124.11 177.49 5.79 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 126.193 1.797 . . . . 2.89 107.502 -177.002 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -15.2 125.28 0.01 OUTLIER Glycine 0 CA--C 1.533 1.176 0 C-N-CA 127.852 2.644 . . . . 1.41 115.187 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? 64.1 105.53 0.03 OUTLIER 'General case' 0 C--O 1.237 0.43 0 C-N-CA 124.482 1.113 . . . . 4.2 112.214 177.97 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -67.15 60.02 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.856 0.862 . . . . 4.05 111.18 166.437 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -164.37 -64.83 0.04 OUTLIER 'General case' 0 N--CA 1.458 -0.066 0 C-N-CA 125.593 1.557 . . . . 3.71 107.322 -177.861 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 p -85.52 159.72 19.84 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 125.157 1.383 . . . . 1.82 110.836 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -100.12 175.66 5.67 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 107.761 -1.2 . . . . 2.28 107.761 172.99 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.9 t -144.33 179.78 7.03 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 126.781 2.033 . . . . 2.12 106.277 177.752 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 67.7 t -47.81 -64.02 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 123.533 0.733 . . . . 2.17 111.467 -175.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -66.57 -50.76 62.05 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 119.163 -0.446 . . . . 1.99 110.267 -176.239 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -39.01 -50.67 1.8 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.169 0.988 . . . . 2.19 113.139 170.293 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -65.27 -51.63 59.52 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.953 0.901 . . . . 2.78 109.169 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 41.6 tttm -56.98 -42.25 79.87 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 120.64 -0.424 . . . . 3.5 110.171 -175.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -50.3 -42.2 52.13 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.49 0.716 . . . . 3.24 111.604 174.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 tp -61.47 -48.15 82.43 Favored 'General case' 0 CA--C 1.527 0.076 0 O-C-N 120.663 -1.273 . . . . 2.86 109.357 -175.995 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.5 m -72.75 -45.71 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 CA-C-O 121.681 0.753 . . . . 1.07 109.43 -172.608 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 84.2 m -64.71 -45.37 86.85 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.211 1.004 . . . . 1.17 110.035 -177.368 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -81.18 -60.33 2.32 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.109 0.964 . . . . 2.83 110.734 -174.323 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -111.97 57.11 0.64 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.853 0.861 . . . . 4.64 112.478 -175.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 tp -159.1 81.17 2.65 Favored Pre-proline 0 CA--C 1.542 0.647 0 O-C-N 121.057 -1.027 . . . . 1.84 109.428 167.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -75.35 -44.41 0.31 Allowed 'Trans proline' 0 N--CA 1.452 -0.943 0 C-N-CA 123.302 2.668 . . . . 2.14 112.048 -167.385 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 35.8 t-80 -109.79 -74.88 0.64 Allowed 'General case' 0 C--N 1.343 0.319 0 CA-C-N 118.499 0.591 . . . . 3.19 110.523 176.919 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.547 HD23 HD22 ' A' ' 83' ' ' LEU . 7.2 tp 8.45 -91.78 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.969 2.508 . . . . 1.47 116.972 -166.265 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.4 mt -79.67 -27.66 40.79 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.382 1.073 . . . . 3.06 111.707 -178.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 42.5 mmtt 53.33 -166.42 0.07 Allowed 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 125.092 1.357 . . . . 8.54 110.073 -156.712 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.413 ' OD2' ' NZ ' ' A' ' 59' ' ' LYS . 15.4 t0 58.7 52.08 7.11 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-O 125.021 2.343 . . . . 3.85 109.705 172.458 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.57 -1.17 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 CA-C-N 111.529 -2.578 . . . . 3.26 110.318 163.776 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.87 -66.37 1.45 Allowed Glycine 0 C--N 1.342 0.888 0 C-N-CA 125.527 1.536 . . . . 1.71 110.747 171.29 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 t -78.1 68.22 4.09 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.486 1.143 . . . . 1.99 108.964 -176.005 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -81.29 -36.08 30.26 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 125.118 1.367 . . . . 1.31 110.98 -172.811 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -53.96 -44.04 70.39 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.693 -0.629 . . . . 3.97 112.014 -175.511 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -57.53 -42.64 83.3 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.36 -0.838 . . . . 3.85 111.912 174.676 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.413 ' NZ ' ' OD2' ' A' ' 52' ' ' ASP . 0.2 OUTLIER -61.82 -49.41 76.4 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.217 -0.927 . . . . 3.41 109.043 172.383 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 10.3 ttt -49.66 -45.83 49.07 Favored 'General case' 0 C--O 1.22 -0.453 0 N-CA-C 110.055 -0.35 . . . . 2.26 110.055 178.109 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -62.68 -37.69 87.42 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.251 0.62 . . . . 3.31 111.224 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.8 t -58.15 -40.69 82.01 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 118.667 0.667 . . . . 2.91 110.358 170.737 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.7 mt -73.94 -78.84 0.09 Allowed 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.671 -0.643 . . . . 2.59 111.003 178.011 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -77.77 67.87 3.73 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.803 2.041 . . . . 2.14 110.006 -174.215 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 15.5 m -57.26 -19.65 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 113.349 0.87 . . . . 3.15 113.349 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -92.54 -9.69 40.33 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.898 1.279 . . . . 2.82 113.259 176.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 48.81 56.6 7.44 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.644 1.111 . . . . 3.28 111.624 -176.929 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 56.8 p-10 -95.36 -9.87 31.68 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.004 0.522 . . . . 2.25 110.265 170.68 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.2 m 63.61 20.73 12.39 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.595 1.158 . . . . 1.99 111.912 -173.815 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.63 111.49 16.28 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 105.346 -2.094 . . . . 3.25 105.346 171.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -84.84 93.64 8.55 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.025 -1.842 . . . . 1.43 106.025 173.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.22 155.6 4.79 Favored 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 123.565 0.746 . . . . 4.23 109.225 174.087 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -46.27 -55.54 7.05 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 119.099 0.863 . . . . 4.98 112.916 -172.364 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -60.09 -42.34 94.44 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.126 0.965 . . . . 1.77 111.472 176.757 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -59.89 -42.52 93.98 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.025 1.73 . . . . 2.04 110.066 -176.801 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -66.73 -52.59 42.64 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 124.956 1.302 . . . . 2.67 109.63 172.084 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.506 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 1.7 t-105 -42.99 -42.95 3.97 Favored 'General case' 0 C--N 1.344 0.365 0 O-C-N 123.735 0.647 . . . . 4.76 109.819 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 44.0 mtt180 -37.0 -50.3 0.88 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.302 1.041 . . . . 4.48 111.447 -174.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.2 tp -45.36 -48.92 13.32 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 123.611 0.764 . . . . 0.74 110.941 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.0 mp -69.02 -34.2 62.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 C-N-CA 124.91 1.284 . . . . 1.87 109.055 -173.935 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.425 ' HA2' ' CD1' ' B' ' 77' ' ' TRP . . . -63.55 -43.97 97.27 Favored Glycine 0 N--CA 1.442 -0.902 0 N-CA-C 110.733 -0.947 . . . . 1.31 110.733 172.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -59.89 -49.32 78.16 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 118.796 -0.621 . . . . 3.02 109.692 173.658 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.547 HD22 HD23 ' A' ' 49' ' ' LEU . 29.3 mt -49.25 -48.42 45.75 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.789 1.177 . . . . 2.47 112.448 -179.472 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.18 -25.92 35.69 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.416 0.686 . . . . 1.22 112.217 177.486 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -81.25 -58.26 3.13 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.292 1.837 . . . . 2.35 109.848 168.383 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -49.71 -38.89 35.09 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.662 1.585 . . . . 2.54 113.048 -172.64 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.6 tt -49.42 -37.03 10.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 112.223 0.453 . . . . 1.21 112.223 176.225 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -98.43 -44.85 6.35 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.961 1.304 . . . . 5.95 110.451 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 35.8 tttp -71.57 65.05 0.46 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 126.114 1.766 . . . . 2.86 109.792 178.278 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.82 -43.67 24.75 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 121.29 -0.881 . . . . 7.2 111.098 -176.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 16.1 tptt -162.36 67.08 0.23 Allowed 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 122.502 1.144 . . . . 8.17 108.74 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -75.64 63.91 1.63 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 126.667 1.987 . . . . 7.51 111.268 -175.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -140.08 -47.7 0.44 Allowed 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 123.915 0.886 . . . . 8.21 109.56 164.687 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -87.65 -47.28 8.8 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 119.095 -0.478 . . . . 10.74 110.08 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 77.4 mt 68.79 -64.25 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 125.962 1.705 . . . . 12.45 111.529 174.135 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? 78.84 -45.02 0.37 Allowed 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 128.14 2.576 . . . . 12.32 114.755 155.346 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . 2.278 39.4 mttp -178.26 130.36 0.13 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.905 1.682 . . . . 15.66 108.507 -157.025 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.406 ' NZ ' ' C ' ' A' ' 98' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.256 1.401 0 N-CA-C 104.531 -2.396 . . . . 13.44 104.531 163.94 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.41 1.2 ppp? . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 116.199 -1.857 . . . . 6.02 106.627 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 114.23 73.99 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 127.463 2.305 . . . . 5.72 115.633 160.672 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 27.53 100.92 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 117.754 2.501 . . . . 3.86 117.754 137.397 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -91.5 151.86 43.0 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 123.921 0.888 . . . . 9.07 110.717 168.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.57 162.92 37.08 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.868 3.046 . . . . 3.63 110.51 171.963 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 38.9 mt -139.72 150.28 44.65 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.686 0.794 . . . . 2.53 111.717 -159.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.5 HG23 ' N ' ' B' ' 8' ' ' GLU . 6.5 t -90.9 -66.6 0.91 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.39 2.276 . . . . 2.6 115.07 -173.534 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.5 ' N ' HG23 ' B' ' 7' ' ' THR . 37.5 tt0 -169.9 -75.66 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.92 0.888 . . . . 2.18 108.69 -162.348 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mt -56.83 -45.44 82.35 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 120.828 -1.17 . . . . 1.13 109.774 165.792 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.484 ' HB2' ' H ' ' B' ' 7' ' ' THR . 72.1 mt-10 -50.77 -48.78 59.25 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.932 0.893 . . . . 3.13 110.768 170.751 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -58.18 -45.74 87.0 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.085 -1.009 . . . . 3.64 110.791 176.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -60.24 -47.68 84.96 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 124.255 1.022 . . . . 1.7 110.752 -177.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.285 2.9 pp -61.68 -33.21 56.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 120.322 -0.551 . . . . 0.95 110.319 174.58 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.7 -58.97 5.96 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 118.687 0.676 . . . . 2.64 111.404 172.351 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 t -51.02 -40.1 57.39 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.386 0.994 . . . . 1.18 111.559 -168.483 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.16 -43.58 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 O-C-N 121.366 -0.834 . . . . 0.94 111.802 174.729 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 37.9 t -54.31 -58.37 3.91 Favored 'Isoleucine or valine' 0 C--N 1.341 0.21 0 CA-C-N 118.572 0.624 . . . . 1.1 110.334 174.17 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 13.8 t -56.23 -47.22 78.88 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 118.667 -0.682 . . . . 1.17 110.562 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 98.3 m -58.49 -44.34 89.36 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 119.651 1.114 . . . . 1.3 111.82 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -66.06 -43.82 86.32 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 117.952 -1.499 . . . . 4.17 110.131 175.029 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -57.81 -46.49 84.59 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.119 0.968 . . . . 2.9 111.824 -174.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 31.4 p -62.28 -25.43 67.85 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.392 -0.817 . . . . 2.24 111.654 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -80.52 -46.17 16.26 Favored 'General case' 0 C--O 1.224 -0.254 0 O-C-N 121.978 -0.451 . . . . 3.41 110.491 170.123 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.03 -25.41 58.57 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 127.787 2.435 . . . . 0.94 111.938 -178.064 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -45.09 -37.37 4.22 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.783 1.233 . . . . 4.42 111.021 171.267 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.463 ' HB2' ' HG2' ' B' ' 37' ' ' GLU . 0.5 OUTLIER -60.93 -70.02 0.2 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 116.708 2.114 . . . . 2.68 116.708 -142.032 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -92.53 -74.3 0.52 Allowed 'General case' 0 C--N 1.34 0.185 0 C-N-CA 119.089 -1.044 . . . . 3.59 113.463 -166.825 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.38 152.86 22.95 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 126.384 1.945 . . . . 1.77 109.17 164.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 29.9 ttt180 43.37 100.64 0.0 OUTLIER 'General case' 0 C--O 1.241 0.63 0 C-N-CA 125.158 1.383 . . . . 4.05 113.992 146.807 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 59.9 pttt -61.06 -22.32 64.49 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 114.538 1.31 . . . . 3.41 114.538 -168.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -77.59 -25.52 50.0 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.488 0.551 . . . . 4.09 112.488 177.131 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 96.4 p -83.84 141.78 31.09 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 117.88 -1.057 . . . . 2.7 110.836 -172.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -93.31 115.34 27.92 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 106.124 -1.806 . . . . 2.09 106.124 149.366 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 9.1 t -99.92 177.67 5.04 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.047 0.539 . . . . 2.16 109.671 161.464 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 11.5 p -85.76 50.81 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 O-C-N 120.724 -1.235 . . . . 2.55 111.423 -173.554 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -159.75 53.28 0.36 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 107.38 -1.341 . . . . 2.54 107.38 147.909 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.463 ' HG2' ' HB2' ' B' ' 26' ' ' GLN . 73.8 mt-10 -160.48 -55.39 0.05 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 130.08 3.352 . . . . 1.63 103.444 -174.05 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.3 -50.58 73.43 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.401 -1.272 . . . . 2.21 109.643 169.006 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -62.65 -47.59 83.04 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 120.215 -0.594 . . . . 2.81 109.546 -171.235 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -39.91 -48.35 2.32 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.233 0.613 . . . . 4.26 112.078 167.957 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.8 tp -58.63 -49.27 78.13 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.906 -0.775 . . . . 1.95 108.906 -172.837 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 42' ' ' VAL . . . . . 0.472 ' HA ' HD23 ' B' ' 46' ' ' LEU . 4.6 m -74.25 -54.56 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-N 115.703 -0.68 . . . . 0.64 109.933 -173.742 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 63.5 m -53.03 -46.12 68.3 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.599 1.16 . . . . 0.97 110.878 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -80.84 -62.39 1.68 Allowed 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 122.989 0.516 . . . . 1.91 111.156 -173.924 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -84.28 -42.28 16.0 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 115.633 1.716 . . . . 3.47 115.633 -163.208 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 46' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' B' ' 42' ' ' VAL . 0.6 OUTLIER -44.31 -46.2 23.15 Favored Pre-proline 0 N--CA 1.474 0.736 0 N-CA-C 115.576 1.695 . . . . 1.97 115.576 -155.282 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -77.74 -29.45 4.48 Favored 'Trans proline' 0 N--CA 1.449 -1.13 0 CA-C-N 120.827 1.331 . . . . 2.31 109.477 -42.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 19.6 t60 -89.02 -49.69 6.62 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 125.224 1.41 . . . . 2.49 110.844 -168.724 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.473 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 6.3 tp -34.24 -60.27 0.41 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.853 2.061 . . . . 1.2 113.852 -171.042 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 54.9 mt -96.16 111.82 23.74 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 108.239 -1.023 . . . . 1.46 108.239 172.244 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -64.49 154.46 35.82 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 120.237 -0.585 . . . . 5.52 109.582 165.599 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 17.0 t0 61.17 82.94 0.16 Allowed 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.425 1.49 . . . . 4.6 109.684 -168.534 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 29.5 m -96.78 21.94 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.786 0 CA-C-N 113.542 -1.663 . . . . 2.9 109.601 166.224 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -110.79 -65.93 0.53 Allowed Glycine 0 C--N 1.343 0.954 0 N-CA-C 109.605 -1.398 . . . . 3.67 109.605 -174.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -81.67 46.3 0.96 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.131 0.972 . . . . 4.49 109.803 -179.01 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -55.09 -42.28 72.67 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.189 0.996 . . . . 2.05 109.519 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -25.78 -51.26 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.348 1.859 . . . . 4.37 113.69 164.963 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -52.88 -56.51 15.32 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.986 0.812 . . . . 3.28 111.448 174.898 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -53.79 51.65 Favored 'General case' 0 C--O 1.224 -0.262 0 N-CA-C 108.236 -1.024 . . . . 4.61 108.236 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -50.67 -53.21 32.98 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 125.386 1.474 . . . . 3.06 111.015 -178.166 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -61.07 -30.8 70.55 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.366 0.666 . . . . 3.94 111.235 -178.543 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.2 t -71.82 -55.22 7.98 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 109.831 -0.433 . . . . 2.63 109.831 173.48 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 33.6 mt -51.9 -44.13 63.64 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.599 1.56 . . . . 1.51 111.446 -179.404 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.271 22.9 t0 -50.23 -8.7 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 118.105 2.631 . . . . 1.88 118.105 -173.696 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 23.3 m -32.92 -20.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.755 1 C-N-CA 132.074 4.15 . . . . 2.24 119.14 -133.74 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -50.02 -39.81 42.66 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 119.792 1.178 . . . . 2.46 109.544 156.964 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 62.3 63.43 1.05 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.633 1.573 . . . . 3.02 109.021 -171.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -116.93 -8.57 11.27 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.333 2.253 . . . . 2.7 112.754 -175.284 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 2.1 t 92.19 -7.42 0.2 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.068 2.147 . . . . 3.53 113.239 178.342 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -129.65 119.56 23.75 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 119.207 0.912 . . . . 4.42 110.736 -175.739 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.59 105.72 14.74 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 107.634 -1.247 . . . . 1.4 107.634 176.729 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -84.0 175.06 9.81 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.852 1.661 . . . . 3.55 110.971 -175.161 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -81.61 56.7 3.08 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.668 0.787 . . . . 4.47 110.643 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -168.83 45.89 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.855 0.836 . . . . 2.67 110.178 110.635 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -90.73 -61.36 1.69 Allowed 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 127.006 2.122 . . . . 2.21 107.779 153.484 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -50.87 -38.17 47.79 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 114.648 -1.16 . . . . 3.92 111.224 -170.101 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.464 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 5.1 t90 -38.86 -48.17 1.51 Allowed 'General case' 0 CA--C 1.541 0.604 0 O-C-N 124.562 1.164 . . . . 4.62 109.906 177.365 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 14.1 mmt-85 -42.02 -39.12 1.82 Allowed 'General case' 0 C--O 1.223 -0.311 0 CA-C-O 118.317 -0.849 . . . . 6.39 112.959 -176.133 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.45 ' O ' HD13 ' B' ' 83' ' ' LEU . 6.5 tp -55.5 -47.68 75.81 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.091 1.314 . . . . 0.85 111.732 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 1.4 mt -69.93 -34.88 62.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 O-C-N 120.92 -1.113 . . . . 1.75 108.701 178.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -41.32 -52.31 4.32 Favored Glycine 0 C--N 1.345 1.029 0 C-N-CA 126.075 1.798 . . . . 1.76 110.216 168.596 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -76.67 -60.31 2.4 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 112.031 -2.085 . . . . 2.71 108.842 -175.931 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.473 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 6.5 mp -37.44 -58.46 0.85 Allowed 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 120.767 1.621 . . . . 2.13 112.688 -172.884 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.91 -28.62 69.65 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.347 1.059 . . . . 1.61 112.67 -176.553 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -80.32 -51.79 8.47 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.668 0.787 . . . . 1.8 110.092 172.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -51.48 -44.47 62.48 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.292 1.037 . . . . 3.52 112.028 -176.932 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 8.9 tt -52.92 -38.59 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 118.926 0.785 . . . . 1.2 111.722 175.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.75 -30.75 26.42 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.827 1.651 . . . . 3.54 113.892 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 53.2 tttp -97.94 147.28 24.63 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.785 1.634 . . . . 4.79 111.936 -163.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -84.69 -60.87 1.93 Allowed 'General case' 0 C--N 1.342 0.26 0 O-C-N 121.538 -0.727 . . . . 4.9 112.388 -176.778 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 53.4 pttt -168.51 4.14 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.349 1.46 . . . . 8.51 111.781 -174.487 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.65 53.32 1.83 Allowed 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.152 1.381 . . . . 4.42 108.248 -146.672 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 42.1 tp -106.22 -71.62 0.74 Allowed 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.303 1.441 . . . . 4.85 109.462 -168.336 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.3 162.92 8.72 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 118.597 0.635 . . . . 7.52 110.382 179.024 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 7.3 tp -145.73 48.74 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-O 122.945 1.355 . . . . 9.16 107.921 166.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -166.75 152.12 7.91 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.22 -0.9 . . . . 8.85 109.484 177.22 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -177.69 137.28 0.2 Allowed 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 129.093 2.957 . . . . 9.01 104.929 172.742 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.256 1.438 0 N-CA-C 103.947 -2.612 . . . . 10.07 103.947 168.717 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.0 mtt . . . . . 0 N--CA 1.472 0.629 0 N-CA-C 106.012 -1.848 . . . . 6.26 106.012 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -99.28 179.09 4.7 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-N 119.362 0.983 . . . . 3.03 110.38 177.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 80.59 77.75 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 127.397 2.279 . . . . 3.51 110.559 -176.304 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -77.33 122.94 86.87 Favored Pre-proline 0 N--CA 1.442 -0.869 0 C-N-CA 124.427 1.091 . . . . 5.39 109.117 -175.515 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -70.04 140.77 42.43 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 121.96 1.773 . . . . 2.26 108.769 175.014 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.0 mt -99.3 176.03 5.67 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.394 -0.965 . . . . 1.39 108.394 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.412 HG22 ' CG ' ' A' ' 10' ' ' GLU . 2.5 t -70.47 162.74 28.19 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 120.952 -1.092 . . . . 1.78 109.749 178.631 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -56.44 -50.19 72.4 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.649 0.738 . . . . 2.02 110.474 -170.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.6 mt -60.74 -46.55 90.0 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 117.251 -1.357 . . . . 1.49 111.945 176.38 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.412 ' CG ' HG22 ' A' ' 7' ' ' THR . 71.0 mt-10 -49.65 -55.13 14.83 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 120.656 1.571 . . . . 2.24 112.171 172.335 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -50.55 -52.53 38.0 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.663 0.744 . . . . 4.04 109.299 176.787 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.4 t -57.6 -50.86 71.75 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.285 -0.87 . . . . 1.64 111.441 -176.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.451 HG21 HD12 ' B' ' 83' ' ' LEU . 2.2 pp -66.37 -39.05 83.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 CA-C-O 118.169 -0.92 . . . . 0.7 111.07 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -58.89 -55.61 32.85 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 119.619 1.1 . . . . 2.98 109.93 178.959 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 15.0 t -54.13 -38.84 65.9 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.625 0.648 . . . . 1.29 112.456 -174.129 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 m -75.03 -40.54 45.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 O-C-N 120.714 -1.241 . . . . 0.64 111.148 175.225 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.2 t -57.83 -49.54 80.65 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 CA-C-N 119.196 0.907 . . . . 0.57 110.461 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.2 t -60.12 -44.94 94.5 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.828 0.74 . . . . 0.76 110.538 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 62.0 m -58.02 -56.47 21.56 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.759 -0.588 . . . . 0.78 110.192 177.096 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -43.63 -56.3 3.81 Favored 'General case' 0 N--CA 1.458 -0.065 0 C-N-CA 125.009 1.324 . . . . 3.18 110.299 172.626 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -58.1 -52.86 63.77 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.076 0.95 . . . . 2.81 110.261 -174.681 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.5 t -65.15 -33.22 75.51 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.195 -0.602 . . . . 2.17 111.538 -177.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -61.47 -50.94 70.72 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.842 0.746 . . . . 2.69 110.473 168.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.01 -19.68 63.11 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.712 1.605 . . . . 0.87 112.26 -175.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.68 -18.96 58.24 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.557 1.543 . . . . 3.82 112.054 176.67 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.71 -69.39 0.13 Allowed 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.953 0.797 . . . . 2.68 112.171 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -111.26 171.25 7.59 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 125.73 1.612 . . . . 2.61 107.082 -172.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -20.75 131.57 0.01 OUTLIER Glycine 0 CA--C 1.53 1.019 0 C-N-CA 127.338 2.399 . . . . 1.58 114.333 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.3 mmm-85 64.92 103.25 0.04 OUTLIER 'General case' 0 C--O 1.237 0.438 0 C-N-CA 124.699 1.2 . . . . 6.66 111.502 178.508 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.9 pttm -73.21 56.2 0.46 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.85 0.86 . . . . 3.59 111.439 173.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -163.38 -54.62 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.309 1.443 . . . . 3.64 108.229 -176.556 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 97.8 p -83.91 150.29 25.79 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-O 121.213 0.53 . . . . 1.8 111.295 175.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -96.51 126.27 41.58 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 107.611 -1.255 . . . . 1.82 107.611 168.594 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 t -83.37 177.42 8.5 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 109.554 -0.536 . . . . 2.32 109.554 164.087 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.7 p -61.42 -49.62 83.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 O-C-N 121.963 -0.46 . . . . 2.08 111.517 -171.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -63.49 -54.2 40.05 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 108.333 -0.988 . . . . 2.32 108.333 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -36.97 -51.83 0.93 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 125.238 1.415 . . . . 1.93 111.53 172.512 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -61.87 -53.97 48.54 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.511 -0.768 . . . . 2.34 110.791 177.53 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.6 ttmm -56.32 -41.8 76.61 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.944 -0.472 . . . . 2.51 110.219 -176.183 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -55.41 -36.31 66.31 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 122.768 0.427 . . . . 3.3 111.145 178.274 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.1 tt -68.17 -48.26 65.8 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 119.403 1.001 . . . . 2.5 109.737 -178.046 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.1 m -67.15 -39.94 84.18 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 N-CA-C 109.507 -0.553 . . . . 0.92 109.507 -176.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 95.0 m -63.37 -52.94 59.62 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 124.011 0.924 . . . . 1.16 110.69 176.554 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -78.34 -54.78 5.82 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.505 0.722 . . . . 2.04 111.257 -167.684 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -120.32 43.11 2.8 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.498 0.719 . . . . 3.57 111.045 -163.74 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 tp -153.18 61.07 3.48 Favored Pre-proline 0 CA--C 1.542 0.671 0 O-C-N 121.885 -0.509 . . . . 1.57 111.013 177.32 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -66.72 -43.82 6.77 Favored 'Trans proline' 0 N--CA 1.453 -0.858 0 C-N-CA 124.169 3.246 . . . . 2.02 115.385 -165.858 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -132.27 26.98 4.49 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 120.008 1.276 . . . . 3.46 112.281 -166.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.419 HD23 HD22 ' A' ' 83' ' ' LEU . 11.5 tp -99.93 -75.99 0.56 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 122.566 0.347 . . . . 1.58 110.796 -168.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.0 mp -91.74 -175.94 4.31 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.639 1.175 . . . . 3.0 108.604 166.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -134.74 -160.76 1.08 Allowed 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 106.93 -1.507 . . . . 5.73 106.93 159.904 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 69.15 26.94 5.38 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.639 1.575 . . . . 3.78 111.291 171.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -68.38 -8.97 10.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.939 1.295 . . . . 2.02 112.962 -174.64 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.65 -64.28 4.24 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 108.792 -1.723 . . . . 1.78 108.792 166.924 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.89 53.65 0.12 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 129.191 2.996 . . . . 2.52 111.646 178.384 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -74.31 -26.36 60.12 Favored 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 124.985 1.314 . . . . 1.36 109.33 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -54.14 -46.36 72.22 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.663 1.185 . . . . 4.23 111.224 176.504 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -50.12 -54.85 17.78 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.788 0.804 . . . . 2.87 109.7 174.208 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.02 -47.93 83.44 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.412 -0.813 . . . . 4.91 109.966 -177.534 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 7.4 tmm? -51.12 -58.42 6.16 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.965 1.306 . . . . 2.04 109.455 176.586 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.9 mttt -52.83 -44.18 66.51 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.422 1.089 . . . . 3.34 110.983 178.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.1 m -65.68 -38.99 90.8 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.173 0.589 . . . . 2.21 111.839 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 34.8 mt -77.9 -47.09 19.53 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.501 1.12 . . . . 1.72 111.708 -175.49 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -72.47 91.46 1.38 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 123.455 0.702 . . . . 2.34 110.194 -170.35 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.2 m -55.38 -37.55 45.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 C-N-CA 122.796 0.438 . . . . 2.39 112.143 -167.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -97.26 -0.88 45.9 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.762 0.653 . . . . 2.19 112.762 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 46.21 48.74 13.02 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.489 1.515 . . . . 4.53 111.806 -178.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.4 p30 -90.84 -12.62 35.76 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.207 1.003 . . . . 1.78 110.685 168.895 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 35.4 p 70.47 7.05 6.07 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 127.52 2.328 . . . . 1.97 114.074 -176.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -95.06 112.82 24.48 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 104.741 -2.318 . . . . 2.93 104.741 160.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -80.74 96.67 7.01 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 103.766 -2.679 . . . . 1.01 103.766 171.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.15 158.32 2.27 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.481 -0.933 . . . . 3.9 108.481 171.837 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.1 p90 -38.94 -52.41 1.78 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.879 1.271 . . . . 6.01 111.915 -179.132 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -70.36 -35.17 73.39 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.181 0.592 . . . . 1.63 112.494 -179.108 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -65.13 -51.73 59.52 Favored 'General case' 0 C--O 1.227 -0.129 0 O-C-N 121.643 -0.661 . . . . 2.15 109.257 176.46 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -56.1 -49.86 72.68 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.788 0.435 . . . . 2.99 110.058 178.018 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 0.7 OUTLIER -40.02 -44.0 1.66 Allowed 'General case' 0 CA--C 1.535 0.402 0 O-C-N 124.164 0.915 . . . . 4.24 110.691 179.169 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -42.58 -40.49 2.7 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 114.176 1.176 . . . . 3.74 114.176 178.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 60.4 tp -46.19 -51.23 14.59 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 119.252 0.933 . . . . 0.91 111.107 175.401 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 78.1 mt -57.38 -28.94 31.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 124.656 1.182 . . . . 1.43 107.824 -175.315 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.524 ' HA3' ' CE2' ' B' ' 77' ' ' TRP . . . -76.99 -48.89 8.03 Favored Glycine 0 N--CA 1.44 -1.071 0 N-CA-C 109.607 -1.397 . . . . 1.15 109.607 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -48.61 -52.61 22.16 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-O 117.752 -1.118 . . . . 4.14 108.291 169.865 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.419 HD22 HD23 ' A' ' 49' ' ' LEU . 11.6 mt -49.48 -52.78 26.98 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 120.077 1.308 . . . . 2.47 111.712 178.599 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.4 -21.32 24.3 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.9 0.88 . . . . 1.22 112.386 176.073 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.62 -61.5 1.95 Allowed 'General case' 0 C--O 1.221 -0.437 0 CA-C-O 117.434 -1.27 . . . . 2.27 112.956 162.349 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -54.91 -33.83 62.5 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 125.834 1.654 . . . . 2.93 112.119 -166.103 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.7 tp -38.39 -44.3 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 124.808 1.243 . . . . 1.34 111.465 167.247 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 51.4 mtt85 -104.67 -58.47 1.88 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 127.044 2.138 . . . . 7.62 110.665 178.265 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 3.3 ttpm? -72.28 54.79 0.31 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.717 1.607 . . . . 3.49 112.784 -175.075 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -81.02 -19.64 43.47 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 120.741 -1.224 . . . . 7.55 114.053 -172.52 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.0 tptt 177.71 -31.07 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.281 1.832 . . . . 10.01 110.884 170.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 75.83 35.41 0.51 Allowed 'General case' 0 CA--C 1.527 0.081 0 C-N-CA 123.308 0.643 . . . . 5.5 112.184 151.677 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 21.2 tp -149.57 -54.84 0.17 Allowed 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.135 -1.432 . . . . 9.13 107.135 174.764 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -111.61 -65.44 1.17 Allowed 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 123.405 0.682 . . . . 10.9 110.873 174.529 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 0.259 1.4 pp 50.6 -173.77 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 C-N-CA 125.919 1.688 . . . . 8.67 112.849 -165.986 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.03 126.85 11.81 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 106.09 -1.818 . . . . 13.5 106.09 163.562 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -178.18 -63.4 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 124.723 1.209 . . . . 10.81 107.961 -173.262 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . 2.396 6.7 mtpm? . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.054 -1.451 . . . . 10.2 111.01 -176.623 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.418 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.613 0 N-CA-C 105.487 -2.042 . . . . 6.79 105.487 . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 66.12 -170.97 0.19 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.8 1.182 . . . . 5.01 113.16 169.287 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 57.76 51.48 9.23 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 125.43 1.492 . . . . 4.56 111.59 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -117.59 153.53 50.5 Favored Pre-proline 0 CA--C 1.536 0.408 0 C-N-CA 126.05 1.74 . . . . 7.99 106.693 170.235 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -71.98 150.12 54.22 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.758 2.305 . . . . 2.89 108.981 172.307 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.0 mt -140.17 137.57 34.48 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.68 -0.859 . . . . 2.65 108.68 -166.345 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.456 HG23 ' N ' ' B' ' 8' ' ' GLU . 6.4 t -69.15 -65.59 0.69 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.062 0.764 . . . . 2.53 113.062 -174.869 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.456 ' N ' HG23 ' B' ' 7' ' ' THR . 43.9 tt0 -168.82 -75.97 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 108.78 -0.822 . . . . 1.96 108.78 -162.318 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 mt -57.3 -45.29 84.32 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 120.98 -1.075 . . . . 1.01 109.366 167.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -56.06 -39.11 71.54 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.867 1.267 . . . . 3.46 110.52 174.218 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -50.89 28.05 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 108.852 -0.795 . . . . 4.46 108.852 -176.47 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 5.4 p -61.3 -35.48 77.45 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.445 -0.798 . . . . 1.51 110.747 -172.319 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 13' ' ' ILE . . . . . 0.493 ' O ' HG23 ' B' ' 17' ' ' VAL 0.332 2.9 pp -62.38 -42.41 95.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-O 118.395 -0.812 . . . . 1.07 111.311 173.901 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -67.2 -42.94 83.29 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-N 120.763 1.62 . . . . 3.75 110.419 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 16.9 m -43.77 -47.68 8.01 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 119.261 0.937 . . . . 2.41 112.304 175.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 35.2 m -74.02 -37.16 46.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 O-C-N 120.777 -1.202 . . . . 1.0 111.431 177.604 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 17' ' ' VAL . . . . . 0.493 HG23 ' O ' ' B' ' 13' ' ' ILE . 95.6 t -54.85 -49.68 67.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 119.308 0.958 . . . . 1.22 110.242 173.973 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -64.24 -39.26 93.59 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.494 -0.754 . . . . 1.24 110.656 179.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 34.6 m -58.9 -38.72 79.54 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.78 0.718 . . . . 1.57 111.076 174.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 20' ' ' PHE . . . . . 0.45 ' CE1' ' HB2' ' B' ' 24' ' ' ALA . 0.0 OUTLIER -60.28 -52.57 64.7 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.183 -0.948 . . . . 4.39 109.165 169.325 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -55.01 -41.04 70.79 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.499 0.72 . . . . 3.03 112.672 -172.383 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 16.6 p -57.93 -30.26 65.8 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 118.722 -0.656 . . . . 2.95 112.197 177.522 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -82.07 -34.62 29.3 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 119.376 0.989 . . . . 2.83 112.514 167.007 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 24' ' ' ALA . . . . . 0.45 ' HB2' ' CE1' ' B' ' 20' ' ' PHE . . . -51.05 -44.6 61.13 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 124.167 0.987 . . . . 1.15 109.949 -174.905 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -51.49 -38.55 54.5 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 124.545 1.153 . . . . 3.34 112.96 178.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.47 -69.17 0.14 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 116.89 2.181 . . . . 1.79 116.89 -136.574 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -93.15 -76.91 0.46 Allowed 'General case' 0 C--N 1.341 0.204 0 CA-C-O 122.216 1.008 . . . . 3.73 113.652 -173.718 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.06 153.53 22.37 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 127.593 2.521 . . . . 2.21 109.767 167.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.6 ttt85 45.06 101.63 0.0 OUTLIER 'General case' 0 C--O 1.245 0.824 0 C-N-CA 125.706 1.602 . . . . 4.09 114.028 153.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 58.7 pttt -73.09 59.6 0.53 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.712 1.205 . . . . 3.97 112.113 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -160.98 -61.19 0.06 Allowed 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.173 1.389 . . . . 3.71 108.501 -168.318 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 55.2 p -97.44 158.71 15.33 Favored 'General case' 0 C--O 1.245 0.842 0 C-N-CA 123.418 0.687 . . . . 1.96 109.648 -173.588 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 62.6 mt -107.91 157.06 18.51 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 124.491 1.12 . . . . 2.58 109.187 164.285 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 7.9 t -152.26 178.62 9.31 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 106.684 -1.599 . . . . 3.68 106.684 167.354 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 3.2 t -83.85 56.84 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 118.743 0.701 . . . . 2.8 112.008 -161.986 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -156.5 56.4 0.56 Allowed 'General case' 0 C--O 1.225 -0.211 0 N-CA-C 106.782 -1.562 . . . . 2.25 106.782 141.317 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -173.87 -52.09 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 125.842 1.657 . . . . 1.74 106.703 -166.191 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -61.6 -53.06 61.34 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.461 -0.79 . . . . 2.17 108.968 168.298 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 38.4 tttt -57.93 -37.06 73.42 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.57 -0.286 . . . . 2.8 111.08 -174.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -47.35 -36.86 10.09 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.806 0.669 . . . . 3.49 112.806 173.092 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 6.6 tt -66.45 -51.28 58.56 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 107.799 -1.185 . . . . 2.48 107.799 -175.579 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 14.3 m -67.4 -46.14 84.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 109.802 -0.444 . . . . 0.72 109.802 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 99.0 m -55.73 -50.73 69.57 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 123.93 0.892 . . . . 0.86 111.517 176.525 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -76.1 -61.62 1.88 Allowed 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 118.302 0.501 . . . . 3.28 111.111 -174.558 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 40.4 mm-40 -81.36 -46.44 14.66 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 112.833 0.679 . . . . 3.42 112.833 -157.507 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -57.77 -36.71 48.17 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 122.874 0.469 . . . . 2.09 111.893 -162.294 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -45.1 -57.25 2.19 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 119.767 -3.014 . . . . 1.7 108.871 -83.271 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -55.13 -42.74 73.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 125.251 1.42 . . . . 2.26 112.55 -175.907 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 35.7 tp -52.09 -47.4 65.24 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 120.951 0.405 . . . . 0.96 110.69 -169.593 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 92.6 mt -114.96 69.58 0.72 Allowed 'General case' 0 C--O 1.228 -0.067 0 C-N-CA 125.341 1.456 . . . . 1.64 109.067 163.917 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.94 8.59 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 115.752 1.76 . . . . 4.97 115.752 178.157 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -105.05 89.82 3.25 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 104.733 -2.321 . . . . 3.33 104.733 163.669 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 19.7 m -93.52 14.81 2.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 114.991 -1.004 . . . . 1.66 108.944 166.814 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -83.36 -73.49 1.24 Allowed Glycine 0 N--CA 1.443 -0.892 0 N-CA-C 107.345 -2.302 . . . . 2.32 107.345 176.791 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 55.6 m -80.06 54.33 1.9 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.516 1.127 . . . . 2.64 112.076 -169.089 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.09 -40.89 87.01 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 124.811 1.245 . . . . 1.16 109.143 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -29.43 -66.52 0.09 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 127.164 2.186 . . . . 4.25 114.208 165.534 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -47.66 -53.11 15.87 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.854 0.835 . . . . 2.86 110.007 177.024 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -38.28 78.19 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-O 118.427 -0.796 . . . . 4.35 111.12 178.714 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.7 ttp -60.59 -45.64 93.22 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 119.881 1.218 . . . . 2.99 109.843 178.113 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -61.71 -42.81 99.44 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 120.56 -0.456 . . . . 4.26 110.278 174.292 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 11.4 m -62.67 -30.47 71.41 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 122.86 0.464 . . . . 1.7 112.029 176.617 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.566 HD23 ' HB2' ' B' ' 78' ' ' ARG . 8.4 mt -76.45 -59.52 2.73 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.928 1.691 . . . . 1.22 109.627 -178.436 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 64' ' ' ASP . . . . . 0.419 ' HA ' ' HG2' ' B' ' 75' ' ' GLU 0.344 2.7 t70 -57.18 -14.42 4.11 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 116.571 2.063 . . . . 2.92 116.571 -159.233 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 28.8 m -34.61 -19.92 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 130.635 3.574 . . . . 2.69 118.951 -132.066 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -48.98 -42.78 38.87 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 120.531 1.514 . . . . 3.91 110.092 151.848 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 70.98 55.01 0.23 Allowed 'General case' 0 C--N 1.34 0.189 0 CA-C-O 122.14 0.971 . . . . 4.18 109.23 168.727 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 16.7 p30 -87.15 -133.21 0.07 Allowed 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 104.636 -2.357 . . . . 4.17 104.636 158.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 61.8 m -146.14 29.11 1.09 Allowed 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.123 -1.611 . . . . 3.0 110.945 165.178 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -129.94 110.78 11.95 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 127.49 2.316 . . . . 6.28 105.646 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.24 108.39 7.0 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 104.421 -2.437 . . . . 1.27 104.421 177.919 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.12 175.11 6.9 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.257 1.423 . . . . 3.66 108.947 -178.658 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 18.9 p90 -86.9 53.05 2.69 Favored 'General case' 0 C--O 1.224 -0.281 0 O-C-N 120.434 -1.417 . . . . 5.35 113.793 -169.169 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.57 51.64 0.45 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 105.325 -2.102 . . . . 2.41 105.325 127.442 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 75' ' ' GLU . . . . . 0.419 ' HG2' ' HA ' ' B' ' 64' ' ' ASP . 0.7 OUTLIER -89.2 -63.94 1.22 Allowed 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.776 -0.824 . . . . 2.82 108.776 152.624 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.406 ' CE2' ' CE1' ' B' ' 20' ' ' PHE . 0.0 OUTLIER -53.55 -35.79 61.13 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.684 0.394 . . . . 7.87 110.865 -170.32 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 67.3 t-105 -38.62 -51.72 1.64 Allowed 'General case' 0 N--CA 1.439 -1.018 0 O-C-N 124.646 1.216 . . . . 4.58 110.744 173.612 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 78' ' ' ARG . . . . . 0.566 ' HB2' HD23 ' B' ' 63' ' ' LEU . 11.0 mmm180 -45.99 -48.09 16.64 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.623 -0.673 . . . . 4.2 111.429 177.751 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.419 ' HB2' HD21 ' B' ' 63' ' ' LEU . 6.7 tp -58.03 -41.28 82.86 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.197 0.599 . . . . 0.87 111.104 -179.652 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 55.9 mt -64.8 -35.46 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.006 0 N-CA-C 105.945 -1.872 . . . . 1.39 105.945 -176.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.575 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -66.09 -48.2 67.11 Favored Glycine 0 CA--C 1.494 -1.224 0 N-CA-C 110.209 -1.156 . . . . 1.47 110.209 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -62.44 -61.48 2.42 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-O 117.89 -1.053 . . . . 2.31 108.213 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.451 HD12 HG21 ' A' ' 13' ' ' ILE 0.262 3.8 pp -53.98 -36.22 62.68 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.949 1.25 . . . . 1.82 112.573 -178.408 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.41 -61.68 2.37 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 119.183 0.901 . . . . 1.71 110.804 170.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 18.3 ttpp -52.92 -41.16 64.16 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.356 1.863 . . . . 1.56 111.594 -175.894 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -51.08 -33.73 27.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 127.47 2.308 . . . . 3.75 111.463 178.578 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 7.1 tt -52.7 -40.43 34.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 118.607 0.639 . . . . 1.05 110.226 -176.735 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -84.85 -61.09 1.86 Allowed 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 121.431 0.634 . . . . 6.1 110.84 164.721 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 33.5 mttp -82.66 61.2 5.64 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.047 0.939 . . . . 5.77 111.486 -168.643 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.9 -19.39 65.86 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.131 0.419 . . . . 9.65 112.131 -175.252 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -128.4 -35.63 1.96 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 124.661 1.185 . . . . 8.18 110.553 176.116 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -77.9 39.73 0.3 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.659 2.384 . . . . 4.98 111.746 -172.309 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -93.84 -111.18 0.11 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.418 1.087 . . . . 6.4 108.644 179.238 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 11.8 mptt 63.71 153.18 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.984 2.114 . . . . 8.65 111.99 -175.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -161.19 124.42 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 N-CA-C 106.345 -1.724 . . . . 8.71 106.345 178.689 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 33.1 ptt-85 -160.79 138.2 9.25 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 108.813 -0.81 . . . . 8.26 108.813 173.029 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -179.58 138.71 0.13 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.361 1.865 . . . . 6.58 107.641 172.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 9.3 tptp . . . . . 0 C--O 1.252 1.214 0 N-CA-C 105.113 -2.18 . . . . 7.28 105.113 155.657 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.3 mtm . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 106.255 -1.757 . . . . 7.45 106.255 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -174.08 174.37 2.96 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 125.321 1.448 . . . . 3.45 107.537 -171.335 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.15 96.04 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 128.532 2.733 . . . . 3.07 110.869 175.947 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -88.35 128.92 51.41 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 124.194 0.998 . . . . 5.57 108.885 176.735 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -76.49 158.19 36.38 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.746 2.297 . . . . 2.56 110.323 -178.424 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 72.3 mt -128.57 166.72 18.3 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.179 1.391 . . . . 1.72 107.925 179.329 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.506 HG23 ' H ' ' A' ' 10' ' ' GLU . 7.3 t -72.95 174.48 7.75 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 118.588 0.631 . . . . 2.13 110.163 -179.747 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -68.18 -43.76 77.42 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 122.535 1.159 . . . . 2.74 109.211 -177.25 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.8 mp -61.1 -41.57 96.91 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.361 -0.836 . . . . 2.16 109.962 178.571 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.506 ' H ' HG23 ' A' ' 7' ' ' THR . 78.1 mt-10 -62.53 -49.12 76.58 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.475 1.11 . . . . 2.52 111.299 175.241 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.72 -52.83 63.82 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 108.359 -0.978 . . . . 5.31 108.359 -179.816 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.4 p -61.68 -40.62 95.6 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.575 -0.284 . . . . 1.41 110.913 -170.317 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.28 2.8 pp -67.1 -39.66 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 O-C-N 121.78 -0.575 . . . . 0.61 110.209 177.974 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -60.89 -51.65 68.4 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.867 0.758 . . . . 3.69 110.018 174.513 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.5 m -44.09 -47.4 8.89 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.697 1.999 . . . . 2.12 112.354 175.625 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 30.4 m -76.33 -35.03 26.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 O-C-N 120.348 -1.47 . . . . 0.65 111.568 177.695 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.6 t -59.97 -42.79 90.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 119.484 1.038 . . . . 0.73 111.148 174.562 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.2 t -61.64 -49.07 78.02 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 120.812 -1.18 . . . . 0.71 109.532 175.201 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.1 m -52.51 -43.4 65.07 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 118.473 0.578 . . . . 0.69 110.613 176.269 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.482 ' HA ' ' CZ ' ' A' ' 23' ' ' PHE . 41.5 t80 -48.43 -57.08 6.61 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 123.683 0.793 . . . . 3.37 110.548 174.767 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -59.56 -41.78 90.93 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 119.724 -0.79 . . . . 3.39 111.388 177.468 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.9 m -53.33 -43.86 67.97 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.576 0.584 . . . . 2.61 112.576 177.876 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' PHE . . . . . 0.482 ' CZ ' ' HA ' ' A' ' 20' ' ' PHE . 22.8 p90 -81.58 -43.49 18.59 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 119.324 0.965 . . . . 6.62 113.201 176.158 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.16 -20.73 65.66 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 125.806 1.642 . . . . 1.27 112.16 -169.617 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -17.86 64.45 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 117.571 -1.205 . . . . 4.92 113.622 172.571 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -50.99 -58.18 6.71 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.925 1.239 . . . . 2.76 112.512 -172.308 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -121.6 171.12 9.06 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.286 1.834 . . . . 2.54 107.285 -179.371 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -1.59 106.57 0.01 OUTLIER Glycine 0 CA--C 1.53 0.995 0 C-N-CA 127.443 2.449 . . . . 1.65 114.268 170.973 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . 0.278 30.5 mtt85 66.11 109.45 0.04 OUTLIER 'General case' 0 C--O 1.239 0.544 0 N-CA-C 114.732 1.382 . . . . 5.11 114.732 167.244 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -62.22 59.95 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.936 0.894 . . . . 5.47 112.051 163.28 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -165.38 -57.82 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 127.048 2.139 . . . . 3.26 106.725 -171.587 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.8 p -84.92 122.75 29.64 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 125.079 1.352 . . . . 2.37 109.382 177.137 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -90.83 156.59 17.92 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 107.715 -1.217 . . . . 2.14 107.715 160.312 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.7 t -152.42 177.91 10.1 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.912 0.885 . . . . 3.67 108.784 172.021 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -39.93 -64.74 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 125.487 1.515 . . . . 2.98 112.955 -168.474 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -60.49 -60.19 4.2 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.195 0.452 . . . . 2.1 110.416 -175.767 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -38.77 -52.28 1.71 Allowed 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.601 1.56 . . . . 1.84 112.296 175.472 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -63.99 -51.74 62.86 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 114.803 -1.09 . . . . 2.59 108.726 -179.416 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.426 ' HE2' ' HB3' ' A' ' 56' ' ' LEU . 32.2 ttmt -52.56 -44.95 66.2 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.898 0.479 . . . . 3.58 111.185 178.017 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -54.26 -41.44 68.79 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.626 0.648 . . . . 2.23 111.448 175.416 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 41' ' ' LEU . . . . . 0.441 HD13 ' CD2' ' A' ' 23' ' ' PHE . 45.4 tp -64.67 -49.73 69.8 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.632 -0.877 . . . . 2.61 108.632 -176.445 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.8 m -65.8 -52.88 44.61 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 108.528 -0.915 . . . . 1.0 108.528 -174.661 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 96.5 m -52.18 -53.18 46.34 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.936 1.294 . . . . 1.68 111.511 178.669 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 40.0 tt0 -75.62 -53.37 8.69 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.42 0.288 . . . . 2.7 110.285 -171.545 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -85.4 -33.66 21.91 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 117.717 -1.135 . . . . 4.64 112.446 -169.789 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.0 mt -103.17 98.3 11.63 Favored Pre-proline 0 CA--C 1.538 0.494 0 CA-C-N 120.368 1.44 . . . . 2.87 111.633 -171.914 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -71.38 -39.15 3.97 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 121.911 1.741 . . . . 1.81 111.918 -178.025 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -141.81 -12.29 0.87 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.477 1.288 . . . . 4.89 114.477 -170.8 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.48 HD21 ' HG ' ' A' ' 83' ' ' LEU . 28.0 tp -66.32 -68.79 0.34 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 119.032 0.833 . . . . 1.33 110.728 -171.353 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 36.9 mt -93.01 100.39 12.83 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 106.252 -1.759 . . . . 2.31 106.252 163.63 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 62.4 mttt -69.12 174.99 4.08 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 120.213 -0.595 . . . . 5.49 109.962 165.405 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 25.4 t0 59.49 50.48 7.46 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 124.593 2.14 . . . . 4.13 108.963 177.913 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.7 m -58.47 -35.69 55.57 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 CA-C-N 112.338 -2.21 . . . . 1.99 108.414 161.551 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -40.75 -61.69 1.84 Allowed Glycine 0 C--N 1.342 0.91 0 C-N-CA 125.937 1.732 . . . . 1.54 111.783 174.519 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 52.5 m -103.76 43.49 1.08 Allowed 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.755 0.822 . . . . 2.44 111.602 177.397 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.426 ' HB3' ' HE2' ' A' ' 39' ' ' LYS . 0.9 OUTLIER -41.05 -43.74 2.25 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 124.252 1.021 . . . . 1.82 109.608 162.611 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -39.41 -41.49 0.96 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 127.88 2.472 . . . . 3.72 112.231 179.083 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -62.09 -54.36 42.43 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 121.686 -0.633 . . . . 5.06 110.561 175.955 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.95 -50.33 66.72 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 108.304 -0.999 . . . . 2.87 108.304 176.54 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -47.29 -58.16 4.43 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.064 1.745 . . . . 2.29 110.188 -176.766 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.53 -35.16 69.93 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.514 -0.312 . . . . 4.8 111.58 -179.49 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.4 t -73.17 -46.81 48.64 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.864 0.866 . . . . 2.38 111.468 -178.528 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.5 mp -59.26 -48.37 81.87 Favored 'General case' 0 C--O 1.232 0.173 0 O-C-N 121.843 -0.536 . . . . 2.07 109.629 176.584 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -71.21 83.41 0.74 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 120.802 0.334 . . . . 1.86 110.786 -171.549 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.3 m -45.97 -41.32 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 C-N-CA 125.761 1.624 . . . . 2.6 113.941 -173.547 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -96.19 -9.06 31.41 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.26 1.024 . . . . 2.64 111.845 -179.869 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 53.02 35.34 19.2 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.356 1.462 . . . . 3.92 111.67 177.206 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 57.6 p30 -65.96 -16.64 64.05 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.277 1.031 . . . . 1.96 110.765 170.903 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m 83.73 11.3 0.43 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.616 2.366 . . . . 2.55 112.472 -179.064 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -111.06 132.34 54.32 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 106.884 -1.524 . . . . 3.05 106.884 164.908 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -95.68 102.46 14.26 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 104.563 -2.384 . . . . 1.38 104.563 163.042 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -100.12 171.36 7.86 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 118.96 0.8 . . . . 3.44 109.88 170.929 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -38.68 -60.33 0.84 Allowed 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.267 1.581 . . . . 4.86 115.267 -155.033 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -70.01 -26.95 64.31 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.567 0.621 . . . . 1.83 112.09 -174.876 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -73.14 -57.53 3.96 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 107.746 -1.205 . . . . 2.26 107.746 176.24 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -50.88 -42.52 59.15 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 124.18 0.992 . . . . 3.3 110.827 177.423 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.433 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 3.1 t90 -40.03 -44.79 1.81 Allowed 'General case' 0 CA--C 1.538 0.509 0 O-C-N 124.131 0.894 . . . . 5.25 109.815 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.4 mtt-85 -43.58 -33.96 1.29 Allowed 'General case' 0 C--O 1.226 -0.169 0 N-CA-C 113.227 0.825 . . . . 4.57 113.227 -178.917 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.3 tp -51.92 -49.62 62.71 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-O 117.616 -1.183 . . . . 0.99 111.388 174.767 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.4 mt -71.31 -36.5 61.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 C-N-CA 124.96 1.304 . . . . 2.23 108.826 179.059 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.431 ' HA2' ' CE2' ' B' ' 77' ' ' TRP . . . -39.22 -56.78 2.24 Favored Glycine 0 C--N 1.344 1.02 0 C-N-CA 126.01 1.767 . . . . 1.74 111.214 170.057 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -74.17 -52.86 11.19 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-N 110.723 -2.738 . . . . 2.72 109.344 179.386 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.48 ' HG ' HD21 ' A' ' 49' ' ' LEU . 2.6 tp -39.25 -56.12 1.57 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.024 1.729 . . . . 2.95 112.517 -172.934 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.65 -33.24 71.28 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.129 0.571 . . . . 1.34 112.504 179.003 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.505 ' CE ' ' HB2' ' B' ' 74' ' ' ASN . 0.7 OUTLIER -73.36 -44.86 57.87 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.868 1.267 . . . . 2.08 110.451 173.782 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -67.42 -16.16 64.08 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 125.173 1.389 . . . . 3.28 113.089 -174.021 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 5.3 tt -58.94 -36.73 63.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 O-C-N 121.435 -0.79 . . . . 1.44 111.076 165.73 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.97 -52.68 3.36 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 126.72 2.008 . . . . 4.5 109.678 -170.404 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.9 tttm -69.58 62.49 0.17 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.908 1.683 . . . . 3.76 106.962 163.541 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -40.57 90.37 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 121.493 -0.755 . . . . 7.15 110.748 -167.701 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.9 tptp -170.57 -38.01 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 127.686 2.394 . . . . 8.61 107.622 166.07 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.0 t70 37.75 83.9 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.624 2.37 . . . . 6.64 113.548 -176.568 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.1 tp -172.18 -57.55 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 103.792 -2.67 . . . . 9.12 103.792 173.579 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -86.08 -169.33 2.59 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 108.06 -1.089 . . . . 11.1 108.06 160.502 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.7 pp -71.93 -170.69 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 C-N-CA 125.327 1.451 . . . . 9.86 112.478 -175.61 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 4.8 mmm180 67.44 104.75 0.05 OUTLIER 'General case' 0 C--N 1.342 0.282 0 C-N-CA 126.494 1.918 . . . . 13.98 107.913 -154.542 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.1 mttm -176.83 90.46 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 130.045 3.338 . . . . 11.94 104.686 -161.898 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.674 ' H ' ' HA ' ' B' ' 1' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.255 1.354 0 N-CA-C 100.996 -3.705 . . . . 9.83 100.996 -115.565 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 1' ' ' MET . . . . . 0.674 ' HA ' ' H ' ' A' ' 98' ' ' LYS . 1.4 mpt? . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 114.888 -2.482 . . . . 5.86 106.28 . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 136.02 163.13 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 127.67 2.388 . . . . 5.13 110.918 -177.942 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 90.06 90.83 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 126.264 1.826 . . . . 4.48 114.404 153.417 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -128.45 146.77 61.2 Favored Pre-proline 0 CA--C 1.537 0.456 0 N-CA-C 104.116 -2.55 . . . . 6.13 104.116 149.636 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -82.21 142.57 12.17 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 C-N-CA 123.821 3.014 . . . . 3.5 108.414 167.084 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 6' ' ' LEU . . . . . 0.573 HD12 ' HG3' ' B' ' 10' ' ' GLU . 25.6 mt -144.5 -123.63 0.08 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.597 0.759 . . . . 3.8 111.234 -158.884 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 9.3 t -95.78 163.75 13.04 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 125.173 1.389 . . . . 2.23 110.457 -176.016 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -48.07 -55.73 9.49 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.568 1.147 . . . . 2.16 112.471 -171.701 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 11.4 mt -58.53 -38.23 77.32 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.419 -0.355 . . . . 1.03 111.358 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.573 ' HG3' HD12 ' B' ' 6' ' ' LEU . 1.4 tm-20 -59.92 -60.18 4.24 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 119.056 -0.497 . . . . 5.71 110.474 169.169 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -45.23 -42.16 9.11 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 119.752 1.16 . . . . 4.26 110.645 -176.75 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 22.3 p -64.01 -31.64 72.89 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.12 1.526 . . . . 1.4 115.12 177.082 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 12.6 pt -76.04 -41.28 38.2 Favored 'Isoleucine or valine' 0 C--N 1.344 0.366 0 CA-C-N 121.95 2.159 . . . . 1.44 109.955 164.107 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -47.11 -56.11 7.16 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 121.045 1.748 . . . . 2.88 109.981 -174.004 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 15.3 t -48.22 -43.37 32.06 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.485 1.136 . . . . 1.29 111.733 178.234 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 16' ' ' VAL . . . . . 0.464 HG13 ' CE2' ' B' ' 20' ' ' PHE . 0.5 OUTLIER -72.99 -38.31 55.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 C-N-CA 124.271 1.028 . . . . 1.53 110.126 -177.923 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 69.2 t -61.92 -50.61 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 123.831 0.852 . . . . 1.29 109.303 175.455 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.1 t -61.59 -43.67 98.43 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.839 0.745 . . . . 1.46 110.665 178.486 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 98.7 m -47.95 -58.16 4.77 Favored 'General case' 0 C--N 1.346 0.449 0 CA-C-N 118.595 0.634 . . . . 1.44 109.482 170.354 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 20' ' ' PHE . . . . . 0.464 ' CE2' HG13 ' B' ' 16' ' ' VAL . 16.8 m-30 -55.02 -44.64 74.79 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 112.786 0.662 . . . . 6.31 112.786 178.514 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -60.26 -53.54 56.4 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 119.716 1.144 . . . . 4.42 110.12 -176.815 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 6.7 t -65.87 -40.74 91.92 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 119.52 -0.872 . . . . 3.5 110.08 -179.439 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -62.8 -61.73 2.21 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 121.517 -0.74 . . . . 5.25 111.55 -179.754 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.14 -19.72 65.48 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 125.808 1.643 . . . . 1.0 111.951 -172.409 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.07 -26.86 11.99 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 118.431 -0.795 . . . . 4.17 111.167 169.192 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -39.28 -69.05 0.14 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 115.994 1.85 . . . . 1.86 115.994 -156.742 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -92.14 -77.7 0.43 Allowed 'General case' 0 C--N 1.341 0.206 0 C-N-CA 118.889 -1.125 . . . . 2.85 112.688 -171.289 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.04 161.16 25.39 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 127.929 2.68 . . . . 1.72 110.614 152.959 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.0 ttm180 55.96 102.34 0.01 OUTLIER 'General case' 0 C--O 1.24 0.601 0 N-CA-C 115.116 1.525 . . . . 4.17 115.116 135.719 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.47 6.6 5.49 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 115.135 1.531 . . . . 6.58 115.135 -174.256 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -123.77 11.44 9.07 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.231 0.923 . . . . 4.08 110.961 178.957 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 29.0 p -142.57 142.4 32.17 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 109.321 -0.622 . . . . 1.57 109.321 172.87 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -101.29 154.18 19.0 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.303 -0.999 . . . . 2.24 108.303 167.361 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 68.6 m -136.46 168.72 18.93 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 107.003 -1.48 . . . . 2.41 107.003 173.908 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 10.8 p -84.04 53.9 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 121.725 0.774 . . . . 2.8 111.202 -172.454 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 38.2 t30 -157.21 51.08 0.47 Allowed 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 105.881 -1.896 . . . . 3.07 105.881 150.038 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -168.41 -62.41 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 104.583 -2.377 . . . . 2.08 104.583 -166.897 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -48.61 -49.19 38.0 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.689 0.796 . . . . 2.71 111.036 178.32 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 31.3 tttt -57.44 -29.27 64.05 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.081 0.552 . . . . 2.65 111.586 -177.992 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -70.17 -25.6 63.52 Favored 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 121.535 -0.728 . . . . 4.59 110.587 -174.696 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 14.8 tp -70.16 -43.2 71.34 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 119.015 0.825 . . . . 1.95 109.716 178.016 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 6.0 m -69.89 -41.27 79.57 Favored 'Isoleucine or valine' 0 C--N 1.339 0.147 0 N-CA-C 109.099 -0.704 . . . . 0.64 109.099 -178.501 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 87.6 m -67.42 -60.78 2.3 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 116.029 -0.532 . . . . 0.81 111.071 -178.782 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -82.82 -62.81 1.5 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.839 0.456 . . . . 2.11 111.897 -170.821 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -70.61 -48.2 56.32 Favored 'General case' 0 CA--C 1.528 0.096 0 O-C-N 122.16 -0.338 . . . . 3.89 111.782 -169.651 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 tp -71.58 -19.89 0.44 Allowed Pre-proline 0 CA--C 1.536 0.429 0 N-CA-C 114.666 1.358 . . . . 1.86 114.666 -161.627 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -34.42 -65.92 0.11 Allowed 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 121.895 1.73 . . . . 2.01 114.806 -110.593 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -73.65 -59.6 2.64 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 113.358 0.873 . . . . 2.38 113.358 -158.544 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.673 ' HG ' HD23 ' B' ' 50' ' ' LEU . 29.5 tp 0.53 -85.04 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 127.949 2.499 . . . . 1.43 115.613 176.238 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.673 HD23 ' HG ' ' B' ' 49' ' ' LEU . 0.4 OUTLIER -125.88 64.52 1.21 Allowed 'General case' 0 CA--C 1.522 -0.122 0 N-CA-C 108.05 -1.092 . . . . 2.65 108.05 166.82 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.28 123.31 7.22 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.573 -0.899 . . . . 6.33 108.573 166.995 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.405 ' OD2' ' NZ ' ' B' ' 91' ' ' LYS . 60.6 t0 -165.96 51.43 0.09 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 105.999 -1.852 . . . . 5.13 105.999 -169.02 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 34.4 m -88.5 -12.25 10.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 113.698 -1.592 . . . . 2.37 111.102 -173.679 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -71.42 -77.19 0.53 Allowed Glycine 0 C--N 1.338 0.669 0 N-CA-C 107.416 -2.274 . . . . 2.68 107.416 165.654 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.1 43.72 0.37 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.863 1.665 . . . . 3.22 112.65 -177.765 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -67.82 -28.48 67.61 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 108.549 -0.908 . . . . 1.17 108.549 169.18 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.9 -53.17 61.42 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.097 0.862 . . . . 4.48 110.044 173.521 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -47.22 -56.06 7.41 Favored 'General case' 0 C--N 1.342 0.259 0 C-N-CA 124.003 0.921 . . . . 2.48 109.508 173.002 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -56.61 -61.46 2.4 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 120.812 -0.355 . . . . 4.65 110.193 -176.999 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -45.03 -55.25 5.74 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 125.242 1.417 . . . . 1.61 110.271 179.766 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -60.98 -41.1 95.79 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 125.168 1.387 . . . . 3.5 110.528 -177.178 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 50.5 m -64.96 -31.7 73.07 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.017 0.527 . . . . 1.85 111.82 175.43 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 mp -74.42 -52.83 10.94 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.809 0.731 . . . . 1.54 111.133 173.357 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.256 19.8 t0 -57.88 -8.62 1.02 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.969 2.907 . . . . 1.66 117.635 -164.451 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 8.8 m -33.6 -18.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.472 1 C-N-CA 132.776 4.431 . . . . 1.4 119.344 -139.8 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.6 -37.75 58.74 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 120.145 1.339 . . . . 2.72 109.616 158.114 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 67.44 68.12 0.38 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 126.744 2.018 . . . . 3.3 108.95 -171.87 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 28.4 p30 -128.03 -10.47 5.38 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.373 1.869 . . . . 1.89 113.494 -172.652 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 17.9 m 72.14 4.04 4.88 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.311 1.444 . . . . 1.86 114.589 -178.578 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 70' ' ' GLU . . . . . 0.407 ' OE1' ' NZ ' ' B' ' 72' ' ' LYS . 1.8 mt-10 -99.12 103.35 15.25 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 106.321 -1.733 . . . . 3.79 106.321 156.245 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.26 94.43 1.19 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 104.331 -2.47 . . . . 1.17 104.331 158.975 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 72' ' ' LYS . . . . . 0.407 ' NZ ' ' OE1' ' B' ' 70' ' ' GLU . 20.6 ttmm -81.78 172.48 13.31 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.973 0.909 . . . . 3.27 110.429 -170.272 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -87.83 56.06 3.73 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.0 -1.063 . . . . 4.61 111.257 177.178 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 74' ' ' ASN . . . . . 0.505 ' HB2' ' CE ' ' A' ' 85' ' ' LYS . 0.5 OUTLIER -161.35 55.72 0.28 Allowed 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 107.32 -1.363 . . . . 2.57 107.32 100.263 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -90.9 -60.97 1.77 Allowed 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 124.741 1.216 . . . . 2.09 108.808 139.562 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -56.77 -37.05 70.55 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 124.09 0.956 . . . . 5.77 112.177 -161.95 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.566 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 1.6 t-105 -45.46 -39.74 7.52 Favored 'General case' 0 C--O 1.219 -0.512 0 O-C-N 123.565 0.541 . . . . 5.5 109.987 175.727 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -39.62 -48.46 2.1 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 120.965 -1.084 . . . . 4.28 112.038 -169.105 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 13.1 tp -49.53 -46.71 48.88 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.421 0.688 . . . . 1.02 111.244 177.445 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 8.5 mm -58.37 -42.25 83.5 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.103 0 C-N-CA 127.284 2.233 . . . . 2.8 108.169 -178.824 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -64.5 -51.18 54.5 Favored Glycine 0 N--CA 1.441 -1.019 0 N-CA-C 109.971 -1.252 . . . . 1.58 109.971 178.166 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -50.89 -47.47 60.59 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 118.235 -0.888 . . . . 2.17 110.712 178.166 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.434 HD23 HD21 ' B' ' 50' ' ' LEU . 22.1 mt -39.14 -54.5 1.75 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.598 1.09 . . . . 1.94 113.214 -178.25 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.78 -26.25 68.62 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.917 1.287 . . . . 1.32 112.143 -176.55 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -80.72 -53.42 6.53 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.131 0.973 . . . . 1.96 109.526 171.648 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 86' ' ' GLU . . . . . 0.451 ' CG ' HD22 ' B' ' 50' ' ' LEU . 4.2 mm-40 -57.6 -40.42 79.03 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.993 0.917 . . . . 2.55 111.718 -171.113 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 10.8 tt -50.01 -36.68 12.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 118.568 0.622 . . . . 1.03 111.885 174.758 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -49.11 11.23 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.518 0.727 . . . . 5.36 109.726 174.774 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 32.2 mttm -106.38 116.35 31.77 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.886 1.674 . . . . 5.14 112.144 -166.16 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -38.39 -13.37 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 130.291 3.436 . . . . 6.36 119.157 174.14 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 91' ' ' LYS . . . . . 0.405 ' NZ ' ' OD2' ' B' ' 52' ' ' ASP . 7.4 tppt? 114.16 26.99 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.67 1 C-N-CA 132.064 4.145 . . . . 9.28 107.514 -158.226 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -82.05 64.15 6.6 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.644 1.578 . . . . 3.95 109.598 -176.672 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -137.48 -116.75 0.16 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.956 0.902 . . . . 4.85 110.939 -179.969 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt 59.48 -164.95 0.2 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.952 1.301 . . . . 7.72 110.261 -168.494 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . 0.254 0.2 OUTLIER 36.93 90.59 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 127.734 2.414 . . . . 8.0 115.04 -179.929 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.8 107.96 3.75 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 120.946 -1.097 . . . . 11.43 109.471 166.381 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 56.7 tttp -175.71 137.26 0.34 Allowed 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 104.794 -2.298 . . . . 6.4 104.794 -169.375 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.232 0 N-CA-C 105.97 -1.863 . . . . 10.23 105.97 -155.18 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.2 mtt . . . . . 0 N--CA 1.472 0.64 0 N-CA-C 105.854 -1.906 . . . . 6.64 105.854 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.06 176.49 1.25 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-N 118.9 0.773 . . . . 3.05 110.174 162.957 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.84 98.73 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 128.963 2.905 . . . . 3.24 109.171 -171.849 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -96.04 115.57 65.65 Favored Pre-proline 0 N--CA 1.451 -0.391 0 C-N-CA 124.996 1.318 . . . . 4.82 109.093 -174.234 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -70.54 146.94 56.72 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 121.859 1.706 . . . . 2.73 108.385 175.373 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 51.9 mt -101.15 173.14 6.6 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.256 -1.016 . . . . 1.44 108.256 -176.178 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' THR . . . . . 0.605 HG22 ' OE1' ' A' ' 10' ' ' GLU . 8.9 t -71.14 161.47 31.05 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 120.573 -1.329 . . . . 2.51 110.001 178.548 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -48.34 -43.77 33.72 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 124.072 0.949 . . . . 2.61 111.382 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.424 ' H ' HD12 ' A' ' 9' ' ' LEU . 5.6 mp -63.29 -54.46 36.84 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 109.308 -0.627 . . . . 1.96 109.308 -177.265 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 10' ' ' GLU . . . . . 0.605 ' OE1' HG22 ' A' ' 7' ' ' THR . 81.6 mt-10 -49.64 -57.71 6.67 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.586 1.554 . . . . 2.7 110.898 174.975 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -49.93 -51.13 43.36 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.889 0.876 . . . . 3.59 109.94 177.966 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.8 p -64.3 -47.86 77.86 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.543 -0.723 . . . . 1.61 112.21 -178.124 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.276 2.6 pp -63.13 -31.57 53.15 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 O-C-N 121.131 -0.981 . . . . 1.1 110.283 -179.577 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -65.73 -57.07 8.89 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 120.026 -0.669 . . . . 3.14 109.404 169.281 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -48.38 -43.52 33.92 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.983 0.81 . . . . 1.4 111.616 -171.764 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.4 m -69.75 -39.39 77.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 121.402 -0.811 . . . . 1.03 111.568 177.413 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.8 t -63.73 -48.17 87.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.729 0.812 . . . . 0.99 110.572 177.614 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.7 t -60.89 -44.04 97.66 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 120.981 -1.075 . . . . 0.85 110.741 174.398 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 61.1 m -57.34 -45.08 84.68 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.327 0.967 . . . . 0.77 110.264 176.433 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -53.33 -60.07 3.76 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.178 0.591 . . . . 3.37 110.235 172.4 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -58.76 -48.0 82.74 Favored 'General case' 0 C--O 1.232 0.169 0 O-C-N 121.693 -0.63 . . . . 4.25 112.185 -174.125 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -63.47 -23.11 67.26 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 118.639 -0.696 . . . . 1.92 111.243 -178.186 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -80.05 -42.03 24.54 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 118.462 0.574 . . . . 2.95 111.185 167.78 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.93 -32.19 65.72 Favored 'General case' 0 C--O 1.238 0.474 0 O-C-N 120.68 -1.263 . . . . 1.28 112.579 -175.539 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.255 0.0 OUTLIER -77.14 -15.17 59.64 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.804 1.641 . . . . 3.82 113.971 179.546 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.04 -65.08 0.4 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.457 1.026 . . . . 1.9 112.03 177.248 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -141.21 -175.31 4.29 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 125.72 1.608 . . . . 5.46 109.226 -170.999 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 25.12 92.76 0.01 OUTLIER Glycine 0 C--N 1.341 0.858 0 C-N-CA 127.197 2.332 . . . . 2.39 113.179 157.841 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 62.44 102.01 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.55 1.14 . . . . 5.45 110.35 178.854 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.9 pttt -79.03 50.99 1.09 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.115 1.366 . . . . 6.49 112.074 -166.404 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -172.01 -55.15 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 107.815 -1.18 . . . . 5.6 107.815 -156.839 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.7 p -84.74 153.81 22.81 Favored 'General case' 0 C--O 1.244 0.799 0 C-N-CA 124.058 0.943 . . . . 2.42 110.886 170.486 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -94.67 119.08 32.74 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.094 -1.076 . . . . 2.06 108.094 172.843 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.4 m -82.41 166.28 19.54 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.345 -0.983 . . . . 3.07 108.345 171.778 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.0 t -60.99 -57.96 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 O-C-N 121.139 -0.976 . . . . 2.29 111.275 -171.558 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -61.33 -43.25 99.19 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.096 0.474 . . . . 3.4 110.888 -179.665 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -50.83 -50.6 56.22 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.668 1.187 . . . . 2.52 110.324 176.188 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -62.94 -44.11 96.97 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.829 -0.544 . . . . 3.65 110.933 173.71 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -49.22 -38.81 27.58 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.641 -0.695 . . . . 3.72 111.234 -178.292 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -46.06 -48.76 16.9 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 118.807 0.731 . . . . 2.87 112.085 172.754 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -59.32 -51.37 70.23 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 108.949 -0.76 . . . . 2.47 108.949 -173.167 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.99 -33.66 48.18 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 CA-C-N 115.87 -0.605 . . . . 1.34 110.012 -173.769 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 91.1 m -69.33 -32.77 72.09 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.896 0.878 . . . . 1.23 111.124 174.012 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -81.16 -58.84 2.88 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 125.002 1.321 . . . . 2.57 109.878 -174.392 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -99.95 -135.26 0.29 Allowed 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 108.898 -0.779 . . . . 3.85 108.898 176.322 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' LEU . . . . . 0.451 HD22 ' H ' ' A' ' 46' ' ' LEU . 2.8 mm? 29.98 51.75 0.46 Allowed Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 127.309 2.244 . . . . 2.08 113.949 -170.688 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -66.95 -40.08 12.74 Favored 'Trans proline' 0 N--CA 1.448 -1.201 0 C-N-CA 121.97 1.78 . . . . 1.73 111.175 178.424 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 20.6 t-160 -116.71 -28.05 6.48 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-O 119.216 -0.421 . . . . 4.13 111.636 -165.166 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 tp -64.53 -74.75 0.1 Allowed 'General case' 0 C--O 1.232 0.174 0 CA-C-N 119.481 1.037 . . . . 1.4 110.832 179.903 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 85.2 mt -119.54 83.63 2.07 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.338 1.455 . . . . 2.31 107.362 -174.406 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -178.34 0.31 Allowed 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 114.976 -1.011 . . . . 5.78 109.433 167.626 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 80.97 44.2 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 125.192 1.397 . . . . 4.0 110.053 -179.8 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -59.99 -21.5 22.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 C-N-CA 124.833 1.253 . . . . 3.47 111.188 175.873 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -56.18 -53.97 38.92 Favored Glycine 0 CA--C 1.528 0.899 0 N-CA-C 110.736 -0.945 . . . . 1.66 110.736 169.439 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 56.0 p -80.14 40.71 0.49 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.062 0.931 . . . . 2.88 111.726 -172.132 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -57.21 -36.92 71.46 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 120.811 -1.181 . . . . 1.62 110.501 -172.373 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.09 -34.95 58.9 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.689 0.996 . . . . 4.57 113.689 177.459 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -57.99 -51.97 67.45 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.571 0.701 . . . . 3.15 109.219 174.313 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.75 -51.07 70.89 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.574 -1.269 . . . . 3.68 107.574 -178.694 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -46.35 -60.88 2.06 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 123.922 0.889 . . . . 1.44 109.988 176.93 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -67.32 -28.34 67.91 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.055 0.843 . . . . 4.17 112.396 -176.645 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 49.5 m -61.74 -32.04 72.26 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.647 0.658 . . . . 2.24 111.804 169.543 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 63' ' ' LEU . . . . . 0.485 HD23 ' HB3' ' A' ' 78' ' ' ARG . 12.1 mt -91.24 -64.38 1.13 Allowed 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 124.714 1.206 . . . . 1.72 111.305 -175.52 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -74.48 71.61 1.83 Allowed 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.242 1.417 . . . . 2.15 109.96 -173.803 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -33.1 8.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 124.934 1.294 . . . . 3.39 112.766 -177.507 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -85.14 -10.2 57.0 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.214 1.006 . . . . 2.13 113.095 -179.203 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.86 39.85 26.67 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.862 1.265 . . . . 5.1 110.693 179.372 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 31.0 p30 -88.62 -14.53 37.27 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.006 0.922 . . . . 2.16 109.92 174.993 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.2 m 69.34 15.75 8.43 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.942 1.297 . . . . 1.59 112.974 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -121.66 105.61 10.58 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.609 1.563 . . . . 3.96 107.474 167.24 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.14 109.32 16.34 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 105.976 -1.861 . . . . 1.26 105.976 -175.154 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -85.06 148.54 26.1 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.435 1.094 . . . . 3.46 108.149 177.048 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -39.69 -56.37 1.72 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.012 1.325 . . . . 5.15 114.159 -173.44 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -68.06 -29.08 67.96 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.451 -0.781 . . . . 2.05 112.173 -178.609 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -66.13 -51.36 58.69 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 107.975 -1.12 . . . . 2.19 107.975 173.104 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.98 -44.44 64.02 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.315 1.046 . . . . 6.4 110.395 177.948 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.679 ' CZ2' ' CE2' ' B' ' 77' ' ' TRP . 23.5 t90 -40.63 -38.71 0.92 Allowed 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 117.705 -1.14 . . . . 5.01 113.061 -171.615 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.485 ' HB3' HD23 ' A' ' 63' ' ' LEU . 15.3 ttt180 -39.24 -49.49 1.9 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.61 1.096 . . . . 6.39 111.012 175.805 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 9.6 tp -46.97 -46.47 21.6 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 123.368 0.667 . . . . 0.87 110.27 -177.751 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 53.2 mt -66.31 -33.0 60.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 121.829 0.823 . . . . 1.94 109.319 -174.066 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.56 ' HA2' ' CE2' ' B' ' 77' ' ' TRP . . . -63.6 -48.87 73.65 Favored Glycine 0 CA--C 1.492 -1.373 0 C-N-CA 126.888 2.185 . . . . 1.43 110.073 176.728 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 4.0 mm-40 -69.89 -53.07 19.67 Favored 'General case' 0 N--CA 1.433 -1.298 0 N-CA-C 106.002 -1.851 . . . . 2.42 106.002 -173.976 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mt -40.13 -59.39 1.26 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.913 1.285 . . . . 2.52 111.375 168.835 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.72 -41.35 77.3 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.43 0.692 . . . . 1.16 110.943 -179.485 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -58.92 -52.19 66.79 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 121.896 -0.503 . . . . 1.97 110.184 174.091 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -52.42 -46.31 66.3 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.409 1.883 . . . . 2.31 110.288 -168.143 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.8 tt -53.77 -29.99 18.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 N-CA-C 112.52 0.563 . . . . 1.48 112.52 178.246 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -88.68 -45.48 9.79 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.109 0.964 . . . . 6.12 111.25 174.15 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.3 tttt -80.98 -32.38 34.36 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 128.233 2.613 . . . . 3.48 114.299 -165.124 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 27.2 mttm -31.86 -62.69 0.2 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 120.425 1.466 . . . . 7.33 114.699 -117.086 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.4 ttmt -146.66 60.94 1.21 Allowed 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.525 -1.287 . . . . 8.93 107.525 175.634 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.61 95.41 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.373 1.469 . . . . 6.65 109.595 172.954 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.0 tp -173.47 -58.29 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 104.919 -2.252 . . . . 8.13 104.919 -168.346 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -73.01 171.77 12.24 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 108.773 -0.825 . . . . 10.48 108.773 161.95 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.6 tt -57.26 143.93 10.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 122.964 0.506 . . . . 11.33 110.454 179.495 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -78.02 151.69 33.42 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.044 0.537 . . . . 14.03 109.558 -174.084 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -177.57 -27.01 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.296 1.438 . . . . 10.4 111.08 -170.924 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 98' ' ' LYS . . . . . 0.446 ' NZ ' ' OE2' ' B' ' 4' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.954 0 C-N-CA 126.754 2.022 . . . . 9.71 110.531 -176.787 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 52.7 mmm . . . . . 0 N--CA 1.477 0.908 0 CA-C-O 118.511 -0.757 . . . . 7.21 111.51 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -176.58 166.2 2.66 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-N 119.576 1.08 . . . . 7.33 108.831 176.579 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 65.92 89.54 0.1 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.043 1.737 . . . . 6.46 115.593 155.476 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 4' ' ' GLU . . . . . 0.446 ' OE2' ' NZ ' ' A' ' 98' ' ' LYS . 54.0 mt-10 -138.43 151.18 68.7 Favored Pre-proline 0 CA--C 1.537 0.464 0 N-CA-C 105.432 -2.062 . . . . 5.29 105.432 148.568 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -76.91 147.08 26.7 Favored 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 123.452 2.768 . . . . 3.56 110.709 -179.655 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.3 mt -144.47 -159.12 0.95 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.346 1.858 . . . . 3.06 109.821 -166.227 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 7' ' ' THR . . . . . 0.485 HG23 ' N ' ' B' ' 8' ' ' GLU . 4.0 t -69.13 -70.56 0.27 Allowed 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 115.221 1.563 . . . . 2.36 115.221 -165.766 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 8' ' ' GLU . . . . . 0.485 ' N ' HG23 ' B' ' 7' ' ' THR . 28.4 tt0 -171.93 -73.45 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.411 1.484 . . . . 2.39 108.334 -168.094 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 17.4 mt -56.47 -41.24 76.23 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.574 -1.328 . . . . 1.05 110.064 167.798 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 10' ' ' GLU . . . . . 0.446 ' CG ' HG22 ' B' ' 7' ' ' THR . 78.4 mt-10 -54.59 -41.8 70.33 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.52 0.728 . . . . 3.51 111.319 171.964 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -63.42 -43.54 97.2 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 120.891 -1.131 . . . . 4.31 110.43 173.974 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.2 t -59.58 -45.42 91.92 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.305 0.642 . . . . 1.83 110.624 -178.259 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.8 pp -66.46 -38.0 80.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 118.151 0.432 . . . . 1.0 110.4 172.869 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -56.09 -60.34 3.63 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-O 117.894 -1.051 . . . . 2.73 109.764 178.929 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.1 t -56.93 -28.82 62.51 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 120.182 1.355 . . . . 1.24 113.455 -170.516 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 27.2 m -81.05 -44.66 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 O-C-N 121.426 -0.797 . . . . 0.89 109.626 -178.669 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 85.9 t -54.38 -35.46 30.95 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.407 0 N-CA-C 108.405 -0.961 . . . . 1.12 108.405 165.748 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . 2.238 1.5 t -54.59 -63.76 1.05 Allowed 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 126.543 1.937 . . . . 3.29 110.834 -178.72 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 49.8 m -51.32 -59.66 3.98 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 110.805 -2.907 . . . . 1.02 110.166 176.598 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -58.91 -54.55 45.81 Favored 'General case' 0 C--O 1.223 -0.331 0 O-C-N 122.108 -0.37 . . . . 6.89 110.815 -178.946 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -57.72 -45.76 85.32 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.895 1.278 . . . . 3.17 111.768 -176.52 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 2.7 t -65.72 -52.9 47.54 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.082 -0.71 . . . . 3.09 109.082 177.158 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -55.5 -38.95 69.84 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.696 0.76 . . . . 3.54 111.046 -179.031 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.93 -24.2 36.43 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.153 2.181 . . . . 1.14 110.6 -179.42 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -19.24 34.67 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 117.844 -1.074 . . . . 4.18 111.841 175.783 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.435 ' HB3' ' HG3' ' B' ' 37' ' ' GLU . 0.5 OUTLIER -50.57 -67.52 0.25 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.881 1.067 . . . . 2.11 113.881 -160.96 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 68.4 mt-10 -90.14 -44.48 9.75 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 125.931 1.692 . . . . 3.72 111.977 -179.091 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.5 -143.48 1.12 Allowed Glycine 0 CA--C 1.536 1.36 0 CA-C-N 115.269 -0.878 . . . . 3.75 113.546 -166.052 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 16.2 mtt-85 50.35 99.45 0.01 OUTLIER 'General case' 0 C--O 1.237 0.404 1 C-N-CA 131.755 4.022 . . . . 3.58 112.464 27.349 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 10.4 ptpp? -66.42 -177.72 0.59 Allowed 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 119.092 -1.043 . . . . 3.85 109.195 148.946 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 9.1 t70 78.31 -59.83 0.42 Allowed 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 127.593 2.357 . . . . 4.15 109.846 179.809 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 25.8 p -88.12 134.66 33.71 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.471 0.653 . . . . 1.85 110.201 175.857 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.14 141.89 32.71 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 106.84 -1.541 . . . . 2.2 106.84 167.056 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 4.5 t -92.79 -172.32 2.99 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 125.086 1.354 . . . . 2.21 109.998 165.771 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 35' ' ' VAL . . . . . 0.408 ' C ' ' H ' ' B' ' 37' ' ' GLU . 70.9 t -67.53 -112.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.431 2 N-CA-C 99.47 -4.27 . . . . 3.52 99.47 -179.354 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.75 53.78 0.75 Allowed 'General case' 0 CA--C 1.556 1.202 0 CA-C-N 123.505 2.866 . . . . 2.9 112.136 -172.171 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.435 ' HG3' ' HB3' ' B' ' 26' ' ' GLN . 3.3 tt0 -105.4 -58.0 1.96 Allowed 'General case' 0 N--CA 1.448 -0.552 1 C-N-CA 132.292 4.237 . . . . 1.66 104.099 150.38 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -57.68 -40.16 78.8 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.716 0.806 . . . . 2.17 110.161 -178.767 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.7 ttpm? -58.02 -37.06 73.6 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 119.126 -1.03 . . . . 4.63 109.981 179.647 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -73.83 -25.58 60.16 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 116.413 -0.358 . . . . 4.9 110.687 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 tt -67.57 -48.76 65.98 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.484 -0.932 . . . . 2.69 108.484 172.558 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 2.1 m -65.24 -51.09 69.51 Favored 'Isoleucine or valine' 0 C--N 1.34 0.166 0 N-CA-C 109.344 -0.613 . . . . 1.12 109.344 -177.858 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 94.6 m -51.31 -56.6 12.18 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.722 0.809 . . . . 0.89 111.576 176.557 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 44.4 tt0 -80.87 -54.37 5.65 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.757 0.28 . . . . 1.77 111.757 -169.612 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 26.5 mm100 -80.11 -40.23 27.92 Favored 'General case' 0 C--O 1.227 -0.131 0 N-CA-C 113.573 0.953 . . . . 3.57 113.573 -164.64 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.62 -41.89 92.01 Favored Pre-proline 0 N--CA 1.467 0.393 0 CA-C-N 118.937 0.79 . . . . 2.08 112.47 -168.237 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -70.61 -54.4 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.926 0 N-CA-C 107.631 -1.719 . . . . 2.63 107.631 -41.91 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 50.7 t60 -66.44 -43.62 85.11 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.786 1.234 . . . . 3.48 112.046 -175.311 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 27.0 tp -33.85 -62.96 0.28 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.123 1.769 . . . . 1.36 113.257 -168.635 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 50' ' ' LEU . . . . . 0.495 ' CD1' HD11 ' B' ' 79' ' ' LEU . 35.2 mt -81.34 97.59 7.77 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 107.76 -1.2 . . . . 1.69 107.76 167.152 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -49.44 145.07 5.02 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.081 -0.711 . . . . 6.05 109.081 171.065 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 40.7 t0 63.38 60.19 1.17 Allowed 'General case' 0 C--N 1.339 0.134 0 CA-C-O 123.987 1.851 . . . . 4.31 109.191 171.29 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 33.7 m -56.07 -21.27 11.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 112.36 -2.2 . . . . 2.08 111.245 164.142 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -64.34 -60.52 7.0 Favored Glycine 0 C--N 1.341 0.82 0 C-N-CA 124.455 1.026 . . . . 2.97 111.378 178.367 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.2 t -77.21 66.68 3.04 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 122.396 1.094 . . . . 2.71 109.675 -175.846 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.09 -34.88 71.56 Favored 'General case' 0 N--CA 1.44 -0.926 0 C-N-CA 125.274 1.43 . . . . 1.3 109.917 -174.162 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -18.08 -70.35 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 127.128 2.171 . . . . 4.19 115.508 167.194 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -38.77 78.67 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.705 1.139 . . . . 3.21 111.635 -175.676 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.98 -60.08 4.35 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.203 -1.036 . . . . 3.56 108.203 172.734 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -46.16 -51.43 14.11 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-N 118.962 0.801 . . . . 2.26 110.982 -178.36 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -63.0 -42.21 99.79 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.74 -0.6 . . . . 3.55 111.954 178.827 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 24.8 t -61.16 -39.67 90.97 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.7 0.682 . . . . 2.3 111.828 174.763 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 63' ' ' LEU . . . . . 0.438 HD23 ' HB2' ' B' ' 78' ' ' ARG . 34.4 mt -80.83 -61.19 2.04 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.478 1.111 . . . . 1.64 110.669 -171.822 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -71.11 -10.12 59.22 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 128.888 2.875 . . . . 2.94 115.101 -162.636 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -37.72 -19.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 C-N-CA 131.143 3.777 . . . . 3.99 117.441 -160.698 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -61.12 -19.42 61.48 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 120.192 1.36 . . . . 2.76 111.747 171.845 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 101.16 -25.3 0.02 OUTLIER 'General case' 0 C--N 1.343 0.309 0 C-N-CA 127.605 2.362 . . . . 3.62 111.32 166.982 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -61.62 139.32 58.29 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 118.457 -1.297 . . . . 2.99 107.546 164.848 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 1.7 p -78.33 12.9 1.71 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 127.929 2.492 . . . . 3.28 112.987 -179.576 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -87.63 116.76 25.98 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 104.389 -2.449 . . . . 3.26 104.389 162.839 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.05 90.59 0.09 Allowed 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 104.924 -2.25 . . . . 1.85 104.924 157.463 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 36.6 tptt -80.02 168.45 19.17 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.331 -0.989 . . . . 4.94 108.331 -165.564 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -91.61 61.02 4.17 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.22 -0.659 . . . . 4.64 109.22 175.627 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -154.89 50.94 0.6 Allowed 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 119.096 -1.042 . . . . 3.9 112.661 87.203 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -86.42 -55.92 3.67 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.691 1.597 . . . . 2.2 108.288 153.798 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -50.62 -39.95 51.59 Favored 'General case' 0 C--N 1.344 0.354 0 C-N-CA 123.021 0.528 . . . . 5.91 110.427 -174.377 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.679 ' CE2' ' CZ2' ' A' ' 77' ' ' TRP . 27.8 t90 -47.44 -38.49 13.62 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 123.651 0.781 . . . . 4.0 111.206 -179.808 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 78' ' ' ARG . . . . . 0.438 ' HB2' HD23 ' B' ' 63' ' ' LEU . 54.5 mtp85 -43.05 -38.79 2.45 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.681 1.193 . . . . 4.31 111.716 177.079 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 79' ' ' LEU . . . . . 0.495 HD11 ' CD1' ' B' ' 50' ' ' LEU . 13.7 tp -51.62 -47.45 63.66 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 117.915 0.325 . . . . 0.86 111.05 177.686 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 65.3 mt -65.74 -26.04 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 109.133 -0.691 . . . . 1.73 109.133 -176.252 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.574 ' N ' ' CZ2' ' A' ' 77' ' ' TRP . . . -67.15 -51.64 37.43 Favored Glycine 0 CA--C 1.501 -0.829 0 C-N-CA 126.907 2.194 . . . . 1.78 108.112 176.104 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -51.99 -60.95 2.59 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.168 -1.049 . . . . 4.39 108.168 169.411 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.4 mt -48.09 -51.96 22.33 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 120.526 1.512 . . . . 2.49 113.121 -175.701 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.0 -33.93 62.99 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.26 1.024 . . . . 1.91 110.548 178.647 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.89 -56.39 5.8 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 117.284 -1.341 . . . . 1.98 111.423 165.538 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -52.73 -36.15 57.17 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 120.295 1.407 . . . . 2.54 112.894 -164.092 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 3.0 tt -55.61 -38.2 49.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 O-C-N 121.598 -0.689 . . . . 0.99 111.446 175.222 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -84.06 -61.66 1.76 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.248 1.419 . . . . 6.58 113.463 169.949 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 10.8 pttp -83.09 147.97 27.79 Favored 'General case' 0 C--O 1.223 -0.302 0 O-C-N 120.804 -1.185 . . . . 6.51 111.83 -169.555 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 47.9 tttt -81.12 -60.28 2.35 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 109.225 -0.657 . . . . 5.48 109.225 164.874 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 37.6 tptt -144.24 21.07 1.73 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.143 0.977 . . . . 8.06 109.718 166.627 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 18.2 t70 33.85 -122.49 0.09 Allowed 'General case' 0 C--N 1.346 0.43 0 C-N-CA 126.223 1.809 . . . . 4.89 109.329 -167.783 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 33.2 tp -110.11 134.86 51.75 Favored 'General case' 0 N--CA 1.434 -1.237 0 N-CA-C 105.189 -2.152 . . . . 9.24 105.189 154.314 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -31.52 131.66 0.11 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.733 1.213 . . . . 7.23 112.382 163.445 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 42.5 pt -103.05 150.13 6.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 C-N-CA 124.227 1.011 . . . . 7.65 109.77 -179.83 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.41 -179.01 3.76 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 125.992 1.717 . . . . 6.3 106.958 170.008 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 6.8 ttmt -175.9 137.25 0.33 Allowed 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 106.29 -1.745 . . . . 7.63 106.29 178.381 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.333 0 N-CA-C 104.903 -2.258 . . . . 6.77 104.903 165.962 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.2 mtt . . . . . 0 N--CA 1.475 0.819 0 N-CA-C 104.905 -2.258 . . . . 6.53 104.905 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -63.66 178.04 0.64 Allowed 'General case' 0 C--O 1.238 0.481 0 N-CA-C 108.566 -0.902 . . . . 2.98 108.566 135.048 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 73.15 87.77 0.1 Allowed 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.932 1.693 . . . . 3.56 109.429 -170.867 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -74.61 123.16 88.88 Favored Pre-proline 0 N--CA 1.444 -0.728 0 C-N-CA 125.425 1.49 . . . . 4.44 108.82 -176.523 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -67.53 141.98 57.49 Favored 'Trans proline' 0 N--CA 1.45 -1.079 0 N-CA-C 107.522 -1.761 . . . . 2.25 107.522 171.028 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.6 mt -96.84 173.9 7.07 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 107.4 -1.333 . . . . 1.33 107.4 179.324 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.9 t -72.47 166.63 22.23 Favored 'General case' 0 CA--C 1.529 0.173 0 O-C-N 120.804 -1.185 . . . . 1.85 110.534 -177.824 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -52.8 -57.42 10.23 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.961 0.886 . . . . 2.19 111.39 -169.019 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 mt -66.63 -31.2 71.74 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 117.436 -1.269 . . . . 1.64 112.08 178.679 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 77.6 mt-10 -55.67 -55.97 25.95 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.84 1.654 . . . . 1.95 110.92 168.482 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -48.56 -51.44 27.7 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 122.028 0.918 . . . . 3.39 109.18 174.748 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.2 t -60.01 -53.58 56.15 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.279 -0.873 . . . . 1.83 112.42 -173.787 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.356 0.1 OUTLIER -71.29 -33.24 49.8 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 119.404 1.002 . . . . 1.45 110.415 -178.584 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -53.44 -53.3 53.25 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.081 0.855 . . . . 2.67 109.693 173.293 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.5 t -59.22 -25.38 63.96 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.953 1.094 . . . . 1.49 113.953 -173.686 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.7 m -81.24 -42.22 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 120.286 1.403 . . . . 0.65 110.776 169.498 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.1 t -56.05 -46.05 80.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 123.89 0.876 . . . . 0.74 111.018 179.62 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.3 t -60.65 -47.08 87.82 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.174 0.897 . . . . 0.76 110.632 177.309 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.3 m -58.26 -47.12 84.59 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.358 -0.839 . . . . 0.83 110.073 179.275 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.455 ' CZ ' HD23 ' A' ' 33' ' ' LEU . 7.6 t80 -52.34 -56.98 11.27 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.566 1.146 . . . . 3.01 110.696 171.171 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -68.62 -39.56 80.77 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 123.91 0.884 . . . . 2.66 110.928 -166.506 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.3 p -57.92 -60.35 3.85 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.621 -0.881 . . . . 2.46 108.621 169.762 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -49.04 -41.39 34.8 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 118.874 0.761 . . . . 3.0 113.044 -179.75 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.68 -25.75 19.57 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 127.037 2.135 . . . . 1.1 111.711 -174.774 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -34.1 70.73 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.999 1.32 . . . . 4.15 112.367 176.575 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -52.85 -52.03 58.73 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-O 121.642 0.734 . . . . 1.98 112.53 -157.323 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -119.34 165.3 14.48 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 127.839 2.456 . . . . 2.7 105.923 176.033 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 9.19 106.98 0.0 OUTLIER Glycine 0 CA--C 1.536 1.372 0 C-N-CA 126.798 2.142 . . . . 1.46 115.768 165.593 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? 66.38 105.41 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.848 1.259 . . . . 5.88 113.904 165.552 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.3 pttp -65.29 63.99 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.499 0.72 . . . . 3.53 111.245 164.529 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -171.67 -53.59 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 126.9 2.08 . . . . 3.68 106.965 -175.987 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 m -84.4 128.0 34.33 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 124.345 1.058 . . . . 2.58 109.803 174.283 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.455 HD23 ' CZ ' ' A' ' 20' ' ' PHE . 2.2 mm? -82.56 145.88 29.49 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 107.378 -1.342 . . . . 2.59 107.378 172.499 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.3 m -121.02 164.47 16.71 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 125.179 1.392 . . . . 4.23 107.815 -169.183 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.7 p -68.94 -36.16 72.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 O-C-N 120.707 -1.245 . . . . 2.63 112.193 -167.819 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -69.26 -48.84 60.65 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 107.551 -1.277 . . . . 1.99 107.551 179.648 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -44.74 -54.66 6.04 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.911 0.884 . . . . 1.95 111.021 171.396 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -51.22 -57.03 9.89 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.67 -0.695 . . . . 2.76 110.498 177.637 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.536 ' HE3' HD12 ' A' ' 56' ' ' LEU . 17.0 ttmt -59.52 -42.02 91.28 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.249 0.477 . . . . 3.82 111.874 179.785 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -56.83 -39.7 74.69 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.277 -0.89 . . . . 2.48 110.452 176.946 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -63.41 -47.33 82.41 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 108.024 -1.102 . . . . 2.09 108.024 -174.846 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.53 -54.24 27.76 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 N-CA-C 109.995 -0.372 . . . . 0.88 109.995 -179.103 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 92.3 m -50.0 -48.31 52.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.745 1.218 . . . . 1.13 110.877 -179.717 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -76.74 -45.41 29.31 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.35 0.66 . . . . 2.4 110.862 -174.643 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -135.01 10.67 3.58 Favored 'General case' 0 C--N 1.343 0.311 0 N-CA-C 116.527 2.047 . . . . 3.51 116.527 -161.214 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -120.47 69.89 16.25 Favored Pre-proline 0 N--CA 1.469 0.517 0 CA-C-N 121.133 1.788 . . . . 1.87 109.567 164.1 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.28 -39.86 9.39 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 123.242 2.628 . . . . 1.8 111.391 -178.171 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -97.95 -50.38 4.43 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 118.476 0.58 . . . . 3.83 109.749 -177.442 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.53 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 0.9 OUTLIER -55.47 -64.56 0.81 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 121.361 0.601 . . . . 1.79 111.673 -167.914 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.402 ' C ' ' H ' ' A' ' 52' ' ' ASP . 84.6 mt -116.99 56.52 0.81 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.861 1.265 . . . . 2.97 108.375 -171.326 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.3 31.94 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.262 1.425 . . . . 5.21 112.776 171.394 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 52' ' ' ASP . . . . . 0.402 ' H ' ' C ' ' A' ' 50' ' ' LEU . 33.5 t70 -110.88 29.45 7.75 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 127.899 2.48 . . . . 4.87 108.174 -175.376 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 27.7 m -56.93 -30.02 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 123.588 0.755 . . . . 2.75 111.758 -173.215 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -56.91 -38.29 83.62 Favored Glycine 0 CA--C 1.532 1.154 0 N-CA-C 111.277 -0.729 . . . . 2.39 111.277 174.058 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.8 m -110.86 46.69 1.04 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.299 1.839 . . . . 2.06 109.054 178.759 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 56' ' ' LEU . . . . . 0.536 HD12 ' HE3' ' A' ' 39' ' ' LYS . 3.0 tm? -77.39 -50.54 12.53 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.561 1.144 . . . . 1.21 110.127 171.809 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -64.6 -37.15 86.58 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.426 -0.796 . . . . 5.01 110.694 -162.999 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.59 -40.74 84.04 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.749 0.82 . . . . 4.01 111.664 167.705 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -49.66 77.02 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 107.524 -1.287 . . . . 2.95 107.524 173.789 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.57 -52.19 31.76 Favored 'General case' 0 C--O 1.226 -0.18 0 N-CA-C 109.183 -0.673 . . . . 2.34 109.183 177.996 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -55.0 -45.37 75.05 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 122.395 0.278 . . . . 3.51 110.651 177.178 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.8 t -60.57 -41.76 95.27 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 122.081 -0.387 . . . . 2.44 111.776 179.717 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.5 mp -70.43 -53.15 17.59 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 118.515 0.598 . . . . 1.69 110.042 177.959 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -73.44 75.5 1.42 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.71 0.804 . . . . 2.0 109.342 179.079 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 25.8 m -50.34 -27.67 4.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 124.211 1.004 . . . . 2.23 112.591 179.322 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -77.42 -30.74 53.6 Favored 'General case' 0 CA--C 1.529 0.16 0 O-C-N 121.933 -0.48 . . . . 2.32 111.505 179.106 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 58.39 52.86 6.79 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.868 1.267 . . . . 4.62 109.534 -163.382 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.6 p30 -108.98 -13.25 14.76 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.676 1.991 . . . . 2.57 112.617 -179.362 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.6 m 74.71 2.99 4.17 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.486 1.914 . . . . 2.27 114.161 -176.136 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -86.0 115.95 23.92 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 105.936 -1.876 . . . . 4.13 105.936 152.949 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.27 84.28 7.15 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 102.576 -3.12 . . . . 1.42 102.576 154.26 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.36 155.0 15.52 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 107.774 -1.195 . . . . 5.38 107.774 177.727 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -39.83 -54.69 2.09 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.009 0.924 . . . . 5.3 112.337 -175.685 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -65.08 -31.95 73.41 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.692 0.797 . . . . 3.0 113.041 -179.833 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -70.03 -60.95 1.98 Allowed 'General case' 0 C--O 1.233 0.191 0 N-CA-C 108.377 -0.972 . . . . 2.01 108.377 174.712 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -49.64 -44.09 47.32 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 124.864 1.266 . . . . 3.03 111.065 -178.588 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.408 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.6 OUTLIER -40.02 -40.79 1.11 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 116.235 -1.841 . . . . 5.08 110.125 178.977 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.76 -44.33 3.2 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 121.758 2.072 . . . . 6.45 111.85 -178.267 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 79' ' ' LEU . . . . . 0.478 ' O ' HD13 ' A' ' 83' ' ' LEU . 12.4 tp -53.3 -49.38 67.11 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.502 1.046 . . . . 0.86 111.371 179.663 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 60.7 mt -73.65 -37.4 49.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 125.536 1.534 . . . . 1.71 108.1 -174.925 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -42.98 -58.32 3.76 Favored Glycine 0 N--CA 1.44 -1.036 0 N-CA-C 109.66 -1.376 . . . . 1.56 109.66 165.165 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 82' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 46.3 mm-40 -79.91 -36.05 37.0 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 127.607 2.363 . . . . 2.42 110.153 -160.928 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.53 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 4.9 mp -39.19 -54.93 1.73 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.938 0.895 . . . . 2.45 110.252 170.014 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.13 -24.85 66.58 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.341 1.056 . . . . 1.04 113.449 -178.518 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' A' ' 82' ' ' GLU . 16.7 ttpp -82.76 -50.59 8.52 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.731 1.213 . . . . 1.53 110.737 173.14 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -56.4 -40.18 74.23 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 125.666 1.586 . . . . 2.76 111.852 -174.542 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 10.3 tt -44.68 -29.07 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 N-CA-C 113.291 0.849 . . . . 1.5 113.291 175.376 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -101.76 -63.01 1.19 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.546 0.739 . . . . 4.43 109.785 166.995 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -56.64 -29.84 62.67 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.892 1.071 . . . . 3.38 113.892 -164.356 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.4 tppm? -52.5 -31.73 36.67 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.013 0.824 . . . . 8.88 112.586 -172.004 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.9 mmtt -137.69 -38.52 0.58 Allowed 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 113.436 0.902 . . . . 8.3 113.436 173.096 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 17.4 68.16 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.791 2.036 . . . . 5.88 116.359 -172.277 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -137.58 -46.76 0.55 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.703 0.801 . . . . 9.19 110.613 169.391 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 17.4 mmtp -39.65 -58.76 1.25 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.176 1.391 . . . . 14.08 111.436 178.569 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 5.0 pt -113.36 55.75 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.484 0 CA-C-O 123.592 1.663 . . . . 12.8 108.042 175.229 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . 2.287 0.0 OUTLIER -70.26 57.67 0.17 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 129.716 3.206 . . . . 15.87 114.195 174.777 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -173.24 -50.8 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 114.669 1.359 . . . . 14.63 114.669 -173.295 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.7 mmtp . . . . . 0 C--O 1.253 1.242 0 N-CA-C 114.149 1.166 . . . . 15.12 114.149 -166.03 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.416 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.733 0 N-CA-C 109.391 -0.596 . . . . 7.57 109.391 . . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.434 . . 101.4 -178.49 0.0 OUTLIER 'General case' 0 C--N 1.341 0.233 0 C-N-CA 124.724 1.209 . . . . 4.5 112.194 160.211 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 88.49 95.08 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.75 2.42 . . . . 4.61 111.685 -177.394 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -132.58 148.19 68.58 Favored Pre-proline 0 CA--C 1.547 0.834 0 N-CA-C 104.871 -2.27 . . . . 6.82 104.871 165.269 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -61.39 156.98 43.16 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 123.799 2.999 . . . . 2.78 113.578 -168.165 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -168.56 172.58 8.03 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 118.72 -0.657 . . . . 2.66 111.519 -149.029 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 5.2 t -90.54 -174.97 4.29 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.336 1.054 . . . . 2.19 113.581 -173.65 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -46.77 -73.9 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.287 2.235 . . . . 3.22 112.67 -172.872 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 25.9 mt -55.42 -37.67 67.97 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 121.236 -0.915 . . . . 1.22 111.297 179.359 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -59.76 -36.22 76.22 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 122.779 0.432 . . . . 3.69 111.013 173.572 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -66.13 -46.99 75.58 Favored 'General case' 0 C--N 1.344 0.351 0 O-C-N 120.135 -1.603 . . . . 3.99 109.155 172.077 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -56.27 -42.8 78.03 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.099 0.559 . . . . 1.34 110.287 -175.778 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.263 2.5 pp -70.6 -42.7 78.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 O-C-N 121.622 -0.674 . . . . 0.97 111.033 171.721 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -54.71 -42.41 71.47 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.607 1.094 . . . . 4.34 112.07 179.127 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.1 t -63.18 -31.6 72.79 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.109 -0.994 . . . . 1.23 112.096 -177.919 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 m -80.15 -36.76 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 O-C-N 120.899 -1.125 . . . . 0.96 109.916 173.866 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 58.8 t -57.77 -45.0 87.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 C-N-CA 122.937 0.495 . . . . 1.14 110.343 176.235 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 14.1 t -67.85 -40.42 83.67 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.699 0.682 . . . . 1.27 110.729 177.988 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 51.5 m -55.64 -52.29 64.3 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-N 119.038 0.835 . . . . 1.13 108.891 174.076 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -48.41 -55.63 10.31 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.229 1.411 . . . . 4.52 111.318 171.887 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -56.33 -56.65 18.48 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.05 0.94 . . . . 3.09 109.554 -175.262 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 36.7 p -61.61 -44.79 96.35 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.256 0.622 . . . . 2.32 110.705 -177.576 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -57.64 -61.38 2.55 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.533 1.133 . . . . 5.43 111.008 177.376 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.8 -19.6 51.65 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.668 1.987 . . . . 1.22 111.678 176.656 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . 2.318 0.0 OUTLIER -46.68 -19.1 0.08 Allowed 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 127.956 2.502 . . . . 5.24 113.481 162.368 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -52.07 -64.06 0.94 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 114.101 1.149 . . . . 2.19 114.101 -175.838 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -73.68 -31.6 63.52 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 116.512 2.041 . . . . 5.35 116.512 -154.63 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.22 -111.35 0.43 Allowed Glycine 0 CA--C 1.53 1.013 1 C-N-CA 132.384 4.802 . . . . 3.98 116.075 9.579 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 49.5 ttt85 53.75 98.49 0.01 OUTLIER 'General case' 0 C--O 1.237 0.4 0 C-N-CA 126.512 1.925 . . . . 4.29 112.25 -175.9 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.32 -39.24 93.51 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 121.061 0.458 . . . . 5.09 111.109 177.329 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -75.06 2.33 10.9 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 113.109 0.781 . . . . 3.93 113.109 -171.02 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 1.6 m -154.93 144.21 21.15 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 118.956 0.798 . . . . 2.81 110.657 -177.309 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 33' ' ' LEU . . . . . 0.428 HD13 ' CG ' ' B' ' 76' ' ' TYR . 4.8 mp -131.64 141.31 49.59 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.164 0.985 . . . . 2.78 108.932 178.645 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 8.2 t -108.67 177.24 4.84 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.662 0.744 . . . . 3.02 109.773 168.628 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 10.3 p -84.44 53.77 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.118 0 CA-C-O 122.283 1.039 . . . . 2.51 109.878 177.044 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -155.99 54.33 0.58 Allowed 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 104.825 -2.287 . . . . 3.15 104.825 149.387 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -163.56 -60.42 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 102.403 -3.184 . . . . 2.33 102.403 175.882 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -41.26 -58.08 1.93 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.53 1.132 . . . . 2.94 113.602 -179.129 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 11.9 ttmm -54.78 -30.55 57.1 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.456 0.702 . . . . 2.57 112.42 -179.277 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -65.0 -25.5 67.89 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 121.083 -1.011 . . . . 3.04 110.898 -173.707 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.69 -49.54 62.23 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.27 0.941 . . . . 2.62 108.92 179.272 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 15.3 m -66.67 -38.16 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 115.337 -0.847 . . . . 0.8 109.142 -175.704 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 72.5 m -63.53 -54.37 37.31 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.767 0.827 . . . . 0.97 111.323 175.503 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -80.79 -62.33 1.7 Allowed 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 112.199 0.444 . . . . 2.25 112.199 -164.424 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -80.94 -43.72 19.32 Favored 'General case' 0 C--O 1.226 -0.148 0 O-C-N 122.144 -0.348 . . . . 2.48 110.687 -170.677 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 6.6 mp -81.71 -18.89 0.27 Allowed Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 119.171 3.026 . . . . 2.48 119.171 -161.523 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -52.05 89.56 0.03 OUTLIER 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.396 2.731 . . . . 3.12 114.104 -145.787 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 154.36 -65.06 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 129.656 3.182 . . . . 3.95 106.579 -175.098 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 52.7 tp -49.13 -73.37 0.04 OUTLIER 'General case' 0 C--O 1.235 0.304 0 C-N-CA 123.649 0.78 . . . . 1.07 109.445 -164.801 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.3 mt -74.01 131.85 41.78 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.002 -1.851 . . . . 2.02 106.002 147.029 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.49 168.46 12.55 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 104.333 -2.469 . . . . 6.56 104.333 167.864 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 52' ' ' ASP . . . . . 0.408 ' OD2' ' NZ ' ' B' ' 59' ' ' LYS . 8.8 t0 61.3 84.21 0.14 Allowed 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 124.493 1.12 . . . . 3.56 108.349 -152.599 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 27.3 m -89.13 4.15 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 CA-C-N 114.061 -1.427 . . . . 1.63 109.712 165.649 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.79 -71.48 1.27 Allowed Glycine 0 C--N 1.341 0.854 0 N-CA-C 108.215 -1.954 . . . . 2.35 108.215 -173.55 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 1.5 t -77.01 64.17 2.44 Favored 'General case' 0 CA--C 1.528 0.096 0 C-N-CA 125.518 1.527 . . . . 2.61 107.671 177.583 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -75.25 -27.74 59.59 Favored 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 126.35 1.86 . . . . 0.99 108.845 178.235 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -42.24 -48.84 4.98 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.256 1.822 . . . . 4.33 112.143 170.336 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -45.87 -54.4 8.2 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.369 1.468 . . . . 3.26 110.723 174.872 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 59' ' ' LYS . . . . . 0.455 ' H ' ' HE2' ' B' ' 59' ' ' LYS . 1.6 mppt? -67.93 -55.51 12.48 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 107.363 -1.347 . . . . 3.93 107.363 -177.912 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -40.87 -56.17 2.29 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 125.207 1.403 . . . . 2.02 110.966 -179.973 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -61.27 -42.04 97.96 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 117.8 0.273 . . . . 2.77 111.404 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 21.4 m -59.44 -32.1 69.9 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.065 0.394 . . . . 1.51 112.065 176.871 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 mp -76.65 -57.2 3.99 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.463 0.574 . . . . 2.12 111.076 172.134 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -59.63 -16.19 24.32 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.348 1.859 . . . . 1.74 113.557 -162.397 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.7 m -32.01 -26.33 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 129.848 3.259 . . . . 1.51 119.007 -132.885 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -54.3 -31.32 53.77 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 120.497 1.499 . . . . 2.51 111.314 159.025 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 70.57 68.89 0.2 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.814 1.246 . . . . 2.95 111.077 166.44 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 41.5 p30 -121.14 -7.23 9.4 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.845 1.258 . . . . 1.89 112.497 -177.816 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 18.8 m 72.13 15.48 5.46 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.239 1.415 . . . . 2.14 112.789 -176.567 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -115.76 106.19 13.57 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 127.152 2.181 . . . . 3.94 107.386 164.778 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -83.49 90.12 7.17 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 106.505 -1.665 . . . . 0.98 106.505 167.004 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 31.3 pttt -84.75 174.2 10.08 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.049 0.94 . . . . 4.23 111.37 179.078 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 23.3 p90 -84.67 49.35 1.69 Allowed 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.75 1.019 . . . . 5.51 113.75 -168.424 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -172.03 58.36 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.529 1.531 . . . . 2.95 108.866 116.96 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -87.11 -59.13 2.34 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 106.758 -1.571 . . . . 2.05 106.758 124.182 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 76' ' ' TYR . . . . . 0.428 ' CG ' HD13 ' B' ' 33' ' ' LEU . 53.7 t80 -42.27 -50.94 4.92 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 125.51 1.524 . . . . 3.22 115.044 -168.333 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.444 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 0.0 OUTLIER -45.88 -35.39 4.5 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-O 117.918 -1.039 . . . . 4.64 109.621 -177.835 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 8.0 mmt180 -35.77 -55.26 0.72 Allowed 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 117.66 -1.162 . . . . 3.89 111.087 -178.159 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.4 tp -48.31 -46.98 36.94 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 120.276 1.398 . . . . 0.84 112.203 -177.369 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 64.3 mt -72.87 -39.75 59.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 C-N-CA 125.154 1.382 . . . . 1.87 107.965 -176.965 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -45.93 -53.19 9.08 Favored Glycine 0 N--CA 1.446 -0.638 0 CA-C-O 122.908 1.282 . . . . 2.33 110.864 170.254 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -75.3 -47.77 26.28 Favored 'General case' 0 N--CA 1.438 -1.029 0 C-N-CA 126.734 2.014 . . . . 3.47 107.199 -166.847 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mp -38.85 -47.15 1.38 Allowed 'General case' 0 C--N 1.34 0.171 0 C-N-CA 125.305 1.442 . . . . 2.09 111.138 172.929 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -45.61 -46.16 14.22 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.448 -0.787 . . . . 1.76 111.379 178.548 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.453 0.0 OUTLIER -83.74 -34.72 24.8 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 116.285 1.957 . . . . 2.01 116.285 166.033 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -59.45 -18.92 43.59 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 121.215 1.825 . . . . 3.85 113.052 -176.593 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 6.9 tp -41.51 -51.54 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 O-C-N 121.894 -0.504 . . . . 1.76 110.732 163.468 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -86.22 -48.69 8.33 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.681 1.593 . . . . 4.4 113.441 171.137 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 46.2 tttp -79.94 138.41 37.09 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.476 1.11 . . . . 4.32 111.991 -163.853 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -85.03 -60.65 1.98 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.298 0.639 . . . . 6.46 111.669 176.512 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 31.6 ttmt -172.94 32.68 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.169 1.788 . . . . 8.65 109.242 -177.345 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -92.8 47.0 1.26 Allowed 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 121.024 -1.047 . . . . 5.1 108.801 -160.111 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 93' ' ' LEU . . . . . 0.464 ' CG ' ' H ' ' B' ' 94' ' ' LYS . 0.3 OUTLIER -106.22 -96.24 0.35 Allowed 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 125.65 1.58 . . . . 5.19 109.19 -173.873 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' B' B ' 94' ' ' LYS . . . . . 0.464 ' H ' ' CG ' ' B' ' 93' ' ' LEU . 1.9 mptp? 61.35 -147.35 0.42 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.143 1.377 . . . . 7.14 108.617 -176.76 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 14.1 mt 49.2 68.21 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 C-N-CA 124.773 1.229 . . . . 7.86 111.207 174.591 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 6.0 ppt_? -125.55 132.56 52.55 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 123.806 0.843 . . . . 8.76 108.96 177.725 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 48.0 tttp -178.88 138.92 0.16 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 126.033 1.733 . . . . 7.82 107.133 -178.058 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.22 0 N-CA-C 103.649 -2.723 . . . . 6.8 103.649 147.362 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptt? . . . . . 0 N--CA 1.475 0.797 0 N-CA-C 110.364 -0.236 . . . . 8.5 110.364 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -178.15 170.64 1.78 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 127.695 2.398 . . . . 4.4 105.204 179.665 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.47 69.32 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 128.844 2.858 . . . . 6.61 110.192 179.633 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -114.32 71.64 2.27 Favored Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 126.733 2.013 . . . . 5.73 108.116 178.08 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -72.71 88.34 0.91 Allowed 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 122.814 2.343 . . . . 3.39 110.066 -175.908 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 87.6 mt -64.3 137.02 57.7 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 107.36 -1.348 . . . . 1.42 107.36 170.912 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.9 t -65.47 169.07 6.42 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.403 -0.591 . . . . 1.94 109.403 176.72 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.1 tt0 -59.23 -48.28 82.22 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 121.586 0.708 . . . . 3.7 109.561 -175.896 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.4 mp -57.98 -45.7 86.32 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 118.245 -0.883 . . . . 1.64 110.267 -179.307 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -57.81 -53.33 59.48 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.09 0.956 . . . . 2.12 111.34 174.824 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.84 -49.35 75.69 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 108.827 -0.805 . . . . 5.19 108.827 -176.1 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 70.7 p -68.81 -44.42 73.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.097 -0.501 . . . . 1.33 110.994 -175.141 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.483 HG21 HD12 ' B' ' 83' ' ' LEU 0.257 2.5 pp -63.59 -36.94 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 C-N-CA 118.441 -1.304 . . . . 0.81 109.809 176.797 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -59.04 -50.37 74.35 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.462 1.028 . . . . 3.22 110.187 173.031 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.73 -38.34 78.16 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.366 0.603 . . . . 1.29 111.921 -175.143 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 10.8 m -78.27 -36.98 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 O-C-N 120.54 -1.35 . . . . 0.77 111.012 174.302 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 t -59.01 -41.89 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-N 119.427 1.012 . . . . 0.78 110.481 177.359 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.6 t -65.22 -41.88 93.97 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.015 0.825 . . . . 0.92 110.466 176.604 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 22.4 m -61.98 -47.83 83.05 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.659 0.663 . . . . 0.92 109.907 177.929 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -48.45 -56.77 7.36 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 124.449 1.1 . . . . 3.19 109.883 169.075 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -62.72 -45.44 92.75 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.338 0.655 . . . . 3.95 111.737 -171.467 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.24 -25.88 68.06 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 122.269 -0.269 . . . . 2.23 110.775 179.823 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -80.2 -39.64 28.79 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 118.354 0.524 . . . . 2.57 112.262 164.798 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.94 -37.67 64.1 Favored 'General case' 0 C--O 1.24 0.553 0 O-C-N 120.122 -1.611 . . . . 1.02 110.497 -174.747 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -21.07 66.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.25 1.42 . . . . 4.87 113.302 -179.841 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.0 -66.07 0.45 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 119.849 1.204 . . . . 2.52 111.561 -168.713 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -123.39 151.82 42.19 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 127.148 2.179 . . . . 3.25 109.858 -168.333 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 41.63 62.54 1.89 Allowed Glycine 0 CA--C 1.523 0.589 0 C-N-CA 124.207 0.908 . . . . 2.03 112.941 153.772 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . 0.457 10.7 mpt_? 85.54 112.1 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.558 1.318 . . . . 6.2 114.558 175.757 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -67.14 49.87 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 128.605 2.762 . . . . 3.84 114.522 -177.796 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.86 -54.46 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 108.626 -0.879 . . . . 4.36 108.626 -165.294 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -82.71 131.19 35.21 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 127.403 2.281 . . . . 2.15 107.72 175.907 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -97.97 129.64 44.86 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.297 0.639 . . . . 2.6 109.606 -175.807 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.9 t -82.58 161.86 22.13 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 125.663 1.585 . . . . 2.84 109.603 177.64 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.4 p -57.46 -39.71 70.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 116.212 -0.449 . . . . 2.54 109.927 167.919 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -69.91 -57.14 5.39 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-O 117.823 -1.084 . . . . 1.84 108.977 -178.186 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 63.9 mt-10 -39.0 -49.61 1.72 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 119.07 0.85 . . . . 1.77 112.12 169.91 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -57.71 -52.15 66.63 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 122.011 -0.43 . . . . 2.69 110.723 175.006 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 48.1 tttt -57.23 -38.13 73.3 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.715 -0.616 . . . . 2.5 111.261 -179.959 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -55.43 -34.91 64.86 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.278 0.49 . . . . 2.96 111.376 177.193 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -65.07 -53.78 40.24 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.294 -1.002 . . . . 2.58 108.294 -178.096 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.2 m -66.86 -40.91 86.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-N 115.318 -0.856 . . . . 0.98 109.71 -173.458 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.3 m -60.9 -53.74 53.59 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.288 1.035 . . . . 1.32 110.533 176.001 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 43.2 tt0 -71.11 -48.0 54.79 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 119.188 -0.434 . . . . 2.37 111.282 -170.128 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -154.21 85.85 1.15 Allowed 'General case' 0 C--N 1.34 0.166 0 CA-C-N 118.644 0.656 . . . . 4.97 111.492 177.776 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 tp -157.62 59.02 1.59 Allowed Pre-proline 0 CA--C 1.543 0.696 0 CA-C-N 117.988 0.358 . . . . 1.85 111.602 161.454 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -65.85 -54.61 0.52 Allowed 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 124.103 3.202 . . . . 2.33 113.865 -166.394 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -107.66 41.31 1.54 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 119.295 0.952 . . . . 3.95 110.066 -169.671 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.475 HD23 HD22 ' A' ' 83' ' ' LEU . 1.1 mp -126.31 -98.78 0.4 Allowed 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 106.727 -1.583 . . . . 1.61 106.727 -178.416 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 87.6 mt -90.06 55.99 3.29 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.119 -0.988 . . . . 2.6 109.365 -168.183 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 157.57 14.49 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.658 -0.701 . . . . 4.92 110.925 -179.528 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 84.25 41.57 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 128.045 2.538 . . . . 4.56 110.193 -170.01 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.3 m -72.4 26.29 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 124.389 1.076 . . . . 2.23 113.556 -177.425 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -74.02 -76.85 0.67 Allowed Glycine 0 CA--C 1.522 0.478 0 N-CA-C 105.86 -2.896 . . . . 1.5 105.86 166.475 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 10.7 m -71.19 54.57 0.19 Allowed 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 127.276 2.23 . . . . 2.84 112.114 176.955 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -57.04 -28.54 62.63 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 125.302 1.441 . . . . 1.15 109.866 175.554 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -46.6 -33.43 4.16 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 125.121 1.368 . . . . 4.21 112.565 170.032 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -50.19 -60.88 2.53 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.035 -1.098 . . . . 4.04 108.035 172.884 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.7 -38.81 73.69 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.059 -0.973 . . . . 3.7 109.47 -172.969 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -49.64 -56.79 8.77 Favored 'General case' 0 CA--C 1.528 0.126 0 N-CA-C 109.389 -0.597 . . . . 1.39 109.389 175.04 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -63.42 -36.53 84.05 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 111.549 0.203 . . . . 3.46 111.549 178.945 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.1 m -59.36 -32.53 70.2 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.821 -0.549 . . . . 1.95 112.45 174.063 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 17.7 mt -87.47 -51.67 5.79 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 125.307 1.443 . . . . 1.53 111.679 -175.709 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -75.22 69.42 2.07 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.616 1.167 . . . . 1.52 109.83 -173.695 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 16.4 m -51.36 -42.71 28.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 124.47 1.108 . . . . 1.92 113.711 -168.992 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -84.22 -6.62 59.42 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.273 0.488 . . . . 2.03 112.245 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . 0.306 0.0 OUTLIER 51.25 59.95 4.23 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.646 1.979 . . . . 4.47 113.448 179.365 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.0 p30 -101.6 -9.39 21.0 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.259 1.423 . . . . 1.83 111.44 175.91 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . 0.295 15.7 p 80.9 -0.54 1.8 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 127.751 2.42 . . . . 2.63 114.234 -174.831 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -110.33 124.68 52.11 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.204 1.002 . . . . 3.05 108.345 173.064 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -84.7 97.77 9.84 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 106.071 -1.825 . . . . 0.95 106.071 168.084 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.3 pttt -69.65 162.8 26.95 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.542 1.065 . . . . 6.13 109.32 173.095 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -38.46 -52.61 1.57 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.695 1.198 . . . . 5.29 113.429 -173.051 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.08 -45.49 85.04 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.858 0.463 . . . . 1.5 111.174 -179.212 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -60.0 -45.43 92.77 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.673 -0.492 . . . . 1.89 109.673 178.915 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -66.01 -45.15 82.57 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 118.558 -0.734 . . . . 2.85 110.458 177.581 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.53 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -42.8 -47.13 5.44 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-O 117.133 -1.413 . . . . 5.27 107.239 173.499 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 78' ' ' ARG . . . . . 0.581 ' HB3' HH11 ' A' ' 78' ' ' ARG . 13.4 mtp-105 -39.16 -45.76 1.36 Allowed 'General case' 0 C--O 1.213 -0.829 0 CA-C-O 117.368 -1.301 . . . . 3.58 111.364 -177.422 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.5 tp -45.12 -56.94 4.25 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 120.226 1.375 . . . . 1.1 112.319 174.526 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.7 mp -61.81 -40.69 87.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 C-N-CA 126.949 2.1 . . . . 1.62 107.761 179.636 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -44.98 -54.89 6.66 Favored Glycine 0 CA--C 1.528 0.858 0 N-CA-C 109.761 -1.336 . . . . 2.12 109.761 170.707 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -74.27 -38.9 63.3 Favored 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 127.266 2.226 . . . . 2.7 107.727 -169.193 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.475 HD22 HD23 ' A' ' 49' ' ' LEU . 11.3 mt -52.85 -43.17 65.86 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 119.365 0.984 . . . . 2.21 110.912 178.869 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.49 -25.0 59.09 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.833 0.679 . . . . 1.65 112.833 176.829 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -83.78 -57.15 3.33 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.908 1.683 . . . . 1.56 111.498 168.716 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -57.33 -26.34 60.79 Favored 'General case' 0 N--CA 1.465 0.306 0 O-C-N 120.826 -1.171 . . . . 3.86 112.841 -175.604 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.0 tp -42.5 -33.24 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 C-N-CA 124.626 1.17 . . . . 1.94 112.284 168.913 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.1 -5.7 5.53 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.122 0.969 . . . . 6.15 112.785 174.39 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 26.8 tttp -101.74 7.7 41.78 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.666 1.121 . . . . 3.41 113.424 176.233 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -35.01 -44.3 0.22 Allowed 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 127.167 2.187 . . . . 7.24 116.029 -157.604 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.7 mttt -158.61 57.13 0.44 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.148 0.886 . . . . 11.03 109.02 155.726 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -24.66 -68.79 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 128.089 2.556 . . . . 5.83 111.971 -178.601 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 93' ' ' LEU . . . . . 0.49 ' H ' HD23 ' A' ' 93' ' ' LEU . 2.4 pt? -53.48 -25.01 14.61 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.382 1.473 . . . . 10.27 114.192 -170.019 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -108.23 -59.71 1.82 Allowed 'General case' 0 C--O 1.234 0.278 0 CA-C-N 118.739 0.7 . . . . 12.34 109.776 172.87 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.0 mt -116.62 89.35 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 124.173 0.989 . . . . 10.24 109.604 -166.728 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.33 88.01 1.16 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 108.86 -0.793 . . . . 12.39 108.86 166.959 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -176.42 136.83 0.27 Allowed 'General case' 0 C--O 1.234 0.281 0 C-N-CA 127.67 2.388 . . . . 9.42 104.629 176.58 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.3 ttmm . . . . . 0 C--O 1.253 1.28 0 CA-C-O 117.762 -1.114 . . . . 12.43 108.287 -131.02 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 92.5 mmm . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 112.899 0.703 . . . . 5.9 112.899 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -161.63 -145.15 0.1 Allowed 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 124.802 1.241 . . . . 4.8 107.811 -168.582 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 83.48 108.49 0.06 Allowed 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 116.522 2.045 . . . . 4.71 116.522 127.302 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 111.58 132.81 0.0 OUTLIER Pre-proline 0 N--CA 1.471 0.596 0 C-N-CA 125.042 1.337 . . . . 6.56 111.482 147.6 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -66.69 170.31 12.82 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 124.104 3.202 . . . . 2.53 111.27 -178.752 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -170.34 169.09 7.76 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 118.886 -0.578 . . . . 2.9 110.338 -152.619 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 3.2 t -86.77 -171.88 3.73 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.334 1.054 . . . . 1.92 113.149 -170.397 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -55.16 -67.04 0.31 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.786 1.634 . . . . 2.33 112.837 -170.97 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 20.5 mt -53.13 -42.21 65.82 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.265 -0.897 . . . . 1.42 111.32 176.234 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -57.45 -42.4 82.42 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 119.454 -0.308 . . . . 3.17 110.443 177.415 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.7 -49.58 75.9 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 124.536 1.134 . . . . 4.03 110.148 175.066 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 76.0 p -67.33 -25.88 66.22 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 118.895 -0.574 . . . . 1.55 112.151 -174.58 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.287 2.7 pp -80.32 -32.56 13.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 119.219 0.918 . . . . 1.26 111.268 165.844 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -58.46 -53.42 58.47 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 119.553 1.069 . . . . 2.97 110.808 175.406 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 8.2 t -48.47 -45.13 36.31 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 119.59 1.086 . . . . 1.18 111.557 -174.013 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 33.3 m -69.96 -34.25 59.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 O-C-N 121.113 -0.992 . . . . 0.9 111.577 177.917 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 59.1 t -63.14 -52.32 60.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 118.883 0.765 . . . . 0.94 110.224 173.353 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 8.9 t -60.72 -43.01 98.37 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.547 1.067 . . . . 1.04 110.557 179.009 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 54.9 m -57.72 -49.23 77.22 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.388 -0.82 . . . . 1.09 110.768 174.251 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -48.68 -53.51 18.47 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 121.512 -0.742 . . . . 3.91 110.191 170.209 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -59.32 -47.83 83.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.442 1.097 . . . . 2.54 110.969 -173.331 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -61.55 -47.43 85.58 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 119.876 -0.73 . . . . 2.63 109.909 178.38 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -59.2 -35.16 73.12 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 120.849 -1.157 . . . . 2.87 111.828 173.584 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.11 -34.77 79.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 120.926 -1.109 . . . . 1.02 109.601 -179.875 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -18.53 64.79 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 117.566 -1.207 . . . . 4.05 113.159 -177.86 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.4 ' HB3' ' HG3' ' B' ' 37' ' ' GLU . 0.7 OUTLIER -49.17 -66.73 0.35 Allowed 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 114.113 1.153 . . . . 2.15 114.113 -155.921 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -92.54 -79.69 0.39 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.361 0.875 . . . . 3.3 113.361 -172.762 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.79 170.61 30.89 Favored Glycine 0 C--N 1.34 0.764 0 C-N-CA 128.792 3.091 . . . . 1.88 111.611 160.527 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.9 mmt85 46.69 96.85 0.01 OUTLIER 'General case' 0 C--O 1.241 0.621 0 C-N-CA 124.843 1.257 . . . . 3.56 113.724 146.781 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -76.69 52.88 0.85 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.937 0.895 . . . . 3.56 111.198 173.239 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -147.59 -64.78 0.27 Allowed 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 105.256 -2.128 . . . . 4.09 105.256 179.182 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 26.0 p -78.34 139.38 38.82 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.942 -1.026 . . . . 2.04 109.855 -178.533 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.82 128.42 36.16 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 106.883 -1.525 . . . . 2.61 106.883 159.156 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 6.5 t -82.46 -170.13 2.79 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.37 1.468 . . . . 2.86 108.496 163.707 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 85.1 t -67.03 -98.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 130.183 3.393 . . . . 2.63 101.969 -174.113 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -71.7 77.92 0.84 Allowed 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 121.364 1.893 . . . . 2.68 108.313 178.546 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.4 ' HG3' ' HB3' ' B' ' 26' ' ' GLN . 1.8 tt0 -163.3 -56.84 0.04 OUTLIER 'General case' 0 N--CA 1.444 -0.755 1 C-N-CA 132.155 4.182 . . . . 1.8 102.752 177.849 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -63.36 -52.78 60.29 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.061 -0.972 . . . . 2.09 109.01 170.359 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 9.8 ttmm -55.95 -37.1 68.56 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 119.677 -0.809 . . . . 2.78 110.333 -176.217 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -56.2 -38.03 70.44 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.839 0.681 . . . . 2.76 112.839 175.528 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -62.97 -51.66 65.99 Favored 'General case' 0 C--O 1.231 0.106 0 N-CA-C 108.083 -1.08 . . . . 2.55 108.083 -178.784 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 12.6 m -68.85 -48.66 69.52 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-N 115.861 -0.608 . . . . 0.71 109.726 -172.913 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 47.1 m -53.64 -54.95 30.48 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.991 0.916 . . . . 0.92 110.931 175.662 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -77.18 -56.4 4.6 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 122.362 -0.211 . . . . 1.9 110.745 -168.929 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -80.91 -50.75 9.37 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.552 0.945 . . . . 3.05 113.552 -164.97 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.23 -21.28 0.74 Allowed Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 115.022 1.49 . . . . 2.22 115.022 -157.014 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -62.98 -11.56 25.27 Favored 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 121.59 -2.254 . . . . 1.94 111.467 -74.407 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -107.39 -37.01 6.34 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 125.512 1.525 . . . . 2.49 110.993 -174.884 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 49' ' ' LEU . . . . . 0.452 ' CD2' HD13 ' B' ' 83' ' ' LEU . 28.5 tp -47.39 -46.3 25.96 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 124.313 1.045 . . . . 1.4 111.765 -172.432 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.2 mt -108.27 131.05 55.1 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 105.696 -1.965 . . . . 1.74 105.696 153.641 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -105.37 -175.09 2.69 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 125.609 1.564 . . . . 5.8 109.15 -178.403 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.25 3.7 p30 44.5 47.25 8.32 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 125.227 1.411 . . . . 4.63 110.917 178.731 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -52.85 -14.84 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 C-N-CA 128.082 2.553 . . . . 2.84 113.589 -178.587 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -48.61 -59.58 6.51 Favored Glycine 0 CA--C 1.531 1.063 0 N-CA-C 110.197 -1.161 . . . . 2.35 110.197 162.835 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 23.2 t -73.97 39.49 0.11 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 128.212 2.605 . . . . 2.65 113.15 -169.244 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -67.77 -31.66 71.7 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 125.786 1.634 . . . . 1.09 110.131 -178.393 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -43.75 -52.64 6.45 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.604 1.562 . . . . 4.33 112.602 177.795 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -40.43 87.3 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.625 1.102 . . . . 4.11 111.17 -176.308 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -62.05 -58.99 5.75 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.866 -0.791 . . . . 4.66 108.866 172.12 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -44.48 -50.74 9.29 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 119.112 0.869 . . . . 1.65 111.4 -179.118 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 10.9 tptp -55.3 -46.03 76.24 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.284 1.033 . . . . 4.08 111.333 177.052 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 20.0 m -71.79 -29.06 64.05 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.54 0.736 . . . . 1.44 112.356 179.783 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 65.6 mt -81.3 -57.91 3.28 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.857 1.263 . . . . 1.2 111.212 -175.935 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -57.68 -10.96 1.8 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.797 2.039 . . . . 1.84 115.773 -166.047 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 30.2 m -35.9 -25.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 130.618 3.567 . . . . 1.88 119.173 -130.92 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 21.6 p-10 -61.71 -24.62 66.91 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 120.846 1.657 . . . . 3.34 110.645 169.051 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 65.7 65.07 0.55 Allowed 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.711 2.005 . . . . 4.85 112.047 176.067 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 35.7 p30 -109.48 -8.57 15.0 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.664 1.986 . . . . 2.4 110.542 176.798 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.5 m 63.66 16.24 9.55 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.304 1.041 . . . . 1.88 113.402 -170.384 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -108.62 101.08 10.26 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 105.861 -1.903 . . . . 3.15 105.861 158.377 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.82 94.97 0.34 Allowed 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 105.026 -2.213 . . . . 1.54 105.026 166.482 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 46.5 tptt -83.14 162.42 21.3 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.999 0.519 . . . . 5.36 111.007 -155.009 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -83.11 64.4 7.65 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 109.044 -0.725 . . . . 4.22 109.044 162.413 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -163.97 51.67 0.14 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 115.66 -2.416 . . . . 5.19 113.303 82.397 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 -85.85 -53.06 5.34 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 126.855 2.062 . . . . 2.24 108.213 153.035 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -40.9 -43.2 2.02 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 127.571 2.348 . . . . 3.53 113.077 -169.523 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.512 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 0.0 OUTLIER -39.09 -48.51 1.69 Allowed 'General case' 0 C--N 1.343 0.29 0 O-C-N 124.124 0.89 . . . . 4.54 109.078 178.031 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -38.8 -46.39 1.26 Allowed 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 124.127 0.971 . . . . 4.92 112.948 -168.477 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 5.4 tp -57.59 -46.24 84.27 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.943 1.247 . . . . 0.86 112.966 178.534 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 15.7 mt -66.04 -41.42 89.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 106.95 -1.5 . . . . 2.02 106.95 177.596 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -43.64 -56.6 4.89 Favored Glycine 0 N--CA 1.44 -1.064 0 N-CA-C 108.739 -1.744 . . . . 1.8 108.739 171.806 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -69.32 -61.66 1.7 Allowed 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 125.567 1.547 . . . . 2.2 108.803 -171.881 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.483 HD12 HG21 ' A' ' 13' ' ' ILE . 4.5 pp -53.18 -29.92 34.54 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 111.802 0.297 . . . . 1.95 111.802 -171.79 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -51.12 -48.22 61.8 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.988 1.107 . . . . 1.51 113.988 169.148 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.27 0.0 OUTLIER -77.18 -39.8 47.59 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 119.781 1.173 . . . . 1.77 111.743 172.286 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -55.84 -34.01 65.02 Favored 'General case' 0 C--N 1.339 0.117 0 CA-C-O 118.36 -0.829 . . . . 2.94 112.715 -166.37 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 10.0 tt -42.65 -45.75 1.16 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 118.749 0.704 . . . . 0.93 111.363 173.381 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 63.8 ttt-85 -83.67 -43.78 15.21 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.097 0.959 . . . . 3.9 111.684 172.464 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 45.2 tttt -133.09 71.55 1.47 Allowed 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.682 1.364 . . . . 6.18 114.682 -144.032 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -46.63 -31.15 2.68 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.518 1.673 . . . . 6.01 115.518 179.702 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -87.41 -41.69 13.38 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.79 -1.193 . . . . 9.92 114.174 -161.405 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -84.28 74.78 10.28 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.504 -0.747 . . . . 8.28 110.989 -159.97 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.33 -50.77 1.01 Allowed 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.314 0.857 . . . . 5.6 113.314 176.704 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 43.2 mttp -80.26 77.84 6.98 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.213 -0.929 . . . . 7.76 110.969 -170.055 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 7.8 tp -116.88 141.94 32.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 125.324 1.45 . . . . 8.75 109.879 173.93 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 31.0 ttp-105 -162.48 136.45 6.38 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 107.293 -1.373 . . . . 7.97 107.293 168.68 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -177.3 137.08 0.21 Allowed 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 125.388 1.475 . . . . 8.29 107.199 176.8 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? . . . . . 0 C--O 1.252 1.218 0 CA-C-O 114.958 -2.448 . . . . 9.7 104.789 -165.398 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.9 mtt . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 106.789 -1.56 . . . . 7.83 106.789 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.68 52.67 2.16 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.931 1.241 . . . . 6.58 112.227 -173.684 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 28.1 -40.82 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.576 1 C-N-CA 134.626 5.171 . . . . 4.31 120.688 -175.003 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 166.88 81.01 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.618 0 C-N-CA 125.878 1.671 . . . . 5.47 109.719 -170.919 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.87 142.33 62.37 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.392 1.395 . . . . 2.23 108.662 171.335 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.7 mt -111.6 -173.86 2.34 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.562 0.745 . . . . 1.41 110.086 -169.158 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.2 t -91.09 151.34 21.04 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.331 0.652 . . . . 2.01 110.202 -178.542 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -37.2 -54.52 1.02 Allowed 'General case' 0 C--N 1.339 0.134 0 C-N-CA 125.998 1.719 . . . . 2.13 113.456 -177.353 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.1 mt -63.7 -47.32 81.65 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 117.739 -1.125 . . . . 1.78 110.392 -175.857 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.21 -61.15 2.14 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.713 1.205 . . . . 4.97 110.392 170.044 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -48.7 -51.23 29.7 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.195 0.998 . . . . 3.77 109.318 -178.359 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 81.3 p -62.5 -48.42 79.63 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.626 0.602 . . . . 1.72 112.626 179.783 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' ILE . . . . . 0.456 HG21 HD12 ' B' ' 83' ' ' LEU 0.309 2.7 pp -60.42 -41.66 88.27 Favored 'Isoleucine or valine' 0 C--N 1.344 0.362 0 CA-C-N 119.459 1.027 . . . . 0.96 110.537 179.685 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -60.41 -53.05 62.24 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 119.261 -0.976 . . . . 2.87 109.234 173.962 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -53.62 -36.78 62.38 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.81 0.67 . . . . 1.33 112.81 -174.849 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.3 m -78.52 -45.2 26.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-N 119.311 0.96 . . . . 0.99 111.156 172.8 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 45.5 t -57.47 -40.75 76.39 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.333 0 CA-C-O 118.553 -0.737 . . . . 1.02 110.834 -176.891 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.0 t -59.61 -48.05 83.2 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 119.729 1.15 . . . . 0.95 110.335 176.027 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.7 m -53.19 -59.23 4.81 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 109.005 -0.739 . . . . 1.01 109.005 175.147 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -59.11 -43.52 91.91 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 112.052 0.39 . . . . 7.89 112.052 -176.127 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -61.18 -53.97 50.25 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 125.515 1.526 . . . . 3.69 110.409 -178.605 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 40.0 p -57.3 -50.51 72.69 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.074 -0.713 . . . . 2.35 109.074 177.07 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.89 -47.04 64.75 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-O 121.637 0.732 . . . . 3.17 111.63 176.806 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.65 -17.16 45.71 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 126.55 1.94 . . . . 1.1 111.973 -178.041 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -24.12 67.59 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 117.657 -1.163 . . . . 4.91 111.351 171.598 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -42.61 -62.45 0.98 Allowed 'General case' 0 C--N 1.346 0.431 0 C-N-CA 124.378 1.071 . . . . 2.16 112.082 -174.056 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -122.44 173.17 7.83 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 127.816 2.446 . . . . 2.59 107.606 -177.271 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -22.36 133.33 0.01 OUTLIER Glycine 0 CA--C 1.533 1.201 0 C-N-CA 127.458 2.456 . . . . 1.37 115.348 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.1 mtt85 64.47 103.49 0.03 OUTLIER 'General case' 0 C--O 1.239 0.503 0 C-N-CA 125.319 1.448 . . . . 5.29 111.907 179.509 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.38 58.25 0.39 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.194 1.398 . . . . 5.04 112.015 173.424 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 57.4 p-10 -170.94 -45.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 126.109 1.764 . . . . 3.2 108.61 170.391 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.5 m -84.16 139.87 32.13 Favored 'General case' 0 N--CA 1.444 -0.741 0 C-N-CA 125.152 1.381 . . . . 3.42 109.639 -179.379 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -89.8 175.11 7.36 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.44 1.096 . . . . 1.97 108.563 -178.447 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 35.2 m -153.56 170.13 21.55 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 105.845 -1.909 . . . . 2.99 105.845 179.365 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.3 p -51.63 -57.75 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 119.873 1.215 . . . . 2.31 113.443 -167.001 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -67.03 -47.26 71.97 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.907 -0.405 . . . . 1.7 109.907 -176.419 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -38.62 -51.54 1.64 Allowed 'General case' 0 C--O 1.231 0.12 0 C-N-CA 125.83 1.652 . . . . 1.83 110.863 167.839 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.56 -58.05 10.27 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.431 -0.804 . . . . 3.32 109.665 176.916 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.9 tttm -53.13 -47.45 68.67 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 118.849 -0.596 . . . . 3.1 111.555 -175.106 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -51.36 -41.58 60.72 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.378 0.535 . . . . 2.28 110.986 175.795 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 14.9 tp -64.96 -49.92 68.42 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 119.204 0.911 . . . . 2.69 109.028 -174.876 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 2.3 m -70.31 -46.52 71.09 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 CA-C-O 121.519 0.676 . . . . 1.05 109.215 -173.696 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.4 m -59.6 -49.29 78.33 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.79 0.836 . . . . 1.62 109.941 179.877 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -81.11 -56.13 4.29 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 118.914 -0.565 . . . . 4.16 112.13 -171.527 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.01 39.43 2.55 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.223 0.92 . . . . 5.08 113.44 -173.753 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 tp -150.19 70.83 9.26 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-N 119.273 0.942 . . . . 1.88 110.231 173.062 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.08 -49.38 1.39 Allowed 'Trans proline' 0 N--CA 1.451 -1.017 0 C-N-CA 123.221 2.614 . . . . 1.85 113.084 -165.067 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -120.24 -29.41 4.85 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 118.373 0.533 . . . . 3.05 112.082 -167.27 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' LEU . . . . . 0.463 HD23 HD22 ' A' ' 83' ' ' LEU . 13.6 tp -45.43 -62.98 1.05 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.241 1.017 . . . . 1.3 113.242 -170.065 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.3 mt -84.87 -64.13 1.21 Allowed 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 108.186 -1.042 . . . . 3.48 108.186 174.132 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.5 tptm 68.59 157.65 0.14 Allowed 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 124.656 1.182 . . . . 6.64 111.665 -170.284 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 59.6 t0 50.13 68.69 0.71 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 123.626 1.679 . . . . 4.56 109.145 -147.739 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.7 m -82.64 29.91 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 112.999 -1.91 . . . . 2.2 109.893 160.484 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -101.85 -58.43 0.8 Allowed Glycine 0 C--N 1.341 0.823 0 N-CA-C 108.278 -1.929 . . . . 1.65 108.278 172.834 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.1 t -74.1 57.14 0.63 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.386 1.474 . . . . 2.19 110.682 179.851 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -69.33 -42.53 75.19 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 124.035 0.934 . . . . 1.43 109.528 -175.889 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -39.46 -50.31 2.12 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 126.065 1.746 . . . . 4.25 112.961 -179.096 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -52.88 -52.47 57.36 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.596 0.712 . . . . 3.07 110.291 176.618 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.59 -38.01 83.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.213 0.605 . . . . 3.4 109.549 -177.346 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -55.34 -49.84 71.2 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.506 -0.553 . . . . 1.49 109.506 174.095 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -64.52 -39.01 92.98 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 117.933 0.333 . . . . 3.08 111.353 177.04 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.8 m -58.06 -41.82 84.16 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.768 -0.583 . . . . 2.3 111.072 174.978 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 36.7 mt -70.0 -68.44 0.42 Allowed 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.881 0.872 . . . . 1.98 109.067 178.363 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -77.46 75.83 4.0 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.801 1.24 . . . . 1.79 110.069 -171.775 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.7 m -46.24 -35.96 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 124.718 1.207 . . . . 1.87 113.625 -177.824 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -84.95 -14.62 47.02 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.707 1.203 . . . . 1.93 112.879 -178.214 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 51.89 46.64 26.25 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.028 1.331 . . . . 4.27 110.805 -176.535 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 35.1 p30 -86.38 -18.5 31.68 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.666 0.787 . . . . 1.93 109.909 168.168 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.0 t 71.45 16.06 6.05 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.872 1.669 . . . . 2.78 112.743 -178.886 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -120.84 104.92 10.23 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 105.76 -1.941 . . . . 3.83 105.76 172.397 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -88.07 92.91 9.32 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.221 -1.399 . . . . 1.19 107.221 -174.012 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' LYS . . . . . 0.41 ' NZ ' ' OD1' ' B' ' 92' ' ' ASP . 33.5 tttt -55.13 160.03 2.27 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 108.878 -0.786 . . . . 6.09 108.878 172.385 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -39.77 -57.62 1.51 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.422 1.089 . . . . 5.31 112.777 -178.75 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -60.46 -38.25 83.58 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.087 0.555 . . . . 1.86 112.01 179.08 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -66.77 -50.55 62.34 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.822 -0.436 . . . . 2.14 109.822 -178.024 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -58.88 -43.98 91.03 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 119.818 -0.753 . . . . 6.77 109.628 175.778 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 77' ' ' TRP . . . . . 0.611 ' CZ2' ' CE2' ' B' ' 77' ' ' TRP . 3.8 t-105 -48.5 -34.04 10.53 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 117.714 -1.136 . . . . 3.89 112.019 -177.142 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.7 mtp85 -39.25 -47.49 1.68 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.726 1.148 . . . . 3.88 111.549 174.072 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.1 tp -45.66 -47.45 15.0 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.408 0.683 . . . . 1.08 111.164 179.208 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.8 mp -64.08 -21.37 28.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-O 120.874 0.368 . . . . 1.88 110.265 -169.57 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 81' ' ' GLY . . . . . 0.541 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -76.67 -44.69 14.88 Favored Glycine 0 CA--C 1.496 -1.106 0 N-CA-C 109.012 -1.635 . . . . 1.58 109.012 179.452 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -63.98 -43.23 96.36 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 105.802 -1.925 . . . . 2.64 105.802 -179.53 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 83' ' ' LEU . . . . . 0.463 HD22 HD23 ' A' ' 49' ' ' LEU . 5.5 mt -54.62 -60.28 3.56 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 121.447 -0.783 . . . . 2.78 111.71 171.094 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.7 -27.74 63.2 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.281 1.032 . . . . 1.28 112.46 -176.908 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -80.53 -48.77 12.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.5 1.52 . . . . 1.95 110.054 177.202 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -55.46 -45.67 76.88 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 126.038 1.735 . . . . 2.37 110.694 -179.967 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.0 tt -63.69 0.3 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 N-CA-C 113.271 0.841 . . . . 1.75 113.271 175.661 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.71 -59.54 1.82 Allowed 'General case' 0 C--O 1.236 0.367 0 O-C-N 120.552 -1.343 . . . . 7.76 109.821 162.975 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.71 -44.15 64.66 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 114.339 1.237 . . . . 3.36 114.339 -168.812 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 12.2 ttpt -68.01 -18.29 64.67 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 118.597 0.635 . . . . 8.01 112.368 -159.689 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? -72.34 -74.44 0.16 Allowed 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 126.907 2.083 . . . . 11.67 111.544 -172.024 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -82.93 65.98 8.33 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.568 0.747 . . . . 8.35 110.876 -157.321 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -139.06 -48.3 0.49 Allowed 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.806 0.843 . . . . 7.62 110.8 168.436 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.39 45.1 0.37 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.464 0.65 . . . . 10.62 111.885 176.076 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -154.7 155.97 5.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 104.697 -2.335 . . . . 10.75 104.697 166.144 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -44.06 -72.67 0.05 Allowed 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 113.504 0.927 . . . . 15.62 113.504 -160.847 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 174.91 53.49 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 126.434 1.894 . . . . 9.74 108.942 -177.015 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 95.9 mttt . . . . . 0 C--O 1.251 1.183 0 C-N-CA 127.899 2.48 . . . . 12.66 105.852 -142.927 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 27.6 mmm . . . . . 0 C--O 1.236 0.383 0 CA-C-O 117.825 -1.083 . . . . 8.12 109.767 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.329 . . -142.18 -174.82 4.21 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 130.944 3.698 . . . . 5.51 108.918 -171.387 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 88.73 87.12 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 127.419 2.288 . . . . 6.59 114.785 165.783 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -179.76 161.68 0.9 Allowed Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 129.061 2.944 . . . . 6.64 108.521 152.608 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -87.9 173.5 5.04 Favored 'Trans proline' 0 CA--C 1.535 0.525 0 C-N-CA 123.98 3.12 . . . . 2.71 111.391 -173.805 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -169.14 176.58 5.2 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.24 1.416 . . . . 2.44 109.088 -176.007 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 13.7 t -79.57 -176.62 5.4 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.875 0.87 . . . . 2.22 111.828 -166.706 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -62.98 -67.58 0.41 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.491 0.716 . . . . 3.27 112.26 -165.278 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 18.6 mt -50.07 -45.46 52.49 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.03 -1.044 . . . . 1.16 111.244 176.139 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -56.93 -37.46 71.52 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.252 1.021 . . . . 3.69 111.686 177.123 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.72 -44.21 51.09 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.195 0.998 . . . . 4.19 109.241 179.521 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 25.7 t -57.39 -46.95 82.89 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.272 0.629 . . . . 1.7 110.07 -179.031 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.275 2.7 pp -65.98 -18.93 24.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 O-C-N 121.172 -0.955 . . . . 1.78 112.282 174.505 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.38 -56.17 5.16 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.751 1.16 . . . . 3.17 110.639 167.496 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.1 t -47.48 -43.91 24.83 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.051 1.296 . . . . 1.38 111.422 -169.836 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 15.4 m -69.36 -37.93 76.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 O-C-N 121.562 -0.711 . . . . 1.05 112.128 178.032 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.65 -42.36 95.76 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.133 0.973 . . . . 1.32 109.585 175.011 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 18' ' ' THR . . . . . . . . . . . . 0.269 9.8 t -68.26 -36.9 80.14 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 120.774 -1.204 . . . . 1.35 111.358 174.69 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.0 m -53.59 -57.52 10.45 Favored 'General case' 0 C--N 1.345 0.382 0 CA-C-N 120.705 1.593 . . . . 1.4 109.248 169.632 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -41.59 -55.54 2.87 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.269 1.028 . . . . 4.26 110.539 172.503 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -58.28 -53.21 60.81 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.251 1.02 . . . . 2.38 111.1 -174.624 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 40.3 p -56.1 -52.9 62.63 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.729 0.411 . . . . 2.31 110.893 -178.955 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -61.47 -47.8 84.01 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 118.042 0.383 . . . . 2.87 110.632 177.699 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.19 -29.55 61.04 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 126.221 1.809 . . . . 0.99 111.271 -176.176 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.16 -15.67 47.7 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 117.951 -1.023 . . . . 3.46 113.038 176.524 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 26' ' ' GLN . . . . . 0.412 ' CB ' ' HG2' ' B' ' 37' ' ' GLU . 1.1 tp-100 -58.13 -65.13 0.69 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 116.131 1.9 . . . . 1.98 116.131 -166.801 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -88.02 -77.88 0.34 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.371 0.532 . . . . 2.98 112.205 -163.199 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.39 164.9 25.94 Favored Glycine 0 C--N 1.339 0.728 0 C-N-CA 128.048 2.737 . . . . 1.83 110.609 150.805 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 17.9 mmt85 53.47 98.96 0.01 OUTLIER 'General case' 0 C--O 1.24 0.591 0 N-CA-C 115.326 1.602 . . . . 3.55 115.326 135.565 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -72.82 60.68 0.52 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.018 1.727 . . . . 3.33 112.261 178.615 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -164.25 -61.24 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 106.716 -1.587 . . . . 4.02 106.716 -171.406 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 87.6 p -58.88 138.94 57.09 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 118.008 -0.996 . . . . 2.32 109.938 168.774 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 6.5 mp -102.08 101.45 11.81 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.248 -1.019 . . . . 2.44 108.248 152.353 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 1.4 p -84.25 176.11 8.96 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.684 1.194 . . . . 2.51 108.521 168.841 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 7.8 p -91.6 50.94 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 O-C-N 120.516 -1.365 . . . . 2.55 111.492 -170.523 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -156.37 52.78 0.54 Allowed 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 106.376 -1.712 . . . . 2.64 106.376 149.254 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 37' ' ' GLU . . . . . 0.412 ' HG2' ' CB ' ' B' ' 26' ' ' GLN . 91.8 mt-10 -158.68 -54.83 0.07 Allowed 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 130.915 3.686 . . . . 1.72 104.046 -178.099 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -62.63 -57.64 10.34 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.801 -1.09 . . . . 2.14 109.105 173.683 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -59.13 -41.52 88.42 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 110.061 -0.348 . . . . 2.76 110.061 -175.334 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -47.88 -41.94 25.55 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.621 0.6 . . . . 3.54 112.621 170.549 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 tp -63.24 -52.4 62.29 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 119.115 0.871 . . . . 1.94 108.807 -175.018 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -68.51 -48.52 71.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.436 -0.802 . . . . 0.63 109.242 -173.307 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 68.2 m -56.67 -54.87 41.09 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 123.909 0.884 . . . . 0.87 111.178 177.34 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -80.68 -59.38 2.7 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 117.792 0.269 . . . . 2.48 111.627 -170.375 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -81.3 -48.51 11.9 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 112.404 0.52 . . . . 3.11 112.404 -160.075 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mp -64.77 -24.43 1.21 Allowed Pre-proline 0 CA--C 1.534 0.361 0 N-CA-C 113.727 1.01 . . . . 2.37 113.727 -164.178 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.79 -10.72 18.0 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.027 -2.072 . . . . 1.64 112.365 -82.837 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 70.1 t60 -95.98 -34.95 11.59 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.02 1.328 . . . . 2.52 111.15 179.761 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 33.5 tp -55.08 -66.6 0.38 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-N 119.014 0.824 . . . . 1.03 110.313 -169.078 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 80.3 mt -92.14 156.33 17.42 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 105.984 -1.858 . . . . 2.06 105.984 152.186 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.45 -166.19 2.35 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 106.42 -1.696 . . . . 6.06 106.42 -170.945 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 57.53 33.38 23.19 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 122.651 1.215 . . . . 4.7 109.456 -177.356 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 21.1 m -56.71 -29.98 31.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 125.756 1.622 . . . . 1.99 111.328 -166.564 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -41.78 -46.38 4.87 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 123.688 0.661 . . . . 2.93 111.737 172.869 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 2.4 t -93.7 19.72 8.35 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.626 0.77 . . . . 2.68 112.48 -174.389 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -42.65 -41.65 3.18 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 124.313 1.045 . . . . 1.07 111.201 178.693 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -34.58 -44.54 0.21 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.05 2.14 . . . . 4.22 113.722 173.569 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -65.11 -43.16 92.91 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.001 -1.062 . . . . 3.67 110.844 178.074 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? -65.67 -44.94 84.75 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 118.539 -0.743 . . . . 4.23 109.283 177.431 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -47.15 -53.55 12.71 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 119.196 0.907 . . . . 1.89 109.651 170.628 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -61.38 -39.26 90.0 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 122.182 -0.324 . . . . 3.63 111.568 -178.531 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 32.4 t -61.52 -41.96 98.1 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.846 0.859 . . . . 1.56 111.754 173.852 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 33.9 mt -77.94 -53.52 7.36 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 124.305 1.042 . . . . 1.51 110.254 -171.606 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.256 17.9 t0 -59.41 -8.88 1.98 Allowed 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 127.011 2.124 . . . . 1.42 116.535 -164.09 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.0 m -33.76 -19.26 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 C-N-CA 131.111 3.764 . . . . 1.45 119.414 -131.66 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -58.39 -28.2 64.96 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 120.962 1.71 . . . . 3.01 111.321 158.083 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 59.42 62.34 1.8 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.427 1.491 . . . . 3.91 110.991 175.401 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -103.18 -15.34 16.05 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.202 1.801 . . . . 1.96 111.591 175.21 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 11.8 m 73.79 21.92 2.62 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.783 1.633 . . . . 2.04 113.464 -175.254 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -129.52 109.7 11.25 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 125.36 1.464 . . . . 3.5 107.592 162.135 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -77.77 106.38 9.56 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.847 -1.168 . . . . 1.05 107.847 176.931 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 12.0 ptmt -85.54 -178.46 6.68 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 126.551 1.94 . . . . 3.9 112.115 -174.803 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -75.65 82.55 2.65 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 124.591 1.156 . . . . 3.83 108.284 -172.539 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 96.53 47.79 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.314 1 C-N-CA 133.554 4.742 . . . . 2.25 108.295 178.088 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -89.63 -60.93 1.81 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 107.934 -1.136 . . . . 1.94 107.934 120.467 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -38.71 -53.67 1.63 Allowed 'General case' 0 C--N 1.344 0.358 0 C-N-CA 127.049 2.14 . . . . 3.45 111.529 -174.172 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 77' ' ' TRP . . . . . 0.611 ' CE2' ' CZ2' ' A' ' 77' ' ' TRP . 43.0 t90 -43.4 -38.42 2.75 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 125.989 1.716 . . . . 4.1 112.42 -171.292 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -38.85 -48.66 1.57 Allowed 'General case' 0 C--N 1.342 0.25 0 C-N-CA 123.866 0.866 . . . . 5.23 111.746 174.988 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 6.0 tp -52.12 -48.05 65.01 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.033 0.533 . . . . 0.89 111.504 -177.271 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 64.5 mt -62.16 -30.68 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 N-CA-C 107.529 -1.285 . . . . 1.37 107.529 -178.255 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 81' ' ' GLY . . . . . 0.577 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -69.33 -52.94 19.75 Favored Glycine 0 CA--C 1.496 -1.154 0 C-N-CA 124.894 1.235 . . . . 1.29 111.392 179.965 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -50.54 -63.22 1.19 Allowed 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 107.192 -1.41 . . . . 3.37 107.192 174.047 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 83' ' ' LEU . . . . . 0.456 HD12 HG21 ' A' ' 13' ' ' ILE 0.289 4.5 pp -58.98 -34.05 71.38 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.941 0.719 . . . . 1.94 112.941 -173.645 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.91 -38.62 73.1 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 118.265 -0.874 . . . . 1.17 111.966 174.939 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.315 0.0 OUTLIER -80.39 -41.12 25.2 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-O 116.101 -1.904 . . . . 3.39 112.189 166.451 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -45.62 -36.05 4.5 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 121.331 1.878 . . . . 2.62 112.914 -169.862 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 10.5 tt -44.05 -50.85 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 CA-C-N 118.316 0.507 . . . . 0.96 111.969 171.914 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.44 -50.18 8.0 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.861 2.464 . . . . 4.14 112.613 175.133 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 10.5 tttm -63.49 131.21 47.41 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.04 1.736 . . . . 5.96 112.313 -168.68 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -81.68 -60.93 2.08 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 109.979 -0.378 . . . . 4.87 109.979 161.0 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -152.8 36.62 0.5 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.147 0.795 . . . . 6.62 113.147 178.459 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 92' ' ' ASP . . . . . 0.41 ' OD1' ' NZ ' ' A' ' 72' ' ' LYS . 36.2 t70 -66.79 77.08 0.12 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.973 0.909 . . . . 6.95 111.705 172.036 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 20.6 tp -150.38 -81.08 0.11 Allowed 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 106.927 -1.508 . . . . 5.1 106.927 168.008 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 154.77 174.64 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 130.317 3.447 . . . . 7.22 106.552 -177.536 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 5.5 tp -151.87 68.86 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 121.656 0.741 . . . . 8.74 109.631 -179.565 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 5.0 ttt-85 -170.09 174.76 5.31 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.316 0.646 . . . . 9.86 110.207 173.978 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -178.21 140.82 0.23 Allowed 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 129.614 3.166 . . . . 9.62 105.078 177.893 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt . . . . . 0 C--O 1.254 1.296 0 N-CA-C 103.955 -2.609 . . . . 10.28 103.955 151.907 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 . . . . . 0 N--CA 1.444 -0.756 0 CA-C-O 119.593 -0.242 . . . . 4.2999999999999998 110.457 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -71.62 106.99 2.08 Favored 'Trans proline' 0 N--CA 1.453 -0.902 0 C-N-CA 122.829 2.353 . . . . 2.21 110.757 -174.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.5 mt -66.27 162.75 19.43 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.584 1.154 . . . . 1.24 110.089 172.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 t -76.31 170.1 16.98 Favored 'General case' 0 C--O 1.226 -0.135 0 O-C-N 121.554 -0.717 . . . . 1.72 109.89 -178.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -59.56 -50.21 74.79 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.477 0.711 . . . . 2.0 109.635 -174.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.451 HD12 ' HG2' ' B' ' 45' ' ' GLN . 3.7 mt -62.09 -53.39 56.18 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.55 -1.214 . . . . 1.5600000000000001 111.696 176.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -47.33 -55.66 8.34 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.163 1.385 . . . . 2.2799999999999998 110.785 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -49.71 -60.16 3.15 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.435 1.494 . . . . 3.9399999999999999 109.616 173.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.4 p -57.05 -40.5 76.91 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.403 -0.811 . . . . 1.6599999999999999 112.239 -175.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.295 2.8 pp -69.59 -42.2 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 O-C-N 121.819 -0.55 . . . . 0.57999999999999996 110.248 177.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -58.66 -47.65 83.73 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 118.997 0.817 . . . . 3.4700000000000002 109.804 177.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.9 m -46.03 -45.77 16.18 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.582 1.553 . . . . 1.8400000000000001 112.745 174.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 32.6 m -79.89 -35.78 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 O-C-N 120.376 -1.453 . . . . 0.72999999999999998 110.993 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 49.2 t -58.47 -44.23 88.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 118.779 0.718 . . . . 0.56999999999999995 110.415 176.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.8 t -63.05 -46.53 87.1 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.02 0.827 . . . . 0.62 110.058 177.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 16.2 m -59.33 -49.48 77.65 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.293 0.497 . . . . 0.67000000000000004 109.774 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -46.73 -52.07 14.77 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 124.146 0.978 . . . . 3.52 110.043 168.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -57.75 -50.18 74.08 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 118.566 0.621 . . . . 3.3900000000000001 110.21 -174.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -55.79 -58.53 7.46 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 122.14 -0.35 . . . . 2.4900000000000002 110.798 174.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -62.98 -23.23 67.33 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 112.377 0.51 . . . . 2.6600000000000001 112.377 -177.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.46 -26.58 38.23 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 120.996 -1.065 . . . . 0.81000000000000005 110.338 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 71.4 ttp85 -80.43 -25.73 38.8 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.888 0.875 . . . . 4.3700000000000001 112.317 -177.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -39.06 -60.59 0.85 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.12 1.368 . . . . 2.2999999999999998 112.974 -178.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -118.84 167.5 11.64 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 127.447 2.299 . . . . 2.3700000000000001 106.354 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 0.74 108.73 0.01 OUTLIER Glycine 0 CA--C 1.536 1.383 0 C-N-CA 127.021 2.248 . . . . 1.3100000000000001 115.636 171.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 66.13 103.25 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.928 1.455 . . . . 4.6500000000000004 114.928 165.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.5 pttt -62.92 64.71 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.816 2.047 . . . . 4.0099999999999998 110.973 166.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -177.2 -30.08 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.066 2.146 . . . . 3.6099999999999999 110.599 -158.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 34.1 t -134.83 148.69 50.23 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 121.307 -0.871 . . . . 3.0800000000000001 111.964 166.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -83.99 120.04 25.64 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 125.501 1.521 . . . . 1.9399999999999999 107.473 165.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.4 m -84.48 169.6 14.34 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.599 1.56 . . . . 3.04 108.176 166.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.21 -43.64 91.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 O-C-N 120.854 -1.154 . . . . 2.0099999999999998 112.215 -170.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -64.63 -51.45 62.54 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 108.989 -0.745 . . . . 2.2000000000000002 108.989 -178.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -37.97 -54.31 1.31 Allowed 'General case' 0 C--O 1.232 0.136 0 C-N-CA 124.965 1.306 . . . . 1.8500000000000001 112.139 166.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.21 -51.96 67.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 122.009 -0.432 . . . . 3.0499999999999998 109.849 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt -55.46 -39.55 70.49 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 122.069 -0.394 . . . . 3.71 110.927 -179.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -55.42 -40.14 71.1 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.609 0.64 . . . . 2.5600000000000001 111.851 173.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -62.88 -51.17 68.03 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 119.52 1.055 . . . . 2.6000000000000001 108.664 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -69.01 -38.75 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 CA-C-N 115.991 -0.55 . . . . 1.0600000000000001 110.169 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 78.0 m -63.15 -42.76 99.51 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.666 0.786 . . . . 1.3400000000000001 111.224 175.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -79.84 -53.81 6.42 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 119.283 -0.389 . . . . 2.1400000000000001 110.308 -168.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -98.0 -127.64 0.16 Allowed 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 109.858 -0.423 . . . . 3.6699999999999999 109.858 171.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.487 ' H ' HD22 ' A' ' 46' ' ' LEU . 3.2 mm? 29.7 59.56 0.84 Allowed Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 127.268 2.227 . . . . 2.1699999999999999 114.374 -173.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.31 -42.54 3.77 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 122.488 2.125 . . . . 1.74 111.864 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -122.96 -20.6 5.75 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 113.618 0.97 . . . . 3.1000000000000001 113.618 -170.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.971 HD23 ' HG ' ' A' ' 83' ' ' LEU . 2.0 mp -64.84 -97.2 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 118.898 0.772 . . . . 1.4199999999999999 111.212 172.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 75.5 mt -88.74 71.66 8.71 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 120.87 -1.144 . . . . 2.27 109.31 -163.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.5 ttmm -56.06 156.03 5.84 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.155 -0.93 . . . . 6.0099999999999998 110.845 170.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.0 t0 57.0 66.06 1.25 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 123.496 1.617 . . . . 4.8200000000000003 109.987 -157.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.4 m -68.19 -3.3 2.36 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 112.851 -1.977 . . . . 2.0 111.616 162.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -75.4 -55.93 4.89 Favored Glycine 0 C--N 1.343 0.948 0 N-CA-C 108.136 -1.986 . . . . 1.75 108.136 176.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.5 t -74.08 52.06 0.43 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.158 1.383 . . . . 2.1000000000000001 110.61 173.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -72.09 -45.57 60.14 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 125.015 1.326 . . . . 1.2 108.339 170.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.79 -38.14 74.95 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.561 1.144 . . . . 4.7199999999999998 110.248 -164.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -54.07 -55.06 31.06 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.415 1.086 . . . . 3.1600000000000001 111.669 167.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -51.36 68.57 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 107.653 -1.24 . . . . 2.9199999999999999 107.653 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -46.94 -53.74 11.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.441 0.696 . . . . 1.49 110.698 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -59.56 -26.26 65.23 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.91 0.707 . . . . 3.23 112.91 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.2 m -79.76 -48.59 13.35 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.951 0.9 . . . . 2.2999999999999998 111.466 178.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.4 mp -62.19 -48.82 78.33 Favored 'General case' 0 C--N 1.341 0.209 0 N-CA-C 109.381 -0.6 . . . . 1.6000000000000001 109.381 177.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -74.33 73.07 1.83 Allowed 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 107.84 -1.17 . . . . 1.8999999999999999 107.84 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 20.9 m -49.47 -30.34 4.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.484 1.113 . . . . 1.79 113.09 -173.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -87.33 -21.21 25.85 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.837 1.655 . . . . 2.54 112.645 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 55.16 50.88 14.24 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.509 1.124 . . . . 3.9199999999999999 109.338 -176.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 34.1 p30 -94.09 -18.05 22.2 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.953 1.701 . . . . 1.9399999999999999 110.612 172.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.9 m 70.4 17.21 6.98 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.371 1.468 . . . . 1.79 113.453 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -107.21 107.75 18.85 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 104.094 -2.558 . . . . 3.79 104.094 155.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.57 96.74 8.17 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 103.455 -2.794 . . . . 1.03 103.455 171.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.59 162.18 16.07 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.909 -1.145 . . . . 5.1699999999999999 107.909 176.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -39.58 -52.49 2.19 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 123.578 0.751 . . . . 6.6399999999999997 111.628 176.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -66.81 -27.58 67.67 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 113.496 0.924 . . . . 2.6200000000000001 113.496 -176.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -79.73 -56.44 4.28 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.628 -1.249 . . . . 2.02 107.628 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -45.5 -50.48 12.74 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.42 1.088 . . . . 3.2599999999999998 111.209 173.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.595 ' CH2' ' CH2' ' B' ' 77' ' ' TRP . 2.5 t-105 -39.78 -41.1 1.06 Allowed 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.426 1.89 . . . . 4.1299999999999999 111.77 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 21.7 mmt180 -39.86 -48.12 2.25 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 123.651 0.781 . . . . 4.4299999999999997 111.599 176.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.2 tp -48.64 -46.18 39.61 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.681 0.793 . . . . 0.88 110.405 -178.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 66.8 mt -63.46 -29.36 47.05 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 107.913 -1.143 . . . . 1.6200000000000001 107.913 -172.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.488 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -69.98 -45.37 57.34 Favored Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 109.743 -1.343 . . . . 1.54 109.743 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -68.42 -48.19 65.27 Favored 'General case' 0 N--CA 1.437 -1.096 0 N-CA-C 106.667 -1.605 . . . . 2.5 106.667 -175.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.971 ' HG ' HD23 ' A' ' 49' ' ' LEU . 4.3 mp -42.04 -58.92 1.92 Allowed 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 118.613 0.642 . . . . 2.3700000000000001 110.945 166.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.99 -19.73 53.96 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 113.133 0.79 . . . . 1.2 113.133 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -80.45 -52.74 7.29 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.757 1.623 . . . . 1.6100000000000001 109.761 174.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -58.43 -29.15 65.9 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 127.305 2.242 . . . . 2.6299999999999999 110.962 -171.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.0 tp -40.59 -38.2 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 124.534 1.134 . . . . 1.6200000000000001 111.766 168.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.23 -43.73 3.05 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.462 1.105 . . . . 5.1600000000000001 111.371 177.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 49.0 tttp . . . . . 0 C--O 1.223 -0.341 0 C-N-CA 123.765 0.826 . . . . 3.5299999999999998 110.414 177.828 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.526 ' HB3' ' HB3' ' B' ' 10' ' ' GLU . 1.7 mt . . . . . 0 CA--C 1.55 0.952 0 N-CA-C 113.884 1.068 . . . . 2.1899999999999999 113.884 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 4.2 t -89.05 -163.72 1.03 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.316 1.446 . . . . 1.6299999999999999 113.464 173.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -65.14 -67.29 0.45 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.98 2.112 . . . . 2.1000000000000001 113.057 -172.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 16.3 mt -57.16 -41.46 79.25 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 120.622 -1.299 . . . . 1.05 109.976 178.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . 0.62 ' HG2' HD22 ' A' ' 49' ' ' LEU . 99.2 mt-10 -49.77 -42.97 47.8 Favored 'General case' 0 CA--C 1.563 1.473 0 C-N-CA 123.794 0.838 . . . . 3.1499999999999999 112.512 167.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -61.05 -46.98 88.5 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 119.677 -1.889 . . . . 3.8799999999999999 110.124 172.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 54.1 p -61.23 -36.96 81.36 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.613 -0.68 . . . . 1.8999999999999999 111.121 -175.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.283 2.9 pp -68.63 -43.05 83.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 O-C-N 121.587 -0.696 . . . . 1.04 110.476 171.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.07 -43.55 82.23 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.263 0.938 . . . . 4.2999999999999998 110.845 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.38 -28.77 68.89 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.1 0.56 . . . . 1.4199999999999999 111.735 -174.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 34.3 m -81.35 -36.84 15.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 O-C-N 120.888 -1.132 . . . . 0.93000000000000005 111.276 168.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 39.5 t -56.89 -43.92 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 118.731 0.696 . . . . 1.3 110.688 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.6 t -59.49 -50.53 73.58 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.59 0.632 . . . . 1.6499999999999999 110.268 176.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.9 m -53.83 -55.03 30.31 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.395 -0.816 . . . . 1.05 110.351 177.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -42.84 -56.7 3.12 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 123.929 0.891 . . . . 4.4199999999999999 110.3 171.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -57.01 -52.15 66.42 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.791 0.436 . . . . 3.6200000000000001 110.996 -177.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 75.7 p -56.64 -32.9 65.79 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.334 0.494 . . . . 2.6200000000000001 112.334 -177.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -81.1 -47.2 13.84 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 118.844 0.747 . . . . 2.71 111.534 171.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.32 -40.89 68.41 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 120.769 -1.207 . . . . 1.02 109.854 -175.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -17.19 64.57 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 117.234 -1.365 . . . . 4.75 113.097 -175.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -47.75 -60.87 2.26 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.987 1.267 . . . . 2.2200000000000002 114.262 -168.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -79.54 -35.38 39.98 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 118.65 2.833 . . . . 3.2799999999999998 118.65 -158.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -81.6 -92.94 0.52 Allowed Glycine 0 C--N 1.34 0.766 1 C-N-CA 131.448 4.356 . . . . 3.1299999999999999 114.308 7.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.1 mmt-85 49.15 73.12 0.25 Allowed 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.876 -1.157 . . . . 5.5099999999999998 107.876 -153.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -78.89 49.78 0.95 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.962 1.705 . . . . 3.71 110.949 -175.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -161.03 -48.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 126.73 2.012 . . . . 4.2300000000000004 107.448 -168.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 29.8 m -116.35 140.21 49.58 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 124.676 1.19 . . . . 3.0499999999999998 110.956 -174.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 6.3 mp -93.59 120.68 34.17 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.711 1.204 . . . . 2.3599999999999999 109.249 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 7.1 m -83.38 171.55 13.38 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.399 -0.963 . . . . 2.4100000000000001 108.399 173.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 7.1 p -85.37 51.5 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 120.098 -1.626 . . . . 2.6699999999999999 110.507 177.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -158.53 57.25 0.45 Allowed 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 106.124 -1.806 . . . . 2.0600000000000001 106.124 157.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -176.29 -57.6 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 102.024 -3.324 . . . . 1.5800000000000001 102.024 -167.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -62.91 -60.73 3.07 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.914 -1.039 . . . . 2.1800000000000002 110.479 171.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -58.78 -39.17 80.28 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.984 -0.376 . . . . 3.5099999999999998 109.984 -176.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -54.39 -34.3 60.96 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.862 -0.59 . . . . 2.5600000000000001 112.428 175.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 30.8 tp -67.44 -45.77 75.05 Favored 'General case' 0 C--N 1.338 0.092 0 CA-C-N 119.754 1.161 . . . . 1.9199999999999999 109.045 -177.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . 0.557 ' HA ' HD23 ' B' ' 46' ' ' LEU . 5.6 m -68.67 -45.49 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 N-CA-C 110.009 -0.367 . . . . 0.98999999999999999 110.009 -177.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 97.7 m -55.56 -51.15 68.03 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.431 0.692 . . . . 1.0900000000000001 111.111 174.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -80.04 -57.49 3.61 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.094 0.558 . . . . 2.1299999999999999 111.641 -168.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . 0.451 ' HG2' HD12 ' A' ' 9' ' ' LEU . 34.9 tp60 -80.23 -54.21 5.95 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 112.817 0.673 . . . . 3.8399999999999999 112.817 -158.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . 0.557 HD23 ' HA ' ' B' ' 42' ' ' VAL 0.269 1.0 OUTLIER -39.37 -49.57 4.81 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 116.053 1.872 . . . . 2.4500000000000002 116.053 -136.425 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -84.34 -28.17 1.21 Allowed 'Trans proline' 0 N--CA 1.448 -1.19 0 CA-C-N 120.672 1.276 . . . . 2.71 108.871 -36.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -100.82 -37.4 8.71 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 125.291 1.437 . . . . 2.5600000000000001 110.047 -171.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.438 HD23 ' HB2' ' B' ' 83' ' ' LEU . 43.9 tp -35.31 -58.95 0.55 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.99 1.716 . . . . 2.04 115.235 -171.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.89 -175.24 3.12 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.408 -0.96 . . . . 2.71 108.408 168.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.57 169.88 20.47 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 124.97 1.308 . . . . 5.7400000000000002 108.04 -163.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 11.7 t0 58.9 67.1 0.96 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 123.443 1.592 . . . . 4.2400000000000002 109.11 -171.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 16.1 m -83.54 -12.1 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 112.213 -2.267 . . . . 1.79 109.897 164.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -64.96 -61.86 5.46 Favored Glycine 0 C--N 1.34 0.803 0 N-CA-C 108.884 -1.686 . . . . 2.4199999999999999 108.884 176.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 35.5 t -78.3 57.28 1.86 Allowed 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.943 -1.132 . . . . 2.8199999999999998 107.943 173.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.419 HD23 HG21 ' B' ' 42' ' ' VAL . 2.8 tm? -60.93 -44.29 97.43 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 119.67 -1.894 . . . . 1.0800000000000001 108.116 173.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -65.03 -24.02 67.37 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.256 1.022 . . . . 4.3200000000000003 112.25 -166.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -50.95 -60.12 3.42 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.647 1.179 . . . . 2.3500000000000001 109.585 161.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.47 -51.59 68.82 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.106 -1.072 . . . . 4.0099999999999998 108.106 177.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.42 -60.47 1.93 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.303 0.956 . . . . 1.6699999999999999 110.618 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -61.66 -36.38 80.65 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 122.377 -0.202 . . . . 3.1600000000000001 110.935 -175.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 18.5 m -66.24 -32.48 73.92 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.4 0.518 . . . . 2.2799999999999998 112.4 175.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 22.0 mt -80.65 -43.8 19.86 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.789 1.236 . . . . 1.54 111.158 -177.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -66.45 -7.15 17.63 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 129.905 3.282 . . . . 1.5900000000000001 116.787 -166.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 17.1 m -36.95 -19.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 128.629 2.771 . . . . 1.99 117.844 -160.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -69.12 -1.3 7.4 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 120.689 1.586 . . . . 4.0099999999999998 112.043 170.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 82.43 -29.56 0.1 Allowed 'General case' 0 C--N 1.342 0.241 0 C-N-CA 127.613 2.365 . . . . 4.5999999999999996 113.284 161.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -50.8 109.16 0.29 Allowed 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.421 -0.955 . . . . 3.3100000000000001 108.421 160.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 41.0 p -66.85 66.93 0.06 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.31 1.844 . . . . 2.75 111.469 -179.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -167.03 120.28 0.98 Allowed 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 128.472 2.709 . . . . 3.0 104.828 -167.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -87.55 97.9 11.1 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 107.514 -1.291 . . . . 1.1299999999999999 107.514 -175.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 4.0 tttt -80.25 167.74 19.92 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 122.949 0.5 . . . . 4.0999999999999996 109.691 -165.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -83.15 54.6 2.83 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.536 -0.727 . . . . 4.7999999999999998 110.065 175.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -167.37 50.73 0.06 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.879 1.271 . . . . 2.2000000000000002 107.713 111.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -93.21 -60.69 1.73 Allowed 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.286 -2.133 . . . . 1.8500000000000001 108.34 140.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.467 ' CZ ' HD11 ' B' ' 80' ' ' ILE . 1.3 t80 -41.37 -50.45 3.79 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 126.135 1.774 . . . . 3.4399999999999999 111.53 -173.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.595 ' CH2' ' CH2' ' A' ' 77' ' ' TRP . 25.8 t-105 -39.02 -45.99 1.3 Allowed 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 125.787 1.635 . . . . 4.8099999999999996 111.78 178.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 40.9 mtt-85 -39.42 -52.4 2.08 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.374 1.07 . . . . 5.5800000000000001 111.681 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 11.9 tp -52.17 -42.29 63.3 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.399 0.679 . . . . 1.0900000000000001 111.384 -177.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.467 HD11 ' CZ ' ' B' ' 76' ' ' TYR . 4.1 mp -62.82 -33.47 60.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 N-CA-C 107.063 -1.458 . . . . 2.9100000000000001 107.063 -175.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.485 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -67.41 -44.03 85.6 Favored Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 110.151 -1.18 . . . . 1.3300000000000001 110.151 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -68.38 -54.75 15.12 Favored 'General case' 0 N--CA 1.437 -1.077 0 N-CA-C 108.185 -1.043 . . . . 2.3399999999999999 108.185 -176.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.438 ' HB2' HD23 ' B' ' 49' ' ' LEU . 4.6 pp -57.52 -38.1 74.11 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.608 1.095 . . . . 1.9399999999999999 111.924 177.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.28 -58.57 7.39 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 118.859 0.754 . . . . 1.6599999999999999 109.912 173.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -51.79 -39.33 58.46 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.66 1.584 . . . . 1.49 111.802 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 8.6 mm-40 -60.22 -24.15 64.62 Favored 'General case' 0 C--N 1.338 0.072 0 C-N-CA 125.063 1.345 . . . . 3.0899999999999999 111.431 -176.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 5.0 tt -52.05 -39.45 26.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 118.897 0.771 . . . . 0.93000000000000005 109.865 171.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 18.4 tpt180 -84.94 -54.46 4.64 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.747 1.219 . . . . 4.7699999999999996 112.916 169.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 72.9 tttt . . . . . 0 CA--C 1.535 0.376 0 C-N-CA 123.938 0.895 . . . . 5.0 112.397 -159.166 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 . . . . . 0 CA--C 1.538 0.487 0 N-CA-C 108.357 -0.979 . . . . 5.9900000000000002 108.357 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -71.96 154.98 58.04 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.306 2.004 . . . . 2.6600000000000001 109.718 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.7 mt -118.06 176.83 5.03 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.856 1.262 . . . . 1.4199999999999999 109.414 -169.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.482 HG22 ' CG ' ' A' ' 10' ' ' GLU . 1.0 OUTLIER -74.09 159.03 33.19 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.107 -0.996 . . . . 1.8899999999999999 110.077 178.835 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -43.4 -56.52 3.53 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.237 1.015 . . . . 3.0499999999999998 112.188 -178.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.8 mt -59.16 -47.38 85.53 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.178 -0.915 . . . . 1.3100000000000001 110.818 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.482 ' CG ' HG22 ' A' ' 7' ' ' THR . 83.9 mt-10 -53.08 -50.92 63.42 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.354 1.061 . . . . 2.1899999999999999 111.569 176.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -54.85 -53.06 60.23 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.488 0.661 . . . . 4.2300000000000004 110.011 175.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 84.8 p -62.07 -44.03 97.56 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.867 -0.521 . . . . 1.6000000000000001 111.69 -174.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.452 HG21 HD12 ' B' ' 83' ' ' LEU . 1.8 pp -65.38 -40.6 88.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 117.695 -1.145 . . . . 0.78000000000000003 110.023 175.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -51.52 -55.84 16.77 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 119.779 1.172 . . . . 2.9100000000000001 110.033 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.7 t -58.42 -36.82 74.19 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.469 0.544 . . . . 1.3200000000000001 112.469 -171.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.3 m -77.67 -37.2 23.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 O-C-N 120.629 -1.294 . . . . 0.71999999999999997 111.148 175.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.5 t -61.09 -43.55 96.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 124.394 1.078 . . . . 0.80000000000000004 110.18 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -64.87 -49.35 70.86 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.576 0.625 . . . . 0.63 110.339 176.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 39.7 m -53.3 -44.62 68.49 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.307 0.643 . . . . 0.82999999999999996 110.055 176.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -59.89 -61.97 2.22 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.037 0.935 . . . . 3.2799999999999998 110.512 175.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -62.52 -41.28 98.75 Favored 'General case' 0 C--O 1.233 0.204 0 O-C-N 121.163 -0.96 . . . . 5.3899999999999997 111.89 -171.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.1 t -65.6 -22.13 66.65 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 119.365 -0.35 . . . . 2.2000000000000002 111.247 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -81.35 -43.09 19.55 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 118.415 0.552 . . . . 3.0099999999999998 111.059 166.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.08 -28.78 62.92 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 126.304 1.842 . . . . 1.1299999999999999 111.929 -166.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 33.6 ptt85 -66.38 -34.21 77.45 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.365 1.066 . . . . 3.5899999999999999 112.383 177.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -41.18 -60.09 1.33 Allowed 'General case' 0 C--N 1.345 0.401 0 C-N-CA 124.604 1.162 . . . . 2.0499999999999998 112.962 -163.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -106.05 75.75 1.12 Allowed 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 104.931 -2.248 . . . . 2.9500000000000002 104.931 -178.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 60.21 164.16 0.16 Allowed Glycine 0 CA--C 1.533 1.204 0 C-N-CA 125.449 1.499 . . . . 1.6000000000000001 114.478 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 28.72 100.38 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 128.104 2.562 . . . . 4.7699999999999996 114.839 165.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.9 pttt -69.38 65.06 0.17 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.317 1.847 . . . . 3.3700000000000001 112.741 -177.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -169.31 -45.08 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 127.571 2.348 . . . . 3.8199999999999998 108.066 -175.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.96 110.92 19.24 Favored 'General case' 0 C--O 1.242 0.659 0 C-N-CA 127.548 2.339 . . . . 1.6799999999999999 110.193 171.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.9 mp -91.3 124.52 35.56 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 118.776 -0.631 . . . . 2.5499999999999998 109.549 172.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.9 t -100.05 -179.88 4.28 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 122.007 0.908 . . . . 2.48 111.109 172.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.6 m -57.59 -35.97 52.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 CA-C-N 114.958 -1.019 . . . . 2.9399999999999999 112.923 -167.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -73.18 -50.72 21.0 Favored 'General case' 0 C--O 1.223 -0.316 0 N-CA-C 108.373 -0.973 . . . . 2.0699999999999998 108.373 -177.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 62.3 mt-10 -46.09 -48.17 17.11 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.138 0.975 . . . . 1.8600000000000001 110.901 172.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.17 -58.77 7.08 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.897 -0.592 . . . . 2.8500000000000001 110.138 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.419 ' HA ' HG22 ' A' ' 42' ' ' VAL . 11.0 ttmm -58.0 -37.05 73.55 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 118.243 0.474 . . . . 2.4399999999999999 111.577 -175.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -53.33 -44.98 68.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.735 0.814 . . . . 3.23 110.547 173.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -65.57 -50.28 65.71 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 119.441 1.019 . . . . 2.4399999999999999 108.699 -172.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.419 HG22 ' HA ' ' A' ' 39' ' ' LYS . 31.0 m -62.66 -41.31 91.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 114.767 -1.106 . . . . 1.3799999999999999 108.782 -173.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 96.6 m -62.19 -50.13 73.02 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.102 0.961 . . . . 2.3199999999999998 111.235 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -62.77 -54.29 41.39 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.219 1.408 . . . . 3.71 111.818 -168.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -149.36 66.86 1.01 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 118.185 0.448 . . . . 4.3600000000000003 110.336 -177.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.427 ' N ' ' CD ' ' A' ' 47' ' ' PRO . 2.5 tp -155.04 29.13 0.04 OUTLIER Pre-proline 0 CA--C 1.544 0.74 0 N-CA-C 114.049 1.129 . . . . 1.8799999999999999 114.049 173.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 46' ' ' LEU . 58.8 Cg_endo -64.12 -46.14 8.69 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.943 2.429 . . . . 1.76 112.932 -166.082 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 -79.6 -45.53 18.98 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.47 -0.937 . . . . 5.1600000000000001 108.47 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.553 ' CD2' ' HB2' ' A' ' 83' ' ' LEU . 3.4 tp -66.36 -44.24 83.74 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.455 -0.793 . . . . 1.55 111.996 -168.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.7 mt -129.16 75.02 1.62 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 119.191 0.905 . . . . 2.5699999999999998 109.628 165.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.96 157.51 5.67 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.164 -0.926 . . . . 5.2999999999999998 109.64 165.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 42.9 t0 61.21 74.05 0.46 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 123.378 1.561 . . . . 4.7699999999999996 108.838 -164.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.2 m -76.97 4.38 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 CA-C-N 113.079 -1.873 . . . . 2.4500000000000002 110.582 163.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.19 -66.89 1.69 Allowed Glycine 0 C--N 1.341 0.83 0 N-CA-C 107.924 -2.07 . . . . 1.9199999999999999 107.924 179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 29.2 t -76.28 63.36 1.9 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-O 123.227 1.489 . . . . 1.8999999999999999 110.23 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -77.83 -31.42 51.59 Favored 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 127.978 2.511 . . . . 1.3100000000000001 108.323 174.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -46.41 -51.16 15.57 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 127.102 2.161 . . . . 4.1200000000000001 112.206 172.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -55.78 -53.97 50.16 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.436 -0.579 . . . . 2.9199999999999999 109.436 179.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.4 -48.75 78.26 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 109.119 -0.697 . . . . 3.2999999999999998 109.119 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 8.2 ttt -48.89 -53.73 18.33 Favored 'General case' 0 C--O 1.227 -0.099 0 C-N-CA 123.861 0.864 . . . . 2.3199999999999998 109.976 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -60.19 -45.78 91.97 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 119.798 -0.144 . . . . 3.1299999999999999 111.003 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 26.6 m -60.67 -41.45 95.1 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.291 0.478 . . . . 2.4100000000000001 112.291 177.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.8 mt -71.39 -56.17 6.51 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.178 0.991 . . . . 1.8400000000000001 110.77 -176.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -75.09 82.41 2.28 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.356 0.663 . . . . 2.4199999999999999 109.83 -170.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.9 m -45.04 -39.92 2.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 124.492 1.117 . . . . 1.6699999999999999 113.548 -173.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 23.9 p-10 -97.46 -4.32 38.34 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.93 0.715 . . . . 2.6099999999999999 112.93 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 51.03 50.1 19.81 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.325 1.85 . . . . 3.3100000000000001 111.243 177.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.9 p30 -82.2 -42.32 19.14 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.468 0.707 . . . . 2.2799999999999998 110.291 176.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.4 m 99.92 16.56 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 129.652 3.181 . . . . 1.74 112.112 -170.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 70.8 mt-10 -116.23 108.62 16.35 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 105.145 -2.168 . . . . 2.8900000000000001 105.145 161.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -79.04 87.42 4.83 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 102.312 -3.218 . . . . 1.1599999999999999 102.312 168.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.36 145.9 50.0 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.841 -1.541 . . . . 3.3799999999999999 106.841 177.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -37.61 -51.78 1.2 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.775 1.398 . . . . 5.3899999999999997 114.775 -169.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -73.3 -26.5 61.09 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.519 1.054 . . . . 1.6699999999999999 112.167 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -63.79 -60.36 3.39 Favored 'General case' 0 C--N 1.341 0.238 0 N-CA-C 108.338 -0.986 . . . . 2.3399999999999999 108.338 164.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -50.59 -44.41 56.88 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.253 0.621 . . . . 3.1899999999999999 110.604 -175.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.671 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 41.7 t90 -44.32 -38.22 3.78 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 125.498 1.519 . . . . 4.3200000000000003 111.887 -178.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 13.2 mmt85 -39.72 -46.6 1.9 Allowed 'General case' 0 C--N 1.341 0.238 0 C-N-CA 124.06 0.944 . . . . 4.0099999999999998 111.619 173.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 12.7 tp -49.58 -50.59 41.85 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.974 0.909 . . . . 0.85999999999999999 111.492 178.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.6 mp -64.7 -24.21 35.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 107.616 -1.253 . . . . 1.75 107.616 -176.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.59 ' CA ' ' CZ2' ' B' ' 77' ' ' TRP . . . -69.79 -55.21 9.94 Favored Glycine 0 CA--C 1.49 -1.525 0 C-N-CA 125.334 1.445 . . . . 1.3200000000000001 111.822 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.69 -47.19 77.21 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 107.389 -1.337 . . . . 2.3900000000000001 107.389 -177.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.553 ' HB2' ' CD2' ' A' ' 49' ' ' LEU . 4.0 pp -74.09 -39.97 63.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 115.098 1.518 . . . . 2.1099999999999999 115.098 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.99 -31.95 63.51 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 121.236 -0.915 . . . . 1.2 110.228 170.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -79.7 -42.41 24.74 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 124.809 1.244 . . . . 1.9299999999999999 111.461 175.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -45.36 -42.15 9.71 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 126.123 1.769 . . . . 2.9300000000000002 110.626 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.8 tt -46.46 -32.25 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 123.697 0.799 . . . . 1.6499999999999999 112.638 178.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -121.93 -18.83 6.88 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.925 1.083 . . . . 4.9400000000000004 113.925 177.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.4 tttp . . . . . 0 CA--C 1.534 0.328 0 CA-C-O 123.177 1.465 . . . . 3.3799999999999999 109.139 175.835 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.3 mt . . . . . 0 CA--C 1.539 0.542 0 CA-C-O 119.082 -0.485 . . . . 2.9700000000000002 110.364 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.617 HG22 ' CD ' ' B' ' 10' ' ' GLU . 15.3 t -73.98 -154.35 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.543 0.737 . . . . 1.9399999999999999 109.924 156.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -84.13 -62.02 1.67 Allowed 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 121.073 -1.017 . . . . 3.1000000000000001 111.866 -164.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 mt -47.08 -43.8 20.58 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 120.611 1.55 . . . . 1.26 111.715 168.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . 0.617 ' CD ' HG22 ' B' ' 7' ' ' THR . 90.6 mt-10 -53.83 -44.58 70.36 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.541 1.136 . . . . 3.0699999999999998 111.676 173.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -35.07 63.58 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.026 -1.671 . . . . 3.8599999999999999 111.705 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 22.9 t -59.14 -47.19 86.19 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.717 0.807 . . . . 1.8100000000000001 110.551 177.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.263 2.2 pp -58.05 -37.2 60.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 O-C-N 121.124 -0.985 . . . . 1.1399999999999999 111.522 172.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -58.4 -55.17 38.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.663 0.665 . . . . 2.98 110.137 174.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . 0.251 4.0 t -54.2 -33.27 57.83 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.247 0.931 . . . . 1.3700000000000001 112.617 -172.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 33.9 m -78.43 -44.35 26.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 119.008 0.822 . . . . 1.0800000000000001 111.522 173.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 38.2 t -53.23 -46.74 56.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-O 119.025 -0.512 . . . . 1.1399999999999999 110.491 177.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 15.3 t -62.38 -45.89 91.08 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.15 0.886 . . . . 1.46 111.43 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 20.4 m -54.82 -50.65 68.06 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 120.621 1.555 . . . . 1.2 109.788 174.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -55.21 -51.46 66.5 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.207 0.603 . . . . 7.1299999999999999 110.513 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -64.06 -48.26 76.93 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 126.505 1.922 . . . . 2.73 111.285 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 30.4 p -57.36 -53.29 59.82 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.412 -0.588 . . . . 2.1600000000000001 109.412 176.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -56.1 -39.57 72.36 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.782 0.719 . . . . 3.0699999999999998 111.258 175.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.32 -29.23 63.77 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.266 1.026 . . . . 1.21 110.851 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -53.74 -32.0 50.51 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 118.105 -0.95 . . . . 4.6399999999999997 111.494 176.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.16 -65.99 0.47 Allowed 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 116.033 1.864 . . . . 2.2000000000000002 116.033 -143.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 71.7 mt-10 -91.72 -74.87 0.49 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.846 0.831 . . . . 3.7000000000000002 112.319 -175.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.46 163.73 28.9 Favored Glycine 0 C--N 1.336 0.563 0 C-N-CA 126.898 2.19 . . . . 1.96 111.361 167.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 38.1 ttm180 36.25 102.93 0.0 OUTLIER 'General case' 0 C--O 1.242 0.709 0 C-N-CA 125.675 1.59 . . . . 4.1200000000000001 115.155 142.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -72.11 34.82 0.06 Allowed 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 115.213 1.56 . . . . 3.3599999999999999 115.213 -173.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -147.8 -50.82 0.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.458 -0.942 . . . . 4.0499999999999998 108.458 -167.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 20.2 m -87.43 130.68 34.58 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-N 115.851 -0.613 . . . . 1.96 109.837 173.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -87.11 160.19 18.64 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.488 1.515 . . . . 2.4399999999999999 109.186 172.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 7.0 m -154.71 169.51 23.75 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.787 0.835 . . . . 2.1800000000000002 109.699 -167.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.55 120.36 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 101.503 -3.517 . . . . 3.6899999999999999 101.503 152.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -118.1 98.45 6.32 Favored 'General case' 0 C--N 1.331 -0.198 1 C-N-CA 131.944 4.098 . . . . 2.3100000000000001 107.309 9.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -155.03 -52.49 0.09 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 113.592 -1.64 . . . . 2.4300000000000002 106.852 -175.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -59.3 -49.35 78.18 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 114.132 -1.394 . . . . 1.98 108.314 176.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -58.38 -36.83 74.11 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 120.259 -0.576 . . . . 2.77 110.631 -175.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -58.0 -38.83 76.89 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 112.512 0.56 . . . . 2.7000000000000002 112.512 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 7.7 tp -66.75 -47.79 71.15 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 119.207 0.912 . . . . 1.96 108.849 -178.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 16.2 m -69.59 -39.01 77.82 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.814 -0.63 . . . . 0.71999999999999997 109.536 -172.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 97.8 m -64.21 -60.1 3.61 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.446 0.698 . . . . 1.01 110.604 174.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -81.83 -57.39 3.45 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.701 0.8 . . . . 1.99 111.939 -166.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -82.47 -40.61 20.89 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.709 1.204 . . . . 3.1099999999999999 112.74 -167.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 18.4 tp -81.0 -19.16 0.27 Allowed Pre-proline 0 CA--C 1.538 0.499 0 N-CA-C 116.095 1.887 . . . . 1.97 116.095 -167.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -30.67 -63.26 0.1 Allowed 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 124.82 3.68 . . . . 1.75 116.938 -126.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -80.7 -51.26 8.89 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.87 0.759 . . . . 2.1099999999999999 112.799 -162.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.418 HD23 ' HB2' ' B' ' 83' ' ' LEU . 17.5 tp -18.84 -62.82 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 127.296 2.238 . . . . 1.72 116.329 -175.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 pp -117.71 145.22 44.58 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-O 121.354 0.597 . . . . 2.5299999999999998 109.438 168.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.22 163.2 18.82 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.558 -0.746 . . . . 5.7999999999999998 111.054 -173.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 61.1 t0 57.35 66.73 1.09 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 124.606 2.146 . . . . 3.73 110.236 172.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 18.3 m -71.82 8.59 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.892 0 CA-C-N 110.486 -3.052 . . . . 1.9099999999999999 111.171 157.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -83.59 -55.37 2.87 Favored Glycine 0 C--N 1.343 0.933 0 N-CA-C 108.467 -1.853 . . . . 2.3300000000000001 108.467 179.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 17.2 t -69.05 59.16 0.1 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.811 2.445 . . . . 2.5499999999999998 109.83 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -86.16 -29.5 23.2 Favored 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 124.257 1.023 . . . . 1.1200000000000001 110.348 -172.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -57.75 -46.45 84.47 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.845 0.858 . . . . 3.71 110.281 173.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -51.51 -60.27 3.33 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.174 0.99 . . . . 2.48 109.832 171.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.07 -49.05 74.87 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.846 0.458 . . . . 3.2400000000000002 109.957 -176.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tpt -49.05 -56.84 7.77 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 126.464 1.906 . . . . 3.04 108.614 178.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -60.83 -39.73 90.12 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 111.624 0.231 . . . . 3.5699999999999998 111.624 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.6 t -58.35 -39.05 78.49 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.83 0.452 . . . . 1.6399999999999999 111.322 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 3.5 mp -74.61 -52.89 10.48 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.549 -0.719 . . . . 1.6000000000000001 111.956 174.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -54.39 -10.9 0.44 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 116.939 2.2 . . . . 1.46 116.939 -163.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 28.1 m -34.27 -22.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 130.591 3.557 . . . . 1.49 118.906 -137.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -57.26 -24.48 55.1 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.669 1.577 . . . . 2.7200000000000002 111.608 163.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 69.73 56.62 0.33 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.119 1.367 . . . . 3.3700000000000001 110.871 168.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 47.2 p30 -110.6 -12.29 14.36 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.578 1.551 . . . . 1.79 111.898 177.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 14.2 m 72.96 1.08 3.9 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.41 1.884 . . . . 2.0800000000000001 114.154 -174.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -105.14 107.15 17.98 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.351 1.46 . . . . 2.98 107.594 169.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -80.86 94.86 6.54 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 107.354 -1.35 . . . . 1.03 107.354 -179.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 7.6 ptmt -83.38 175.11 10.09 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.03 0.532 . . . . 3.3700000000000001 110.248 -173.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 40.7 p90 -93.76 52.87 1.74 Allowed 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.616 -0.677 . . . . 4.5499999999999998 111.996 -175.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -155.62 49.54 0.54 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.377 -0.971 . . . . 2.46 108.377 112.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -93.32 -62.09 1.44 Allowed 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 107.475 -1.306 . . . . 2.1299999999999999 107.475 142.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -46.85 -48.28 21.02 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 126.431 1.893 . . . . 4.1200000000000001 112.156 -172.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.671 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 7.5 t-105 -40.34 -40.68 1.22 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.754 1.222 . . . . 4.8300000000000001 111.916 175.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 8.3 mtp-105 -39.54 -46.31 1.72 Allowed 'General case' 0 C--N 1.347 0.462 0 C-N-CA 124.11 0.964 . . . . 4.9699999999999998 112.681 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.0 tp -54.68 -38.73 67.33 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 118.861 -0.59 . . . . 0.80000000000000004 110.922 -176.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 68.3 mt -58.66 -38.09 69.45 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 N-CA-C 109.17 -0.678 . . . . 1.4099999999999999 109.17 -177.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.575 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -74.2 -42.83 34.41 Favored Glycine 0 CA--C 1.488 -1.655 0 N-CA-C 110.715 -0.954 . . . . 1.25 110.715 -174.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . 0.405 ' C ' ' HG2' ' B' ' 86' ' ' GLU . 1.8 mm-40 -64.38 -63.27 1.18 Allowed 'General case' 0 N--CA 1.427 -1.616 0 N-CA-C 104.722 -2.325 . . . . 2.1800000000000002 104.722 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.452 HD12 HG21 ' A' ' 13' ' ' ILE . 3.4 pp -52.12 -38.97 59.16 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.069 0.849 . . . . 1.9199999999999999 111.948 -176.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.2 -60.04 3.86 Favored 'General case' 0 C--N 1.341 0.212 0 N-CA-C 112.237 0.458 . . . . 1.4099999999999999 112.237 171.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.18 -35.15 66.35 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.001 0.819 . . . . 1.5700000000000001 111.71 -174.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.405 ' HG2' ' C ' ' B' ' 82' ' ' GLU . 0.9 OUTLIER -48.62 -34.21 11.24 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 125.719 1.607 . . . . 2.9300000000000002 110.524 -178.509 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 11.8 tt -39.94 -48.29 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 123.972 0.909 . . . . 1.0600000000000001 110.839 174.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 49.3 ttt180 -85.72 -56.76 3.34 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.339 1.455 . . . . 4.1900000000000004 111.692 168.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 18.2 mttt . . . . . 0 N--CA 1.461 0.11 0 C-N-CA 124.957 1.303 . . . . 7.3499999999999996 112.859 -157.592 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 . . . . . 0 N--CA 1.442 -0.865 0 N-CA-C 107.625 -1.25 . . . . 6.0300000000000002 107.625 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -64.02 149.22 90.95 Favored 'Trans proline' 0 N--CA 1.451 -1.002 0 N-CA-C 107.65 -1.711 . . . . 2.23 107.65 172.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.53 -164.19 0.92 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.729 -0.841 . . . . 1.6000000000000001 108.729 -172.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.406 ' HB ' ' HB2' ' A' ' 10' ' ' GLU . 7.3 m -64.93 140.92 58.92 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 120.914 -1.116 . . . . 3.9700000000000002 109.615 177.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -39.51 -56.52 1.62 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.159 0.984 . . . . 2.8599999999999999 112.322 173.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.1 mt -69.62 -38.75 77.36 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.257 -0.902 . . . . 1.6399999999999999 112.153 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.406 ' HB2' ' HB ' ' A' ' 7' ' ' THR . 80.6 tt0 -50.04 -49.45 51.02 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.802 1.241 . . . . 3.1699999999999999 111.16 170.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -52.25 -52.11 54.48 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.583 0.753 . . . . 4.25 109.077 173.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.9 p -63.19 -42.37 99.33 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.241 -0.436 . . . . 1.8100000000000001 111.765 -173.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.28 2.6 pp -71.1 -36.15 61.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 O-C-N 121.742 -0.599 . . . . 0.59999999999999998 110.405 179.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -55.46 -56.03 24.9 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.122 0.874 . . . . 2.6600000000000001 109.678 172.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.2 t -58.57 -28.63 65.71 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 119.712 -0.795 . . . . 1.3200000000000001 112.75 -170.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.7 m -80.72 -39.56 18.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 O-C-N 121.361 -0.837 . . . . 0.63 111.556 170.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.8 t -54.57 -46.89 72.35 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 119.267 0.939 . . . . 0.53000000000000003 110.743 175.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.5 t -59.25 -46.88 87.31 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.715 1.143 . . . . 0.79000000000000004 111.055 176.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.6 m -59.63 -39.3 83.83 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.848 0.859 . . . . 0.96999999999999997 110.839 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -56.63 -61.13 2.64 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.474 0.71 . . . . 3.6400000000000001 109.635 168.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -62.09 -45.97 91.16 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.81 0.844 . . . . 2.7799999999999998 110.801 -164.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -59.79 -33.57 71.89 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.526 -0.306 . . . . 1.99 110.935 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -76.98 -41.57 42.42 Favored 'General case' 0 C--O 1.22 -0.472 0 O-C-N 121.921 -0.487 . . . . 2.7599999999999998 111.338 173.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.38 -25.76 66.13 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 125.442 1.497 . . . . 0.98999999999999999 111.604 -169.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -71.21 -25.18 62.39 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 117.079 -1.439 . . . . 3.96 113.329 175.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -44.11 -53.82 6.08 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-N 119.742 1.156 . . . . 1.6899999999999999 112.355 -167.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -124.26 170.71 10.5 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 106.422 -1.695 . . . . 2.7000000000000002 106.422 176.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -7.87 119.15 0.01 OUTLIER Glycine 0 CA--C 1.537 1.409 0 C-N-CA 127.47 2.462 . . . . 1.8600000000000001 115.972 177.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 60.4 105.33 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.397 1.479 . . . . 6.1900000000000004 114.885 159.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -72.56 60.87 0.49 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.467 1.107 . . . . 3.9399999999999999 113.471 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -147.65 -48.1 0.17 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 129.02 2.928 . . . . 4.8799999999999999 105.419 167.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -81.77 117.15 21.84 Favored 'General case' 0 C--O 1.242 0.669 0 C-N-CA 128.141 2.576 . . . . 1.6599999999999999 111.116 174.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.402 HD22 ' CD1' ' A' ' 76' ' ' TYR . 6.7 mp -89.27 132.48 34.88 Favored 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 122.661 0.384 . . . . 2.2999999999999998 110.068 164.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 29.1 t -82.23 174.67 10.95 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.473 1.509 . . . . 2.46 109.313 175.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.6 t -55.07 -46.34 77.33 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 108.893 -0.78 . . . . 2.1800000000000002 108.893 172.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -54.8 -62.3 1.75 Allowed 'General case' 0 C--N 1.34 0.179 0 C-N-CA 123.056 0.543 . . . . 4.0499999999999998 109.897 176.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -49.78 -48.4 50.5 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 124.435 1.094 . . . . 1.96 110.857 -177.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.588 ' CZ ' HD21 ' A' ' 56' ' ' LEU . 3.7 t80 -61.59 -55.89 25.87 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 116.197 -0.456 . . . . 2.71 110.567 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 40.3 tttt -60.14 -38.18 82.3 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.549 -0.72 . . . . 2.8599999999999999 111.174 -174.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -54.74 -34.23 62.22 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.813 -0.613 . . . . 2.5499999999999998 112.087 174.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.81 -55.64 21.51 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 119.751 1.16 . . . . 2.6899999999999999 108.407 -177.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.9 m -65.94 -38.56 82.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 CA-C-N 115.042 -0.981 . . . . 1.0600000000000001 109.464 -172.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.8 m -60.84 -52.49 64.84 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 123.627 0.771 . . . . 1.2 110.865 174.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -76.25 -51.2 12.52 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.039 0.536 . . . . 2.4900000000000002 111.709 -167.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -146.02 78.25 1.52 Allowed 'General case' 0 CA--C 1.523 -0.086 0 C-N-CA 123.006 0.522 . . . . 3.5600000000000001 110.1 -175.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.4 tp -153.78 48.99 0.45 Allowed Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 113.313 0.857 . . . . 1.72 113.313 159.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -68.02 139.81 48.04 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.793 2.329 . . . . 4.0499999999999998 111.984 -177.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 76.48 -1.74 2.84 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.241 1.417 . . . . 3.9700000000000002 113.681 165.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 11.1 tp -100.47 -92.25 0.29 Allowed 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 124.313 1.045 . . . . 1.3100000000000001 110.565 -175.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 28.6 mt -65.74 -42.06 91.43 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 118.283 0.492 . . . . 3.1499999999999999 110.864 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt 57.1 -168.59 0.11 Allowed 'General case' 0 C--N 1.344 0.367 0 C-N-CA 123.185 0.594 . . . . 7.1600000000000001 110.869 -160.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.6 t0 60.39 44.11 12.56 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 124.028 1.871 . . . . 3.9399999999999999 110.447 175.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.4 m -53.48 -24.32 8.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 112.76 -2.018 . . . . 2.5 110.796 159.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -62.99 -78.31 0.18 Allowed Glycine 0 CA--C 1.528 0.88 0 N-CA-C 110.64 -0.984 . . . . 1.52 110.64 171.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.25 32.34 0.5 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.229 1.012 . . . . 2.9700000000000002 111.528 -167.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.588 HD21 ' CZ ' ' A' ' 38' ' ' PHE . 3.2 tm? -50.31 -37.55 37.13 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 124.761 1.225 . . . . 1.3700000000000001 110.022 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.91 -19.74 45.23 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.25 1.82 . . . . 4.3300000000000001 113.682 -177.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -80.18 -41.23 25.68 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 120.62 1.554 . . . . 2.98 110.351 166.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.66 -47.19 70.6 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 108.515 -0.92 . . . . 2.8999999999999999 108.515 174.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -43.96 -51.83 7.4 Favored 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 124.688 1.195 . . . . 1.47 110.153 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.5 mttp -69.39 -47.47 64.11 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 110.333 -0.247 . . . . 3.8700000000000001 110.333 -177.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.5 m -57.29 -31.49 65.68 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.31 0.644 . . . . 2.73 112.476 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.1 mt -75.69 -60.17 2.43 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.155 1.382 . . . . 2.0 109.409 174.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -76.43 75.37 3.18 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 123.685 0.794 . . . . 1.8400000000000001 110.717 -174.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.2 m -49.55 -34.49 8.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.203 1.001 . . . . 2.4100000000000001 113.059 -179.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -89.86 -32.28 16.96 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.19 0.596 . . . . 2.9900000000000002 112.127 -178.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 56.85 44.1 23.84 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.296 1.038 . . . . 3.0800000000000001 111.466 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 23.8 p30 -50.95 -42.1 59.61 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.14 0.976 . . . . 2.1299999999999999 110.02 155.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.6 t 113.25 18.37 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.635 1 C-N-CA 131.706 4.002 . . . . 1.7 112.277 -174.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -134.24 126.98 30.96 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.802 1.241 . . . . 4.6500000000000004 109.211 178.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -80.43 77.58 7.2 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 104.218 -2.512 . . . . 1.25 104.218 168.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.1 tppt? -49.93 153.76 1.25 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 128.124 2.569 . . . . 4.0 108.885 173.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -38.95 -59.95 0.91 Allowed 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.352 1.433 . . . . 5.4299999999999997 112.836 -166.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.08 -40.03 96.45 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.096 0.558 . . . . 1.8100000000000001 110.853 -177.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -64.06 -41.72 97.26 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.176 0.591 . . . . 2.3799999999999999 111.278 177.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.402 ' CD1' HD22 ' A' ' 33' ' ' LEU . 31.5 t80 -68.64 -53.86 19.92 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 118.937 0.79 . . . . 2.6600000000000001 109.31 176.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.508 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.7 OUTLIER -40.5 -42.19 1.59 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.317 1.047 . . . . 4.8200000000000003 108.918 176.216 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 11.3 ttt180 -38.69 -52.39 1.67 Allowed 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 117.868 -1.063 . . . . 5.0199999999999996 111.266 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.4 tp -43.77 -42.47 5.55 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 123.929 0.892 . . . . 0.70999999999999996 111.085 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 29.5 mt -68.66 -43.61 83.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 C-N-CA 125.81 1.644 . . . . 1.45 108.066 -174.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -59.46 -47.76 89.32 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 110.591 -1.004 . . . . 1.22 110.591 172.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -58.42 -39.94 81.14 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 124.156 0.982 . . . . 2.52 109.898 178.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 13.7 mt -56.76 -48.62 77.44 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 120.069 1.304 . . . . 2.3300000000000001 110.984 174.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.36 -27.71 64.45 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.222 0.609 . . . . 1.23 111.86 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.2 ttmt -75.58 -60.64 2.22 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.333 0.653 . . . . 1.8600000000000001 109.744 168.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -48.67 -49.3 38.15 Favored 'General case' 0 C--N 1.334 -0.068 0 C-N-CA 125.861 1.664 . . . . 2.3399999999999999 111.223 -172.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.9 tt -51.2 -39.78 21.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 C-N-CA 122.577 0.351 . . . . 1.1000000000000001 111.625 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.43 -31.02 26.83 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.015 1.326 . . . . 4.4699999999999998 109.965 -177.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 43.4 tttm . . . . . 0 CA--C 1.542 0.662 0 C-N-CA 125.561 1.544 . . . . 4.1500000000000004 112.138 -168.714 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.7 mt . . . . . 0 CA--C 1.543 0.679 0 CA-C-O 119.396 -0.335 . . . . 2.3700000000000001 110.762 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 1.7 t -129.43 -79.9 0.56 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.857 1.263 . . . . 2.6200000000000001 112.381 -174.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -159.5 -71.32 0.08 Allowed 'General case' 0 C--N 1.342 0.263 0 CA-C-N 119.38 0.991 . . . . 2.3199999999999998 109.256 -176.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.2 mt -50.98 -49.67 59.77 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.522 -0.736 . . . . 1.05 110.106 169.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 22.8 mp0 -50.68 -46.17 58.57 Favored 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 124.636 1.175 . . . . 3.9100000000000001 111.788 173.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -60.34 -41.18 93.04 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.519 -0.738 . . . . 4.4400000000000004 110.398 176.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 31.6 p -64.96 -39.3 93.28 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.595 -0.691 . . . . 1.6100000000000001 111.51 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.322 2.8 pp -69.57 -32.44 52.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 O-C-N 121.524 -0.735 . . . . 0.80000000000000004 111.41 172.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -58.76 -57.27 13.78 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.466 -0.771 . . . . 2.79 110.339 173.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.4 t -51.52 -39.46 57.71 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.762 0.71 . . . . 1.3500000000000001 111.731 -171.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 23.2 m -72.68 -37.02 54.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 120.995 -1.066 . . . . 0.76000000000000001 111.896 176.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 42.1 t -60.57 -45.27 97.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 119.43 1.014 . . . . 0.89000000000000001 110.786 173.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -66.22 -41.4 90.15 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.98 -1.075 . . . . 1.1100000000000001 110.783 176.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 61.6 m -59.23 -46.7 87.78 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.151 0.887 . . . . 0.98999999999999999 110.826 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -48.25 -61.86 1.78 Allowed 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 108.073 -1.084 . . . . 3.8500000000000001 108.073 169.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -52.95 -52.81 56.71 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.203 1.001 . . . . 3.21 112.238 -172.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 7.1 t -61.55 -29.97 70.35 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 119.075 -0.488 . . . . 2.6699999999999999 111.826 -174.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -81.69 -40.25 23.09 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 119.358 0.981 . . . . 3.0099999999999998 111.538 170.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.16 -25.26 65.4 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 126.913 2.085 . . . . 0.90000000000000002 112.653 -168.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 20.3 ptt180 -58.62 -28.86 66.04 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 117.675 -1.155 . . . . 5.0899999999999999 112.9 172.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -52.01 -63.83 1.01 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 115.448 1.647 . . . . 2.1200000000000001 115.448 -155.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -88.93 -76.74 0.4 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.361 0.6 . . . . 3.3300000000000001 112.384 -166.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.75 165.38 27.03 Favored Glycine 0 C--N 1.337 0.635 0 C-N-CA 127.791 2.615 . . . . 2.1499999999999999 110.885 158.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 38.94 103.07 0.0 OUTLIER 'General case' 0 C--O 1.238 0.487 0 N-CA-C 115.973 1.842 . . . . 3.6299999999999999 115.973 139.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 18.3 pttm -54.58 -32.08 57.96 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.948 1.299 . . . . 3.9700000000000002 114.033 174.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -79.37 -33.43 42.88 Favored 'General case' 0 CA--C 1.531 0.226 0 O-C-N 121.591 -0.693 . . . . 4.0499999999999998 111.626 -173.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.0 p -100.73 130.23 46.74 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.953 -0.758 . . . . 1.6899999999999999 108.953 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.26 170.72 4.39 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 122.486 1.136 . . . . 1.98 108.995 161.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 4.7 m -157.24 -173.5 4.46 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 106.259 -1.756 . . . . 3.5699999999999998 106.259 -154.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 93.3 t -71.77 -111.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 101.397 -3.557 . . . . 3.1299999999999999 101.397 -175.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -75.07 59.68 0.97 Allowed 'General case' 0 CA--C 1.551 0.998 0 O-C-N 119.597 -1.94 . . . . 2.3799999999999999 110.074 -176.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -115.37 -52.05 2.67 Favored 'General case' 0 N--CA 1.452 -0.347 1 C-N-CA 132.574 4.35 . . . . 2.4500000000000002 107.621 144.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -56.31 -50.33 71.76 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.677 -1.231 . . . . 2.8900000000000001 107.677 173.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 7.8 tttp -56.0 -39.5 71.97 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 121.02 -0.272 . . . . 2.96 110.723 178.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -56.36 -45.06 80.64 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 122.642 0.377 . . . . 2.5499999999999998 110.745 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 7.2 tt -64.23 -48.83 74.31 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.381 -0.97 . . . . 2.1499999999999999 108.381 -174.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . 0.406 HG21 HD23 ' B' ' 56' ' ' LEU . 6.8 m -67.05 -42.69 88.78 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-N 115.773 -0.649 . . . . 0.80000000000000004 109.899 -173.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 88.1 m -61.22 -53.33 58.28 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.929 0.892 . . . . 0.96999999999999997 110.843 175.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -76.76 -61.16 2.06 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 124.036 0.935 . . . . 1.8500000000000001 110.617 -167.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -82.64 -53.13 6.18 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.72 0.408 . . . . 2.8500000000000001 110.575 -173.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 5.8 tp -83.47 -18.77 0.26 Allowed Pre-proline 0 CA--C 1.542 0.653 0 N-CA-C 121.281 3.808 . . . . 2.29 121.281 -143.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -46.17 -54.81 4.26 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 CA-C-N 123.108 2.146 . . . . 3.0800000000000001 116.154 -145.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -79.69 55.85 2.12 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 118.971 0.805 . . . . 2.4399999999999999 112.055 -175.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 33.2 tp -147.39 -87.1 0.09 Allowed 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 125.898 1.679 . . . . 1.3 107.117 170.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 53.1 mt -73.99 77.46 1.69 Allowed 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 107.29 -1.374 . . . . 1.8700000000000001 107.29 165.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.5 151.76 2.15 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.247 -0.888 . . . . 5.5899999999999999 109.583 174.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 61.3 t0 66.7 73.47 0.35 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 123.665 1.697 . . . . 3.5899999999999999 108.893 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 14.3 m -78.42 6.68 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 CA-C-N 112.172 -2.285 . . . . 1.55 110.284 163.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -74.11 -58.9 4.15 Favored Glycine 0 C--N 1.342 0.904 0 N-CA-C 106.681 -2.568 . . . . 2.3500000000000001 106.681 172.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 1.7 t -77.34 49.07 0.68 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.706 0.765 . . . . 2.6200000000000001 110.46 172.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.406 HD23 HG21 ' B' ' 42' ' ' VAL . 2.2 tm? -62.32 -47.47 84.12 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 107.634 -1.247 . . . . 0.95999999999999996 107.634 167.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -63.25 -30.72 71.81 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.844 0.857 . . . . 4.5899999999999999 111.221 -165.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -52.98 -59.94 3.91 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.132 0.973 . . . . 2.4100000000000001 110.113 163.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -58.51 -39.42 80.04 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.436 -0.792 . . . . 4.6200000000000001 109.982 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -52.49 -55.77 19.74 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 119.066 0.848 . . . . 1.8400000000000001 109.232 174.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 35.1 mtmt -58.1 -40.9 82.35 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.226 0.921 . . . . 3.29 111.954 176.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 18.0 t -61.35 -25.27 67.04 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.734 -0.604 . . . . 1.75 112.475 173.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.831 ' HB3' HD11 ' B' ' 71' ' ' LEU . 1.2 tp -81.95 -52.07 7.43 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.035 1.734 . . . . 2.4399999999999999 110.625 176.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -62.16 -13.73 30.17 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 128.662 2.785 . . . . 1.6699999999999999 115.211 -164.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 30.1 m -35.98 -27.12 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 C-N-CA 130.931 3.693 . . . . 1.48 118.456 -130.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -65.25 -11.52 42.05 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.603 1.092 . . . . 2.3700000000000001 111.643 166.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 70.15 28.67 3.94 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.712 1.205 . . . . 4.1900000000000004 112.297 165.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 55.4 p30 -91.54 -1.21 57.59 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.783 1.233 . . . . 2.1299999999999999 112.73 177.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 8.1 t 69.39 1.56 3.35 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 114.524 1.305 . . . . 2.7000000000000002 114.524 -176.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -103.64 126.77 50.99 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 119.855 1.207 . . . . 3.7000000000000002 108.412 171.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . 0.831 HD11 ' HB3' ' B' ' 63' ' ' LEU . 3.8 mm? -98.76 80.85 2.58 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.802 -1.184 . . . . 1.5700000000000001 107.802 175.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 11.0 ptpp? -83.42 177.75 8.34 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.513 1.125 . . . . 3.9199999999999999 111.772 -174.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -83.08 56.65 3.57 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.373 -0.829 . . . . 3.9100000000000001 112.898 -173.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -163.19 49.07 0.15 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.375 -0.972 . . . . 2.3100000000000001 108.375 109.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -93.78 -62.47 1.35 Allowed 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 124.885 1.274 . . . . 1.76 108.428 150.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -61.1 -32.32 71.99 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.174 -0.921 . . . . 4.6900000000000004 112.012 -164.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.425 ' C ' ' CD1' ' B' ' 77' ' ' TRP . 5.8 t90 -41.11 -44.64 2.55 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 124.49 1.119 . . . . 4.5800000000000001 109.541 175.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 60.1 mtp85 -38.92 -41.19 0.73 Allowed 'General case' 0 C--N 1.344 0.36 0 C-N-CA 123.833 0.853 . . . . 4.1100000000000003 111.509 -178.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 16.7 tp -51.53 -54.5 26.7 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.934 0.788 . . . . 1.0900000000000001 112.822 176.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.6 mt -70.23 -30.94 45.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 120.144 1.338 . . . . 1.4299999999999999 108.529 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -41.92 -51.98 4.9 Favored Glycine 0 C--N 1.344 0.999 0 C-N-CA 125.437 1.494 . . . . 1.4099999999999999 110.184 165.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -75.58 -57.9 3.61 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 112.89 -1.655 . . . . 2.23 109.862 -176.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 10.5 mp -41.69 -59.33 1.68 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 120.62 1.555 . . . . 2.1899999999999999 112.212 -176.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.71 -28.84 70.16 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-N 115.436 -0.802 . . . . 1.3200000000000001 111.739 -174.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -71.24 -62.09 1.53 Allowed 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 108.12 -1.067 . . . . 1.76 108.12 172.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -58.27 -39.11 78.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.047 0.939 . . . . 2.73 111.87 -166.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 11.4 tt -47.51 -47.37 10.64 Favored 'Isoleucine or valine' 0 C--N 1.347 0.492 0 CA-C-N 119.603 1.092 . . . . 1.05 112.104 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 5.9 ttp85 -82.27 -48.4 11.26 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 122.313 1.054 . . . . 4.2699999999999996 110.14 173.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 2.7 tttt . . . . . 0 N--CA 1.45 -0.462 0 C-N-CA 126.846 2.058 . . . . 6.4100000000000001 109.022 -169.685 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 . . . . . 0 CA--C 1.537 0.462 0 CA-C-O 119.182 -0.437 . . . . 5.5099999999999998 110.199 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.69 103.4 1.7 Allowed 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.912 2.408 . . . . 2.6299999999999999 110.467 -177.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 88.5 mt -67.65 164.82 18.4 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.228 0.537 . . . . 1.29 110.833 173.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.8 t -83.18 175.68 9.77 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.658 -0.867 . . . . 2.0299999999999998 108.658 171.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -69.37 -48.52 60.99 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.567 0.747 . . . . 2.5800000000000001 109.175 -167.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.5 mp -62.33 -52.46 63.56 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 119.361 -0.352 . . . . 2.3300000000000001 111.226 178.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -54.42 -50.55 67.34 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.226 1.01 . . . . 2.8900000000000001 110.248 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -50.99 -55.2 18.52 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.3 1.04 . . . . 3.5800000000000001 110.606 172.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.9 m -55.24 -49.77 71.17 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.878 -0.514 . . . . 2.23 111.654 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.293 2.9 pp -62.49 -37.12 78.02 Favored 'Isoleucine or valine' 0 C--N 1.339 0.13 0 C-N-CA 119.763 -0.775 . . . . 0.67000000000000004 110.332 178.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -60.65 -58.08 9.98 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.093 0.86 . . . . 2.6299999999999999 110.431 175.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.9 t -52.33 -39.86 61.18 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.392 0.996 . . . . 1.1799999999999999 111.583 -172.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.0 m -73.36 -42.09 57.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 O-C-N 121.107 -0.996 . . . . 0.75 111.271 175.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 28.2 t -55.39 -51.29 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 119.376 0.989 . . . . 0.62 110.853 175.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.6 t -60.27 -48.34 82.15 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.163 0.892 . . . . 0.83999999999999997 110.448 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 90.6 m -55.29 -51.38 66.85 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-N 118.691 0.678 . . . . 0.97999999999999998 110.251 178.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -46.88 -58.9 3.47 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 123.658 0.783 . . . . 2.96 109.447 171.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -57.09 -47.07 81.95 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.617 1.167 . . . . 2.6400000000000001 111.452 -169.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.05 -41.85 65.19 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 119.101 -0.476 . . . . 2.3799999999999999 111.945 178.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -81.41 -31.18 33.31 Favored 'General case' 0 C--O 1.221 -0.427 0 C-N-CA 123.668 0.787 . . . . 3.54 111.71 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.01 -34.91 72.42 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 120.432 -1.417 . . . . 0.97999999999999998 109.762 178.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 33.7 ttp180 -69.27 -26.24 64.66 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.12 1.768 . . . . 4.5899999999999999 113.589 178.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -41.05 -60.82 1.11 Allowed 'General case' 0 C--N 1.344 0.345 0 CA-C-N 120.49 1.495 . . . . 1.78 113.514 -168.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -110.54 169.27 8.86 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 127.009 2.124 . . . . 2.6299999999999999 106.346 175.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -11.91 121.09 0.01 OUTLIER Glycine 0 CA--C 1.533 1.2 0 C-N-CA 127.264 2.364 . . . . 1.3999999999999999 115.19 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.27 106.3 0.06 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.932 0.893 . . . . 5.7599999999999998 113.072 170.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -68.08 55.22 0.07 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.163 1.385 . . . . 3.6299999999999999 111.769 168.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -158.83 -61.8 0.08 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 126.572 1.949 . . . . 4.1399999999999997 105.771 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.7 m -82.53 127.24 33.14 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.003 -0.999 . . . . 2.2999999999999998 109.365 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.408 HD22 ' CE2' ' A' ' 76' ' ' TYR . 5.8 mp -93.29 132.41 37.51 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.694 0.283 . . . . 2.2799999999999998 110.537 170.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.5 t -81.5 175.78 10.23 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.276 1.43 . . . . 2.5600000000000001 108.429 172.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.1 t -64.73 -48.58 84.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 C-N-CA 123.1 0.56 . . . . 1.97 109.642 -175.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -59.5 -56.8 17.45 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 118.932 -0.556 . . . . 2.1099999999999999 109.537 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -39.23 -52.14 1.96 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 125.098 1.359 . . . . 1.72 112.479 172.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -58.58 -58.2 9.59 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.476 -0.564 . . . . 3.04 109.476 175.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 33.9 tttm -52.98 -39.59 63.14 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 119.216 -0.421 . . . . 3.5499999999999998 111.823 -175.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 67.9 mt-10 -47.78 -47.56 30.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 118.972 -0.537 . . . . 2.8900000000000001 111.224 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.3 tp -65.95 -46.76 77.0 Favored 'General case' 0 C--N 1.337 0.063 0 CA-C-N 119.816 1.189 . . . . 2.6800000000000002 109.266 -171.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.8 m -69.04 -36.29 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-O 121.494 0.664 . . . . 0.94999999999999996 109.471 -173.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 57.9 m -75.35 -30.34 60.2 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.393 0.677 . . . . 1.1899999999999999 110.795 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -80.53 -57.42 3.59 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.754 1.222 . . . . 2.1800000000000002 110.655 -176.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.4 mp0 -97.95 -125.95 0.15 Allowed 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 109.109 -0.701 . . . . 3.98 109.109 177.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.587 ' CD1' HD23 ' A' ' 49' ' ' LEU . 1.4 mm? 28.96 64.61 0.73 Allowed Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 127.973 2.509 . . . . 2.3399999999999999 115.62 175.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -75.54 -50.12 0.13 Allowed 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 121.918 1.745 . . . . 1.72 111.062 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 19.6 t-160 -107.47 -22.77 12.43 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.13 0.972 . . . . 4.1200000000000001 112.181 -166.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.816 HD21 ' HB2' ' A' ' 83' ' ' LEU . 18.1 tp -74.73 -91.08 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.475 1.11 . . . . 1.2 109.733 -167.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.6 mt -82.65 68.08 8.97 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.117 -1.068 . . . . 2.1099999999999999 108.117 172.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -59.74 156.1 14.62 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.155 -0.475 . . . . 5.4199999999999999 110.054 170.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 60.1 t0 67.69 84.58 0.15 Allowed 'General case' 0 C--O 1.231 0.089 0 C-N-CA 125.879 1.672 . . . . 4.4400000000000004 109.055 -155.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 25.2 m -100.09 28.72 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 114.224 -1.353 . . . . 2.0800000000000001 109.244 166.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -104.57 -59.0 0.68 Allowed Glycine 0 C--N 1.34 0.778 0 C-N-CA 126.419 1.961 . . . . 1.45 108.74 177.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 t -77.28 60.81 2.04 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 123.242 1.496 . . . . 2.04 109.571 175.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -73.88 -25.01 59.81 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 124.782 1.233 . . . . 1.2 109.078 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -52.83 -53.07 53.86 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.953 1.701 . . . . 4.0199999999999996 111.613 171.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . 0.409 ' OE1' ' NZ ' ' A' ' 59' ' ' LYS . 2.1 tt0 -54.26 -56.74 15.41 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.132 0.973 . . . . 3.3900000000000001 108.903 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.409 ' NZ ' ' OE1' ' A' ' 58' ' ' GLU . 0.0 OUTLIER -53.43 -45.52 69.48 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.969 -0.56 . . . . 2.6200000000000001 110.034 179.502 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -57.35 -56.06 26.68 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 123.514 0.725 . . . . 1.3700000000000001 109.693 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 60.1 mttt -63.05 -33.08 74.67 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 111.665 0.246 . . . . 3.6699999999999999 111.665 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -62.09 -41.96 98.73 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.132 -0.355 . . . . 1.9199999999999999 110.781 173.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 21.5 mt -76.54 -56.4 4.65 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.214 1.406 . . . . 1.5 112.773 -174.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -59.34 114.42 2.65 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.04 0.936 . . . . 1.8500000000000001 108.834 -175.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.2 t -73.76 -30.66 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 N-CA-C 109.169 -0.678 . . . . 3.6299999999999999 109.169 -173.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -84.19 -40.5 18.06 Favored 'General case' 0 C--O 1.227 -0.109 0 N-CA-C 109.197 -0.668 . . . . 2.1200000000000001 109.197 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 65.36 64.56 0.6 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.014 1.326 . . . . 3.4199999999999999 108.032 -158.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -104.11 -125.11 0.21 Allowed 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 105.467 -2.049 . . . . 3.6400000000000001 105.467 172.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.3 t -137.28 18.22 2.96 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.365 1.066 . . . . 2.4700000000000002 110.117 170.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 40.0 mp0 -133.12 113.38 12.66 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 125.282 1.433 . . . . 5.0199999999999996 107.399 -165.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -84.27 87.85 7.21 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 105.461 -2.052 . . . . 1.0 105.461 167.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -54.64 158.96 2.34 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 118.222 -0.894 . . . . 4.5300000000000002 109.485 176.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -37.25 -53.03 1.07 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.44 1.096 . . . . 4.8799999999999999 112.011 -176.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -70.23 -40.31 74.56 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.565 0.58 . . . . 2.5499999999999998 112.565 -178.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -63.07 -34.76 78.28 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.873 0.469 . . . . 2.1200000000000001 110.576 176.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.408 ' CE2' HD22 ' A' ' 33' ' ' LEU . 28.3 t80 -75.63 -47.04 28.18 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 119.008 -0.52 . . . . 3.4300000000000002 109.832 175.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.526 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 2.3 t-105 -43.74 -43.94 6.31 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 108.73 -0.841 . . . . 4.79 108.73 173.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.0 mtp180 -39.71 -51.48 2.33 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-O 117.087 -1.435 . . . . 4.2800000000000002 109.44 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.7 tp -43.6 -47.64 7.52 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 120.44 1.473 . . . . 0.72999999999999998 112.198 177.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.5 mp -68.19 -44.11 84.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 125.689 1.595 . . . . 1.76 108.707 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -60.49 -36.97 92.53 Favored Glycine 0 C--N 1.332 0.314 0 CA-C-O 122.121 0.845 . . . . 1.5600000000000001 113.48 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.422 ' O ' ' HD2' ' A' ' 85' ' ' LYS . 5.9 mm-40 -75.99 -56.04 5.03 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 104.979 -2.23 . . . . 3.1200000000000001 104.979 -175.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.816 ' HB2' HD21 ' A' ' 49' ' ' LEU 0.282 4.6 pp -57.14 -32.18 66.11 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 121.207 -0.933 . . . . 2.2000000000000002 113.38 177.027 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.12 -25.09 68.2 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 118.065 -0.969 . . . . 1.77 112.876 175.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.422 ' HD2' ' O ' ' A' ' 82' ' ' GLU 0.308 0.0 OUTLIER -84.74 -41.4 16.24 Favored 'General case' 0 C--N 1.344 0.346 0 CA-C-N 120.201 1.364 . . . . 2.2400000000000002 112.507 158.968 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.487 ' HB2' ' HA ' ' A' ' 83' ' ' LEU . 16.8 mm-40 -52.94 -39.39 62.84 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 119.211 0.914 . . . . 2.54 111.336 -171.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.415 HG21 HG21 ' B' ' 17' ' ' VAL . 4.3 tp -26.87 -50.47 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.449 1.1 . . . . 1.8100000000000001 111.963 166.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -115.24 -42.68 3.15 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.007 0.923 . . . . 4.6500000000000004 112.981 -176.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 44.6 tttm . . . . . 0 C--O 1.232 0.166 0 O-C-N 119.92 -1.737 . . . . 3.0499999999999998 109.298 171.811 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.442 ' HB2' ' HB3' ' B' ' 10' ' ' GLU . 0.3 OUTLIER . . . . . 0 CA--C 1.549 0.912 0 N-CA-C 112.188 0.44 . . . . 3.3700000000000001 112.188 . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 5.1 t -79.85 -159.9 0.24 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.403 1.881 . . . . 2.0499999999999998 113.068 -173.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -75.28 -66.83 0.72 Allowed 'General case' 0 C--O 1.223 -0.29 0 O-C-N 121.957 -0.465 . . . . 2.6800000000000002 111.786 -172.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.0 mt -48.81 -41.67 33.54 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 120.852 -1.155 . . . . 1.04 110.353 175.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . 0.599 ' HG3' HD22 ' A' ' 49' ' ' LEU . 1.6 mt-10 -44.69 -61.51 1.55 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.323 1.849 . . . . 3.52 113.71 164.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.66 -34.94 78.12 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 120.464 -1.397 . . . . 4.29 110.234 -177.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.8 m -64.16 -38.06 89.71 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.204 0.602 . . . . 2.2999999999999998 111.238 178.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.263 2.9 pp -71.47 -36.51 60.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 O-C-N 121.477 -0.765 . . . . 1.1200000000000001 111.209 167.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -53.11 -57.3 10.9 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 118.857 0.753 . . . . 2.6499999999999999 110.043 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.1 t -47.24 -44.51 22.77 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.284 0.947 . . . . 1.3600000000000001 112.699 -176.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.0 m -74.36 -36.22 41.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 O-C-N 120.832 -1.168 . . . . 1.23 110.967 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.415 HG21 HG21 ' A' ' 87' ' ' ILE . 56.3 t -61.53 -48.18 89.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 118.828 0.74 . . . . 0.98999999999999999 110.739 175.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 10.1 t -59.89 -44.91 93.97 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 120.197 1.362 . . . . 1.1499999999999999 110.532 176.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 56.5 m -55.7 -49.81 72.0 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.422 0.63 . . . . 1.1799999999999999 110.483 175.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -49.75 -55.64 13.24 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 118.155 -0.926 . . . . 3.79 110.751 170.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -49.61 -57.74 6.58 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 120.125 1.329 . . . . 4.21 111.161 178.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 30.5 p -60.05 -45.75 91.82 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 122.311 -0.243 . . . . 2.04 110.398 -172.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -66.21 -49.38 67.47 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 121.506 0.67 . . . . 3.54 110.488 177.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.02 -30.24 64.03 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 126.011 1.724 . . . . 0.81999999999999995 110.384 -177.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -58.5 -26.11 63.1 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 117.541 -1.218 . . . . 7.1600000000000001 111.453 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.403 ' HB2' ' HG2' ' B' ' 37' ' ' GLU . 0.3 OUTLIER -45.05 -66.19 0.43 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.87 1.804 . . . . 1.72 115.87 -156.949 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -90.21 -75.41 0.46 Allowed 'General case' 0 C--N 1.341 0.219 0 C-N-CA 119.604 -0.838 . . . . 3.48 111.694 -168.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.85 165.18 29.28 Favored Glycine 0 C--N 1.337 0.628 0 C-N-CA 126.891 2.186 . . . . 1.98 110.741 156.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 18.4 mmt85 36.33 105.5 0.0 OUTLIER 'General case' 0 C--O 1.242 0.67 0 N-CA-C 116.819 2.155 . . . . 5.46 116.819 136.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -66.09 46.76 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.833 2.053 . . . . 4.0700000000000003 114.448 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -148.07 -55.98 0.22 Allowed 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 124.872 1.269 . . . . 4.4299999999999997 108.161 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 2.6 p -81.89 117.55 22.23 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.791 1.636 . . . . 1.73 109.952 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.423 ' N ' HD12 ' B' ' 33' ' ' LEU . 7.7 mp -96.22 137.59 35.07 Favored 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 108.382 -0.97 . . . . 2.2200000000000002 108.382 169.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . 0.457 ' C ' ' H ' ' B' ' 36' ' ' ASN . 0.8 OUTLIER -81.77 -171.5 3.38 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 128.547 2.739 . . . . 2.54 108.055 179.464 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 13.2 p -96.52 42.99 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 CA-C-O 123.454 1.597 . . . . 2.5099999999999998 108.569 164.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . 0.457 ' H ' ' C ' ' B' ' 34' ' ' SER . 0.6 OUTLIER -161.09 170.55 20.22 Favored 'General case' 0 CA--C 1.544 0.747 1 C-N-CA 141.317 7.847 . . . . 3.6800000000000002 101.403 169.592 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.403 ' HG2' ' HB2' ' B' ' 26' ' ' GLN . 63.8 mt-10 58.0 -65.36 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 121.918 2.145 . . . . 1.6000000000000001 110.156 -153.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -57.62 -50.59 72.64 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.709 -0.849 . . . . 2.2000000000000002 108.709 177.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -57.32 -48.58 78.6 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.741 -0.208 . . . . 4.4000000000000004 110.885 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -53.86 -38.48 64.74 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 121.917 -0.49 . . . . 3.6099999999999999 111.137 174.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 8.8 tt -68.56 -47.04 67.85 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.955 -0.758 . . . . 2.4199999999999999 108.955 -177.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . 0.451 HG21 HD23 ' B' ' 56' ' ' LEU . 0.2 OUTLIER -65.24 -51.79 60.67 Favored 'Isoleucine or valine' 0 C--N 1.34 0.155 0 CA-C-N 118.379 0.536 . . . . 1.01 110.187 -179.535 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 63.3 m -53.39 -53.58 49.17 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.878 0.871 . . . . 0.93999999999999995 111.252 177.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -81.64 -60.44 2.25 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.93 0.492 . . . . 1.6799999999999999 112.139 -171.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -80.92 -44.19 18.64 Favored 'General case' 0 C--N 1.337 0.039 0 N-CA-C 113.808 1.04 . . . . 2.5099999999999998 113.808 -159.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' B' ' 42' ' ' VAL . 1.2 mm? -39.89 -57.08 2.83 Favored Pre-proline 0 N--CA 1.467 0.418 0 CA-C-O 117.333 -1.317 . . . . 2.3900000000000001 112.823 -164.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -87.22 -27.57 5.2 Favored 'Cis proline' 0 N--CA 1.45 -1.04 0 CA-C-N 120.48 1.207 . . . . 2.1499999999999999 109.506 -25.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 22.2 t-160 -98.72 -44.36 6.44 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.467 1.107 . . . . 2.73 110.327 -166.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.467 HD23 ' HG ' ' B' ' 83' ' ' LEU . 13.0 tp -29.34 -57.8 0.15 Allowed 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.555 1.942 . . . . 1.0700000000000001 114.652 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 72.0 mt -97.56 116.19 29.29 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 109.398 -0.593 . . . . 1.5700000000000001 109.398 175.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.21 178.23 8.19 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.108 0.563 . . . . 5.3099999999999996 109.617 164.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.326 1.0 OUTLIER 62.6 16.26 8.67 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.761 2.025 . . . . 4.3099999999999996 114.075 176.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 19.3 m -54.76 -20.17 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 C-N-CA 125.812 1.645 . . . . 2.3799999999999999 113.101 171.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.3 -44.95 21.42 Favored Glycine 0 CA--C 1.532 1.095 0 N-CA-C 110.456 -1.058 . . . . 2.6000000000000001 110.456 166.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 18.4 m -92.17 40.34 1.04 Allowed 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.821 1.248 . . . . 2.5499999999999998 110.872 174.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.522 HD13 ' C ' ' B' ' 56' ' ' LEU . 2.6 tm? -48.36 -48.67 36.39 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 119.541 1.064 . . . . 1.1299999999999999 109.809 176.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -45.41 -36.73 4.5 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.188 1.795 . . . . 4.8300000000000001 112.819 177.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -64.69 -51.39 62.73 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.139 -0.976 . . . . 2.8799999999999999 110.111 172.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 4.4 mmpt? -54.16 -53.61 51.04 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 107.997 -1.112 . . . . 3.3500000000000001 107.997 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.03 -42.08 98.78 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.876 -0.583 . . . . 2.02 110.464 -174.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -53.84 -37.17 63.34 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.178 0.899 . . . . 3.54 112.051 171.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 9.2 m -68.86 -44.81 72.6 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 122.708 0.403 . . . . 1.96 111.703 176.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 6.5 mp -69.5 -43.61 72.77 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.23 -0.919 . . . . 1.6100000000000001 111.816 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.268 16.9 t0 -62.88 -9.0 8.12 Favored 'General case' 0 C--O 1.221 -0.395 0 C-N-CA 127.874 2.469 . . . . 1.46 115.99 -166.103 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.3 m -32.26 -21.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 130.57 3.548 . . . . 1.54 120.139 -131.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -53.94 -33.82 57.89 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 121.191 1.814 . . . . 2.4100000000000001 110.723 155.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 58.92 55.33 4.59 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.638 0.775 . . . . 4.21 109.658 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 34.2 p30 -81.66 -34.24 30.88 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.331 -0.849 . . . . 2.1299999999999999 109.056 172.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 24.8 m 109.07 -6.23 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 129.531 3.132 . . . . 1.8999999999999999 111.879 -175.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -111.85 98.22 7.23 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.852 1.661 . . . . 5.3899999999999997 106.568 -177.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -76.02 91.19 3.06 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 126.674 1.99 . . . . 0.97999999999999998 106.843 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 12.3 ptmt -84.25 176.37 8.79 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.873 1.269 . . . . 3.1400000000000001 110.25 -177.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -83.73 50.24 1.76 Allowed 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.42 1.267 . . . . 4.5 114.42 -176.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -162.13 49.46 0.19 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.206 1.402 . . . . 2.1400000000000001 107.882 125.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -95.54 -58.85 2.01 Favored 'General case' 0 N--CA 1.44 -0.963 0 O-C-N 119.498 -2.001 . . . . 1.8500000000000001 108.475 131.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -46.27 -44.53 16.56 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 124.15 0.98 . . . . 3.5699999999999998 112.967 -173.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.417 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 7.7 t90 -43.2 -46.65 6.13 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 123.636 0.585 . . . . 4.3099999999999996 110.207 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -41.57 -37.7 1.18 Allowed 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.749 -0.643 . . . . 5.7199999999999998 111.802 -177.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 11.1 tp -50.34 -55.51 15.26 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 119.186 0.903 . . . . 0.92000000000000004 111.935 175.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.2 mt -71.29 -30.51 40.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 120.183 1.356 . . . . 1.45 108.353 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -41.77 -49.57 5.05 Favored Glycine 0 C--N 1.344 1.001 0 C-N-CA 125.687 1.613 . . . . 1.6699999999999999 111.298 166.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -80.51 -59.54 2.65 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 112.538 -1.831 . . . . 2.4199999999999999 108.676 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.467 ' HG ' HD23 ' B' ' 49' ' ' LEU . 8.4 mp -39.01 -56.48 1.41 Allowed 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 121.374 1.897 . . . . 2.27 113.893 -174.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.35 -30.34 69.48 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 123.146 0.578 . . . . 1.29 111.953 -177.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt -75.84 -46.58 29.66 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 123.971 0.908 . . . . 1.73 109.896 169.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -56.77 -40.86 76.59 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-N 120.372 1.442 . . . . 2.6600000000000001 111.931 -175.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 5.7 tt -55.52 -32.36 30.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 CA-C-N 118.776 0.717 . . . . 1.04 111.657 174.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 50.2 tpt85 -81.86 -40.53 22.29 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.449 1.1 . . . . 3.6099999999999999 112.79 175.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 43.4 tttp . . . . . 0 CA--C 1.532 0.259 0 C-N-CA 125.182 1.393 . . . . 4.2800000000000002 112.866 -157.52 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 . . . . . 0 N--CA 1.448 -0.548 0 N-CA-C 110.064 -0.347 . . . . 4.2000000000000002 110.064 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.41 101.46 1.36 Allowed 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 122.583 2.189 . . . . 2.71 109.688 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 91.4 mt -60.08 152.17 24.85 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.473 0.654 . . . . 1.46 110.82 175.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.4 t -69.07 151.06 46.91 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.823 0.849 . . . . 2.0 109.249 178.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -39.09 -59.12 1.04 Allowed 'General case' 0 CA--C 1.527 0.084 0 C-N-CA 126.291 1.836 . . . . 3.2000000000000002 112.147 -172.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 10.3 mt -69.07 -46.05 68.79 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.435 -0.793 . . . . 1.54 111.16 -172.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -54.61 -48.55 72.06 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.996 0.919 . . . . 2.9399999999999999 110.597 175.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -50.67 -60.8 2.66 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.984 1.314 . . . . 3.8500000000000001 109.655 171.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 54.5 p -55.92 -42.95 76.86 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.606 0.362 . . . . 1.48 111.478 -173.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.306 2.6 pp -66.34 -41.03 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-O 117.671 -1.157 . . . . 0.76000000000000001 111.346 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.72 -52.72 64.28 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 120.046 1.294 . . . . 2.52 108.818 172.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -43.23 -43.84 4.97 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.962 1.305 . . . . 2.0600000000000001 113.72 177.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 35.1 m -81.43 -39.35 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.886 1.221 . . . . 0.73999999999999999 112.619 173.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.3 t -57.47 -40.8 76.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 C-N-CA 123.816 0.847 . . . . 0.70999999999999996 110.592 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.7 t -59.6 -50.78 72.55 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.544 0.611 . . . . 0.75 110.882 176.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.2 m -57.25 -50.89 71.45 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.376 -0.828 . . . . 0.81999999999999995 110.12 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -49.1 -58.57 4.74 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.945 0.898 . . . . 3.0099999999999998 109.951 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -63.15 -45.86 89.93 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 118.552 -0.737 . . . . 5.0800000000000001 111.839 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.6 t -60.58 -44.7 95.92 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.506 1.048 . . . . 2.1600000000000001 110.056 -176.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -61.17 -48.61 80.8 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 121.127 0.489 . . . . 2.6600000000000001 111.02 172.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.2 -22.12 66.82 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 120.953 -1.092 . . . . 1.3100000000000001 112.178 -175.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -79.04 -17.18 55.73 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.665 1.986 . . . . 6.21 112.378 174.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.437 ' HB3' ' HG3' ' A' ' 37' ' ' GLU . 6.4 tp60 -39.74 -55.28 1.96 Allowed 'General case' 0 C--N 1.344 0.335 0 CA-C-N 119.86 1.209 . . . . 2.7999999999999998 111.255 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -145.64 -165.39 2.18 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 123.94 0.896 . . . . 5.3399999999999999 109.471 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -18.28 113.58 0.01 OUTLIER Glycine 0 CA--C 1.527 0.806 0 C-N-CA 128.393 2.901 . . . . 1.8899999999999999 114.37 -166.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? 66.05 106.9 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.48 1.112 . . . . 5.0700000000000003 112.956 173.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.89 -26.11 65.63 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 113.32 0.859 . . . . 7.0499999999999998 113.32 176.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -90.56 9.92 27.56 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.577 0.626 . . . . 4.6399999999999997 111.99 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.6 p -151.35 160.5 43.74 Favored 'General case' 0 C--O 1.24 0.568 0 O-C-N 120.908 -1.12 . . . . 1.97 111.708 174.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.414 HD13 ' CG ' ' A' ' 76' ' ' TYR . 3.8 mp -118.03 127.97 54.32 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 122.678 0.391 . . . . 2.9100000000000001 110.918 -172.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.7 t -81.92 172.46 13.27 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.502 -0.925 . . . . 2.23 108.502 174.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 43.1 t -67.28 -48.75 77.1 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 O-C-N 121.492 -0.755 . . . . 2.9900000000000002 110.36 -168.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -56.99 -52.03 66.87 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 109.473 -0.565 . . . . 2.5499999999999998 109.473 172.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.437 ' HG3' ' HB3' ' A' ' 26' ' ' GLN . 7.2 tt0 -48.71 -49.58 37.3 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.349 1.46 . . . . 2.1000000000000001 110.39 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.564 ' CZ ' HD21 ' A' ' 56' ' ' LEU . 1.9 t80 -59.47 -57.65 12.05 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 124.553 1.141 . . . . 2.7999999999999998 109.932 172.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -52.02 -44.72 64.29 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 117.948 0.34 . . . . 4.7599999999999998 111.78 -174.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -48.58 -37.79 18.93 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.295 0.48 . . . . 2.7400000000000002 112.295 177.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -64.65 -47.27 79.1 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 108.534 -0.913 . . . . 2.23 108.534 -176.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.539 HG21 HD23 ' A' ' 56' ' ' LEU . 28.7 m -71.01 -40.64 76.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 116.287 -0.415 . . . . 1.4199999999999999 110.126 -175.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.8 m -61.5 -42.01 98.14 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.385 0.674 . . . . 1.77 110.88 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -80.63 -55.6 4.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.122 0.569 . . . . 2.1099999999999999 111.478 -171.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -92.97 -122.34 0.09 Allowed 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.303 0.501 . . . . 4.2699999999999996 110.421 177.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.653 ' H ' HD12 ' A' ' 46' ' ' LEU . 6.9 mp 12.81 71.53 0.11 Allowed Pre-proline 0 CA--C 1.545 0.754 0 C-N-CA 129.927 3.291 . . . . 2.4300000000000002 115.502 -174.018 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.59 -52.22 0.6 Allowed 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 123.055 2.504 . . . . 1.6599999999999999 113.263 -177.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 -136.0 61.58 1.64 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.78 0.8 . . . . 3.1299999999999999 110.081 -168.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.674 HD21 ' HB2' ' A' ' 83' ' ' LEU . 5.9 tp -143.94 -118.72 0.09 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.876 -1.056 . . . . 1.8799999999999999 108.477 -164.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 68.2 mt -68.56 77.83 0.28 Allowed 'General case' 0 C--N 1.34 0.164 0 N-CA-C 108.524 -0.917 . . . . 2.7999999999999998 108.524 163.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -66.65 -168.91 0.07 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.43 -0.805 . . . . 5.3300000000000001 110.433 172.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 63.93 37.84 9.19 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 124.698 1.199 . . . . 3.5499999999999998 109.46 178.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -63.02 -22.38 30.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 124.796 1.238 . . . . 2.0800000000000001 111.742 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -49.82 -35.82 24.98 Favored Glycine 0 CA--C 1.532 1.117 0 N-CA-C 111.235 -0.746 . . . . 1.98 111.235 166.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.8 t -108.06 46.59 0.94 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.118 1.367 . . . . 2.4500000000000002 109.55 173.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.564 HD21 ' CZ ' ' A' ' 38' ' ' PHE . 2.4 tm? -55.39 -46.5 76.56 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.077 -1.015 . . . . 1.23 109.342 167.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -62.63 -22.82 66.71 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.355 1.062 . . . . 5.2999999999999998 111.775 -169.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -62.34 -48.73 78.52 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 120.801 -1.187 . . . . 3.27 110.437 166.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.23 -37.78 81.37 Favored 'General case' 0 C--O 1.225 -0.232 0 O-C-N 121.441 -0.787 . . . . 3.25 109.406 174.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.0 ttp -53.33 -53.47 50.53 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 118.952 0.797 . . . . 1.8799999999999999 109.876 173.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -57.21 -41.63 79.81 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 119.207 -0.425 . . . . 3.2599999999999998 112.021 177.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.8 t -55.79 -57.47 11.89 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 118.908 0.776 . . . . 2.2200000000000002 110.159 172.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 40.6 mt -58.97 -53.31 59.87 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.435 1.094 . . . . 1.5600000000000001 110.971 -171.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -68.96 81.05 0.31 Allowed 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 123.66 0.6 . . . . 2.1200000000000001 109.461 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.8 m -47.27 -33.34 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 C-N-CA 124.252 1.021 . . . . 1.8200000000000001 111.722 172.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -92.83 -11.5 33.49 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.636 0.976 . . . . 2.2400000000000002 113.636 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 45.41 59.02 3.79 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.587 1.555 . . . . 3.3999999999999999 111.208 -176.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -77.73 -98.88 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 106.316 -1.735 . . . . 3.29 106.316 164.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.1 m 178.72 44.27 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 130.949 3.699 . . . . 1.8 106.003 162.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.66 109.34 3.45 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 105.792 -1.929 . . . . 4.0099999999999998 105.792 -169.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -84.7 94.75 8.73 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 105.443 -2.058 . . . . 0.90000000000000002 105.443 -176.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.54 151.67 45.87 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 107.858 -1.164 . . . . 3.2400000000000002 107.858 175.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -39.13 -54.11 1.78 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.593 0.96 . . . . 5.8600000000000003 113.593 -171.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -73.35 -26.95 61.24 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.553 0.575 . . . . 1.78 112.553 -176.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.32 -59.65 3.82 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 108.08 -1.082 . . . . 2.1299999999999999 108.08 169.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.414 ' CG ' HD13 ' A' ' 33' ' ' LEU . 56.7 t80 -49.92 -49.53 49.49 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 124.044 0.937 . . . . 3.21 110.463 -177.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 1.3 t-105 -39.61 -42.41 1.18 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 125.266 1.426 . . . . 4.1600000000000001 111.393 -178.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 -49.13 -38.98 26.87 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-O 117.994 -1.003 . . . . 3.7400000000000002 112.102 -178.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 tp -46.43 -48.12 18.87 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 119.088 0.858 . . . . 0.96999999999999997 110.763 178.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.6 mp -60.78 -34.44 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 108.0 -1.111 . . . . 1.8400000000000001 108.0 -177.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.569 ' HA3' ' CE2' ' B' ' 77' ' ' TRP . . . -70.4 -48.45 37.3 Favored Glycine 0 CA--C 1.491 -1.415 0 C-N-CA 124.217 0.913 . . . . 1.26 110.904 -178.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.18 -58.69 7.54 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 104.503 -2.406 . . . . 2.7400000000000002 104.503 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.674 ' HB2' HD21 ' A' ' 49' ' ' LEU 0.26 3.8 pp -56.01 -40.95 74.15 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.703 1.372 . . . . 2.0499999999999998 114.703 177.324 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.79 -23.87 66.49 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 118.793 0.724 . . . . 1.4399999999999999 112.27 174.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -80.91 -44.69 17.9 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 125.415 1.486 . . . . 1.9099999999999999 109.514 168.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.427 ' CD ' ' HZ2' ' A' ' 89' ' ' LYS . 36.7 mm-40 -61.84 -34.21 75.55 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 120.061 1.3 . . . . 2.2400000000000002 111.419 -172.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.4 tt -49.04 -37.7 10.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-N 118.114 0.415 . . . . 1.3700000000000001 111.955 171.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.66 -53.96 4.51 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.246 1.018 . . . . 5.3600000000000003 109.056 176.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.427 ' HZ2' ' CD ' ' A' ' 86' ' ' GLU . 3.1 ttpm? . . . . . 0 N--CA 1.437 -1.122 0 C-N-CA 125.601 1.56 . . . . 3.7200000000000002 112.826 -170.002 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 44.1 mt . . . . . 0 CA--C 1.542 0.659 0 N-CA-C 112.772 0.656 . . . . 2.3399999999999999 112.772 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 10.2 t -89.36 -132.04 0.09 Allowed 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.04 1.336 . . . . 1.8 110.513 171.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -92.44 -59.06 2.17 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.111 1.365 . . . . 2.1099999999999999 114.03 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.5 mt -62.93 -50.33 71.24 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 120.846 -1.159 . . . . 1.0600000000000001 111.482 -173.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . 0.549 ' HG2' HD22 ' A' ' 49' ' ' LEU . 0.0 OUTLIER -88.02 115.22 25.34 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 100.433 -3.914 . . . . 4.8200000000000003 100.433 138.399 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -54.67 -50.98 66.93 Favored 'General case' 0 C--N 1.342 0.271 1 C-N-CA 133.753 4.821 . . . . 3.6800000000000002 118.752 19.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 52.7 p -51.74 -40.05 59.55 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.474 0.916 . . . . 1.45 113.474 -155.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.56 HD12 ' N ' ' B' ' 14' ' ' GLU . 2.7 pp -57.34 -42.68 80.85 Favored 'Isoleucine or valine' 0 C--N 1.339 0.134 0 N-CA-C 112.837 0.68 . . . . 1.03 112.837 174.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . 0.56 ' N ' HD12 ' B' ' 13' ' ' ILE . 1.2 tm-20 -60.2 -50.04 75.22 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.867 -1.16 . . . . 2.4199999999999999 107.867 173.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -50.05 -38.69 39.2 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.526 0.73 . . . . 2.5600000000000001 112.882 -178.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 35.8 m -80.36 -40.54 19.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 O-C-N 121.124 -0.985 . . . . 1.1399999999999999 111.924 171.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 18.0 t -55.22 -43.99 73.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 123.645 0.778 . . . . 1.1200000000000001 111.308 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 10.2 t -57.26 -49.05 77.27 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.233 0.924 . . . . 1.3200000000000001 110.428 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 34.6 m -57.61 -52.68 64.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.753 -0.462 . . . . 1.28 109.753 176.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -46.47 -51.82 14.44 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.407 1.083 . . . . 4.4100000000000001 111.395 174.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -66.18 -53.87 32.11 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.088 0.47 . . . . 3.6699999999999999 109.8 -173.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 1.3 t -64.55 -32.66 74.4 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 122.092 -0.38 . . . . 3.3300000000000001 110.363 -176.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -61.35 -59.03 5.91 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.591 1.157 . . . . 5.6100000000000003 110.238 170.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.48 -22.94 35.8 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 126.638 1.975 . . . . 1.1000000000000001 112.033 -178.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -18.01 22.58 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 117.678 -1.153 . . . . 4.75 113.456 171.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -45.99 -62.37 1.35 Allowed 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.237 1.569 . . . . 2.7000000000000002 115.237 -172.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -73.11 -42.5 62.89 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 116.174 1.916 . . . . 5.2400000000000002 116.174 -152.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -80.35 -88.29 0.55 Allowed Glycine 0 CA--C 1.528 0.874 0 C-N-CA 130.015 3.674 . . . . 2.8199999999999998 115.1 18.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 43.49 72.88 0.16 Allowed 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.864 -0.786 . . . . 4.5899999999999999 109.092 -163.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 61.23 2.31 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.951 1.3 . . . . 5.2400000000000002 111.064 -174.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -168.66 -59.7 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 127.286 2.234 . . . . 4.3899999999999997 106.658 171.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 4.1 p -83.86 149.41 26.39 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.72 -0.673 . . . . 1.8100000000000001 111.164 -174.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -107.12 128.64 54.57 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 107.951 -1.129 . . . . 2.27 107.951 174.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 52.8 m -114.11 174.65 5.84 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 119.335 0.97 . . . . 2.9199999999999999 108.851 166.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 12.7 p -84.88 56.1 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.167 0 O-C-N 120.826 -1.171 . . . . 2.6600000000000001 111.45 -174.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -152.9 55.89 0.78 Allowed 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 123.683 1.706 . . . . 2.1699999999999999 108.24 130.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -141.49 -57.51 0.48 Allowed 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 130.408 3.483 . . . . 1.9399999999999999 101.976 164.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -40.76 -52.82 2.93 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.206 1.003 . . . . 2.5600000000000001 112.616 -177.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -68.19 -28.04 66.93 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.373 0.509 . . . . 2.9100000000000001 112.373 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -66.91 -35.53 80.22 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 121.376 -0.827 . . . . 3.4500000000000002 110.886 -178.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.52 -49.13 70.11 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.324 -0.86 . . . . 2.5699999999999998 109.181 -176.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -62.56 -44.07 99.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 114.957 -1.019 . . . . 0.73999999999999999 109.217 -176.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 99.4 m -57.31 -55.65 32.04 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.583 0.753 . . . . 1.04 111.257 172.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -80.9 -62.61 1.62 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.349 0.66 . . . . 1.97 112.443 -162.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 -82.41 -39.87 22.06 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 121.805 -0.559 . . . . 2.9700000000000002 111.985 -173.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.62 -12.77 0.19 Allowed Pre-proline 0 CA--C 1.544 0.746 1 N-CA-C 121.954 4.057 . . . . 2.1200000000000001 121.954 -153.919 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -49.89 -41.46 47.39 Favored 'Trans proline' 0 CA--C 1.535 0.569 0 C-N-CA 122.726 2.284 . . . . 1.8999999999999999 116.676 -147.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 61.5 t-80 -86.77 50.03 1.93 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 120.795 1.634 . . . . 3.3500000000000001 109.415 -174.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.525 HD23 ' HB2' ' B' ' 83' ' ' LEU . 10.3 tp -151.18 -82.52 0.1 Allowed 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.076 0.55 . . . . 1.03 110.444 -175.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 69.9 mt -80.64 70.95 7.48 Favored 'General case' 0 CA--C 1.522 -0.117 0 N-CA-C 108.501 -0.926 . . . . 1.5900000000000001 108.501 171.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.05 137.53 10.27 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.513 -0.921 . . . . 6.0800000000000001 108.513 155.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 16.2 t0 70.71 79.07 0.18 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 126.021 1.728 . . . . 3.3500000000000001 109.869 -156.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 18.1 m -90.47 6.87 4.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 114.085 -1.416 . . . . 1.52 110.209 160.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -89.16 -65.13 1.27 Allowed Glycine 0 C--N 1.341 0.854 0 N-CA-C 108.123 -1.991 . . . . 2.2999999999999998 108.123 -171.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 13.0 t -78.17 50.04 0.87 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.104 0.961 . . . . 2.6499999999999999 108.493 172.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.68 -41.47 99.12 Favored 'General case' 0 N--CA 1.445 -0.681 0 O-C-N 120.469 -1.394 . . . . 1.1599999999999999 108.214 171.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -32.33 71.39 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.689 1.596 . . . . 4.3499999999999996 110.338 -170.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -56.8 -55.73 30.63 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.646 1.179 . . . . 2.3799999999999999 110.615 167.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.17 -48.52 73.66 Favored 'General case' 0 C--N 1.343 0.295 0 N-CA-C 108.184 -1.043 . . . . 3.9399999999999999 108.184 177.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -48.88 -51.01 32.17 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 123.576 0.75 . . . . 1.77 110.411 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -49.28 -46.76 46.8 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.379 0.671 . . . . 3.3999999999999999 111.494 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 10.0 t -71.16 -39.22 72.03 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.95 0.5 . . . . 2.1400000000000001 111.417 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 41.0 mt -68.63 -46.66 68.62 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.583 1.153 . . . . 1.6299999999999999 110.826 -174.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -61.46 -10.31 7.39 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.694 2.398 . . . . 1.6399999999999999 115.989 -173.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 1.1 p -33.49 -18.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.529 1 C-N-CA 132.607 4.363 . . . . 2.8199999999999998 119.956 -141.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.33 -38.3 41.14 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 120.053 1.297 . . . . 3.2400000000000002 109.476 156.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 70.94 67.68 0.17 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 126.626 1.97 . . . . 3.27 109.303 -177.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 16.5 p30 -126.97 -13.66 5.7 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.463 1.905 . . . . 1.97 113.525 -174.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 4.5 m 88.53 -10.0 0.48 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 127.203 2.201 . . . . 2.2200000000000002 114.061 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -111.57 115.04 28.51 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 119.346 0.975 . . . . 3.3199999999999998 108.922 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.73 97.53 9.18 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 106.016 -1.846 . . . . 1.3500000000000001 106.016 173.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -82.95 178.28 8.23 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.71 0.686 . . . . 4.2800000000000002 110.67 -178.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 42.3 p90 -82.8 52.56 2.16 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 114.066 1.136 . . . . 5.5599999999999996 114.066 -166.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -162.69 47.35 0.15 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.465 -1.309 . . . . 2.3700000000000001 107.465 126.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -96.18 -63.79 1.11 Allowed 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 120.046 -1.658 . . . . 2.0699999999999998 109.057 153.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -50.12 -43.63 51.89 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 125.992 1.717 . . . . 3.48 110.543 -175.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 7.7 t-105 -41.78 -43.55 2.97 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.943 0.897 . . . . 4.5999999999999996 111.637 176.24 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 21.6 mtt180 -45.53 -44.57 12.76 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.615 0.643 . . . . 4.1600000000000001 111.382 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.0 tp -53.72 -39.47 65.27 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.337 0.655 . . . . 0.87 111.39 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 62.5 mt -65.28 -32.73 59.52 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 N-CA-C 106.688 -1.597 . . . . 1.3600000000000001 106.688 -177.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.559 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -69.22 -44.95 63.47 Favored Glycine 0 CA--C 1.496 -1.152 0 N-CA-C 110.297 -1.121 . . . . 1.45 110.297 -178.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . 0.442 ' OE2' ' NZ ' ' B' ' 85' ' ' LYS . 3.2 mm-40 -66.17 -62.27 1.58 Allowed 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 106.867 -1.531 . . . . 2.1800000000000002 106.867 -179.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.525 ' HB2' HD23 ' B' ' 49' ' ' LEU . 3.7 pp -54.42 -37.06 64.66 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.466 1.03 . . . . 1.76 112.452 -178.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.69 -61.44 2.62 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.549 0.613 . . . . 2.02 109.869 173.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . 0.442 ' NZ ' ' OE2' ' B' ' 82' ' ' GLU . 2.1 ptpp? -66.73 -23.76 66.14 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 118.037 -0.982 . . . . 1.45 111.789 -173.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -53.11 -25.67 13.88 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.993 1.717 . . . . 3.0800000000000001 111.656 173.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 3.8 tt -59.57 -36.27 64.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 CA-C-N 118.709 0.686 . . . . 1.01 110.447 172.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 -82.91 -48.23 10.93 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.801 1.641 . . . . 4.0300000000000002 112.011 169.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 43.5 tttm . . . . . 0 CA--C 1.536 0.405 0 C-N-CA 125.934 1.694 . . . . 6.5099999999999998 112.043 -159.341 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 . . . . . 0 CA--C 1.542 0.638 0 N-CA-C 109.955 -0.387 . . . . 7.9400000000000004 109.955 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -82.5 -13.93 9.47 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.964 2.443 . . . . 7.4400000000000004 113.291 -173.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 58.5 mt -72.23 134.8 45.82 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.38 0.672 . . . . 2.2799999999999998 110.737 -162.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.6 t -63.52 -61.65 2.19 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.916 0.886 . . . . 3.6200000000000001 112.062 -170.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -177.97 -75.32 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 126.253 1.821 . . . . 3.3100000000000001 106.475 -175.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.06 -42.93 40.26 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.471 0.708 . . . . 1.25 111.154 171.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -49.64 -44.0 47.26 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.586 1.154 . . . . 2.2400000000000002 112.497 174.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -54.59 -49.55 70.14 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.982 0.81 . . . . 3.8100000000000001 109.229 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.3 t -63.78 -54.2 38.94 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.762 -0.654 . . . . 2.2599999999999998 109.812 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.515 HG21 HD12 ' B' ' 83' ' ' LEU 0.352 2.8 pp -62.81 -34.6 66.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 C-N-CA 118.503 -1.279 . . . . 0.79000000000000004 112.562 -178.042 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -61.06 -56.64 18.66 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 119.352 0.978 . . . . 2.8599999999999999 108.95 173.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.88 -39.31 65.6 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.878 0.847 . . . . 1.3899999999999999 111.556 -171.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.8 m -75.23 -37.43 39.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 120.798 -1.189 . . . . 0.90000000000000002 111.815 175.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 28.3 t -58.66 -48.68 85.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 119.808 1.186 . . . . 0.88 110.803 174.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -59.52 -38.32 80.67 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.853 -1.154 . . . . 0.98999999999999999 110.347 175.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.0 m -56.14 -49.82 72.85 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 118.669 0.668 . . . . 1.02 110.115 171.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -50.99 -52.7 40.11 Favored 'General case' 0 C--N 1.342 0.276 0 CA-C-N 118.613 0.642 . . . . 5.0099999999999998 109.805 176.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -55.94 -58.21 8.83 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.199 0.444 . . . . 3.4900000000000002 112.199 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -65.07 -24.31 67.42 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 121.152 0.501 . . . . 2.3799999999999999 111.397 -175.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.512 ' CZ ' ' HB2' ' A' ' 41' ' ' LEU . 8.1 t80 -80.55 -51.77 8.38 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 124.271 1.028 . . . . 4.5499999999999998 112.711 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.7 -22.89 65.73 Favored 'General case' 0 C--O 1.24 0.59 0 C-N-CA 126.352 1.861 . . . . 1.52 113.065 -166.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -69.12 -19.8 64.04 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.215 1.406 . . . . 4.6900000000000004 112.385 175.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -41.9 -62.19 0.96 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.396 0.998 . . . . 2.8199999999999998 113.041 -172.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -127.37 106.8 9.45 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 126.495 1.918 . . . . 3.8599999999999999 105.93 -175.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 62.56 118.11 0.01 OUTLIER Glycine 0 CA--C 1.534 1.269 0 CA-C-N 118.822 0.737 . . . . 2.3999999999999999 113.763 169.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.0 ttm180 63.41 102.85 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 121.794 0.806 . . . . 4.8899999999999997 113.006 162.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt -73.06 59.96 0.54 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.219 1.007 . . . . 5.9299999999999997 112.845 -177.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -156.19 -62.76 0.11 Allowed 'General case' 0 C--O 1.231 0.091 0 C-N-CA 128.023 2.529 . . . . 3.6899999999999999 106.404 177.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.0 p -84.13 135.55 34.34 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 123.666 0.786 . . . . 2.1200000000000001 110.993 -174.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -88.93 143.6 26.76 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.418 -0.956 . . . . 2.4500000000000002 108.418 168.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.9 m -111.9 175.86 5.26 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.349 0.659 . . . . 2.0499999999999998 109.952 168.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.9 p -57.05 -50.22 77.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 N-CA-C 114.008 1.114 . . . . 3.0899999999999999 114.008 -164.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -64.94 -50.41 66.54 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 118.697 0.68 . . . . 3.1899999999999999 109.184 -177.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -37.02 -57.85 0.81 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.149 1.38 . . . . 2.2799999999999998 110.097 166.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.49 -55.6 23.99 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 121.917 -0.489 . . . . 3.1200000000000001 110.75 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -55.84 -41.94 75.05 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 120.658 -0.417 . . . . 4.2199999999999998 111.505 -177.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -49.94 -44.09 50.34 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 118.159 0.436 . . . . 2.8999999999999999 111.022 177.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.512 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 9.6 tp -66.47 -47.58 72.63 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.831 0.741 . . . . 2.73 109.323 -173.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 23.3 m -74.12 -29.13 24.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-N 115.041 -0.981 . . . . 1.6599999999999999 109.951 -171.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 84.8 m -78.05 -47.04 19.27 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.712 0.805 . . . . 2.3599999999999999 110.263 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -81.39 -59.95 2.44 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.373 1.069 . . . . 2.79 111.93 -171.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.459 HE21 HD12 ' A' ' 41' ' ' LEU . 3.3 mp0 -76.8 -51.8 10.69 Favored 'General case' 0 C--N 1.338 0.083 0 O-C-N 122.101 -0.375 . . . . 4.4100000000000001 110.206 -169.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 mp -81.69 114.44 50.04 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 124.846 1.258 . . . . 1.9299999999999999 110.033 -171.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -84.79 -58.96 0.02 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 122.965 2.444 . . . . 2.1099999999999999 110.304 -174.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -141.26 9.03 2.06 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.068 0.947 . . . . 4.4900000000000002 113.442 -168.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.4 tp -55.68 -78.88 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 122.073 0.939 . . . . 1.8700000000000001 109.348 171.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.6 mt -79.4 -55.88 4.74 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.539 -0.912 . . . . 3.6899999999999999 108.539 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 39.79 38.14 0.41 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.467 1.907 . . . . 5.4900000000000002 112.331 -168.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 62.2 t0 -108.37 12.51 26.28 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 130.137 3.375 . . . . 6.1500000000000004 108.616 -175.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 18.8 m -66.25 -22.43 30.2 Favored 'Isoleucine or valine' 0 C--N 1.341 0.207 0 C-N-CA 124.738 1.215 . . . . 2.2799999999999998 112.172 -171.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.6 -32.55 46.63 Favored Glycine 0 CA--C 1.529 0.967 0 N-CA-C 111.009 -0.836 . . . . 3.3300000000000001 111.009 169.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 18.7 m -124.22 60.42 1.14 Allowed 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.186 0.994 . . . . 3.0600000000000001 108.928 178.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -74.37 -38.65 63.12 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.792 1.237 . . . . 1.77 110.172 176.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -54.51 -50.84 66.88 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.406 0.682 . . . . 4.3700000000000001 111.415 -173.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -57.21 -41.44 79.42 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 121.897 -0.502 . . . . 2.7999999999999998 111.713 177.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.04 -59.33 5.44 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.36 -0.978 . . . . 2.6099999999999999 108.36 173.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -46.84 -51.48 16.5 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.202 0.601 . . . . 1.52 111.001 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -56.99 -47.6 80.42 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.665 0.786 . . . . 3.3300000000000001 110.72 177.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 45.6 m -59.62 -39.67 85.06 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 122.195 -0.316 . . . . 1.8500000000000001 111.419 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -69.81 -49.43 52.83 Favored 'General case' 0 CA--C 1.53 0.18 0 O-C-N 121.933 -0.479 . . . . 1.79 110.812 176.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -76.85 62.28 2.04 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.661 0.784 . . . . 1.8200000000000001 110.043 -176.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.6 m -56.78 -31.32 35.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 124.698 1.199 . . . . 1.78 112.194 -176.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -88.8 -3.0 58.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.558 1.543 . . . . 2.5800000000000001 112.057 178.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 54.87 63.35 2.16 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 125.6 1.56 . . . . 4.21 111.982 165.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.3 p30 -130.41 -1.77 4.42 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.784 1.234 . . . . 2.2000000000000002 112.894 -173.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.2 p 64.3 12.67 7.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.231 1.812 . . . . 2.98 114.062 -175.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -113.37 106.47 14.63 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.614 1.565 . . . . 3.27 108.377 169.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.14 81.78 7.25 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 103.414 -2.81 . . . . 1.1100000000000001 103.414 167.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.3 ttmt -67.37 161.15 25.81 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.638 0.775 . . . . 4.4400000000000004 108.985 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -38.65 -53.57 1.61 Allowed 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.309 1.226 . . . . 5.79 114.309 -169.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -65.06 -40.22 94.4 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 121.53 -0.731 . . . . 2.2799999999999998 112.637 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -63.8 -52.73 58.92 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.805 -1.183 . . . . 1.99 107.805 178.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -52.13 -45.59 65.03 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.55 0.74 . . . . 3.1200000000000001 110.704 176.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.454 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.4 OUTLIER -40.29 -45.1 2.04 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-O 117.364 -1.303 . . . . 5.25 110.382 173.59 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -39.36 -46.34 1.59 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 120.753 1.615 . . . . 5.4500000000000002 111.776 -178.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.2 tp -56.25 -45.14 80.17 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.016 0.826 . . . . 0.96999999999999997 112.989 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.1 mt -69.44 -40.78 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 C-N-CA 125.155 1.382 . . . . 2.29 108.18 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.437 ' HA3' ' CZ2' ' B' ' 77' ' ' TRP . . . -44.45 -57.99 4.82 Favored Glycine 0 N--CA 1.436 -1.337 0 N-CA-C 109.529 -1.428 . . . . 2.1400000000000001 109.529 172.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -66.57 -50.97 61.37 Favored 'General case' 0 N--CA 1.435 -1.213 0 CA-C-N 112.134 -2.033 . . . . 2.7999999999999998 107.751 -174.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.1 tp -37.26 -53.88 1.06 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.297 1.839 . . . . 3.0600000000000001 111.747 -178.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.02 -34.02 65.46 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.976 0.911 . . . . 1.8300000000000001 112.802 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -81.84 -48.18 11.9 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.119 0.968 . . . . 2.1899999999999999 111.637 170.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.25 -26.52 66.5 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 123.743 0.817 . . . . 4.0800000000000001 112.909 -170.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.6 tp -36.79 -47.27 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 123.5 0.72 . . . . 1.5600000000000001 111.046 165.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.52 -51.54 6.81 Favored 'General case' 0 C--N 1.345 0.382 0 O-C-N 121.472 -0.767 . . . . 5.0300000000000002 109.979 170.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.3 tttt . . . . . 0 CA--C 1.538 0.503 0 C-N-CA 125.148 1.379 . . . . 3.6600000000000001 112.177 -170.341 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.428 ' HB2' ' HB3' ' B' ' 10' ' ' GLU . 0.7 OUTLIER . . . . . 0 N--CA 1.447 -0.597 0 N-CA-C 109.723 -0.473 . . . . 3.7599999999999998 109.723 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.406 HG22 ' HB2' ' B' ' 10' ' ' GLU . 10.7 t -75.33 -166.24 0.5 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.03 0.932 . . . . 2.0800000000000001 111.907 -172.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -73.82 -60.17 2.38 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.049 -0.407 . . . . 2.8199999999999998 111.091 -171.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mt -47.59 -45.75 27.59 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.169 -0.957 . . . . 1.3300000000000001 110.363 172.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . 0.428 ' HB3' ' HB2' ' B' ' 6' ' ' LEU . 2.0 tt0 -48.71 -58.78 4.23 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 126.043 1.737 . . . . 3.2200000000000002 112.981 170.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.22 -36.9 83.38 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 120.863 -1.148 . . . . 5.1100000000000003 109.204 -176.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 15.8 m -63.17 -37.07 85.77 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.925 0.49 . . . . 2.2200000000000002 111.329 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.335 2.9 pp -70.51 -38.99 75.62 Favored 'Isoleucine or valine' 0 C--N 1.343 0.292 0 CA-C-N 118.691 0.678 . . . . 1.53 111.428 167.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -55.33 -52.18 64.34 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.421 1.01 . . . . 3.6800000000000002 110.76 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 11.9 t -55.02 -39.63 69.33 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.42 0.629 . . . . 1.78 111.66 -176.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 25.6 m -77.61 -34.8 20.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 120.713 -1.242 . . . . 1.3899999999999999 110.781 177.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 45.3 t -59.22 -45.54 92.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-N 119.167 0.894 . . . . 1.27 110.366 173.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.2 t -65.59 -42.41 91.73 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.711 0.687 . . . . 1.6000000000000001 110.412 177.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 34.9 m -55.46 -47.34 76.23 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.089 0.859 . . . . 1.3 110.282 174.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -53.44 -56.43 16.93 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.157 -0.965 . . . . 3.7999999999999998 110.173 172.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -49.52 -51.07 38.98 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.498 1.519 . . . . 3.6200000000000001 111.585 -177.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 32.5 p -64.07 -28.59 69.89 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.184 -0.436 . . . . 2.2999999999999998 111.736 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -82.17 -34.5 29.04 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-N 118.665 0.666 . . . . 2.98 111.791 170.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.54 -39.48 73.45 Favored 'General case' 0 C--O 1.239 0.531 0 O-C-N 120.949 -1.094 . . . . 1.03 110.475 -172.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 5.2 ptt180 -53.97 -44.09 70.5 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.626 -0.715 . . . . 4.2199999999999998 111.755 174.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.428 ' CB ' ' HG2' ' B' ' 37' ' ' GLU . 0.5 OUTLIER -41.62 -66.24 0.36 Allowed 'General case' 0 N--CA 1.443 -0.792 0 O-C-N 124.249 0.968 . . . . 2.0499999999999998 113.012 -126.572 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -96.92 -72.84 0.62 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 124.13 1.919 . . . . 6.0899999999999999 112.385 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.44 80.63 1.51 Allowed Glycine 0 N--CA 1.439 -1.109 0 CA-C-N 112.076 -2.329 . . . . 2.6899999999999999 109.579 -171.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 15.2 ttt180 71.44 111.93 0.06 Allowed 'General case' 0 C--O 1.241 0.647 0 CA-C-N 120.725 2.262 . . . . 6.0899999999999999 114.026 159.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -66.98 64.37 0.05 Allowed 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.886 -1.134 . . . . 4.0 111.727 172.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -132.48 -65.77 0.71 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 125.374 1.47 . . . . 4.96 107.261 172.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 50.0 m -113.93 159.83 19.46 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.18 -0.918 . . . . 2.2599999999999998 110.812 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 10.5 mp -98.73 123.27 42.85 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.518 1.127 . . . . 2.1600000000000001 109.036 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 1.1 t -94.87 176.77 6.13 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.509 1.123 . . . . 3.04 109.377 173.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 23.3 m -88.55 52.94 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 O-C-N 120.655 -1.278 . . . . 2.8900000000000001 112.012 -178.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -157.54 58.11 0.5 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 106.103 -1.814 . . . . 2.54 106.103 143.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.428 ' HG2' ' CB ' ' B' ' 26' ' ' GLN . 50.4 mt-10 -163.34 -57.21 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 129.578 3.151 . . . . 2.21 103.167 -176.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.439 ' CZ ' HD13 ' B' ' 63' ' ' LEU . 4.2 t80 -62.01 -59.94 4.34 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.377 -1.283 . . . . 2.2599999999999998 109.456 171.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -56.82 -40.88 76.8 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 120.27 -0.572 . . . . 3.5699999999999998 110.749 -174.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -50.7 -41.27 55.85 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.188 0.305 . . . . 2.6400000000000001 111.437 175.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.18 -55.96 26.26 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.674 -1.232 . . . . 2.4199999999999999 107.674 -175.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.2 m -67.94 -44.26 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.674 -0.693 . . . . 0.95999999999999996 109.574 -170.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 87.5 m -62.86 -47.61 82.63 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 124.061 0.945 . . . . 1.5800000000000001 110.243 -178.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -80.62 -55.79 4.61 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.085 0.402 . . . . 2.9199999999999999 112.085 -173.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -81.19 -41.83 21.74 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 113.798 1.036 . . . . 2.9500000000000002 113.798 -158.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -62.03 -28.76 4.16 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.186 0.81 . . . . 1.8999999999999999 113.186 -156.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -57.27 -24.55 60.27 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.132 -2.445 . . . . 2.1400000000000001 111.342 -78.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -91.52 -33.24 15.25 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.899 1.679 . . . . 2.9300000000000002 110.653 -175.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 42.8 tp -58.61 -56.4 22.68 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.507 0.323 . . . . 1.3200000000000001 111.449 -165.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 30.2 mt -87.24 162.69 17.3 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 108.404 -0.962 . . . . 1.97 108.404 161.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.29 170.92 14.75 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 107.557 -1.275 . . . . 4.9400000000000004 107.557 165.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 18.7 t0 55.15 72.63 0.46 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 123.393 1.568 . . . . 4.2000000000000002 109.25 -161.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 28.0 m -87.7 22.21 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 112.643 -2.071 . . . . 1.9299999999999999 109.786 160.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -103.59 -70.74 0.84 Allowed Glycine 0 C--N 1.342 0.89 0 N-CA-C 108.81 -1.716 . . . . 2.6099999999999999 108.81 -177.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 46.7 t -79.02 50.2 1.01 Allowed 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.619 1.167 . . . . 3.2999999999999998 109.677 178.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -50.94 -41.65 59.16 Favored 'General case' 0 N--CA 1.444 -0.752 0 C-N-CA 125.679 1.592 . . . . 1.4399999999999999 109.066 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -30.47 -48.18 0.1 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 127.743 2.417 . . . . 4.1399999999999997 113.526 170.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -60.35 -54.55 44.33 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.309 0.576 . . . . 2.8500000000000001 110.28 178.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . 0.422 ' HE3' ' H ' ' B' ' 59' ' ' LYS . 0.0 OUTLIER -58.3 -54.29 48.68 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.115 -1.439 . . . . 4.2400000000000002 107.115 -179.547 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -45.51 -55.05 6.64 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.863 1.265 . . . . 1.76 110.635 178.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -64.43 -39.82 94.56 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.268 0.485 . . . . 3.1400000000000001 110.855 -177.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.4 t -63.89 -30.23 71.33 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 122.833 0.453 . . . . 1.5700000000000001 111.791 175.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.439 HD13 ' CZ ' ' B' ' 38' ' ' PHE . 36.6 mt -80.13 -53.91 6.25 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.595 1.158 . . . . 1.3300000000000001 110.809 -178.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.261 16.8 t0 -54.63 -8.47 0.24 Allowed 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 128.531 2.732 . . . . 1.75 117.324 -168.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.8 m -34.17 -20.14 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 130.706 3.602 . . . . 1.9199999999999999 119.762 -134.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -60.35 -25.16 65.64 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 121.281 1.855 . . . . 3.6899999999999999 111.043 161.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 62.33 64.12 0.98 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.939 1.695 . . . . 3.4700000000000002 109.908 176.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 39.4 p30 -104.33 -27.42 11.99 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.029 1.332 . . . . 2.5600000000000001 111.546 176.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 35.0 m 111.35 -21.06 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.337 3.055 . . . . 2.3100000000000001 111.926 -174.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -113.18 114.8 27.27 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 125.882 1.673 . . . . 6.1399999999999997 108.566 -168.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -83.16 104.56 13.44 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.76 1.224 . . . . 1.4199999999999999 108.336 -176.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -84.28 174.32 10.25 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 127.462 2.305 . . . . 5.3600000000000003 112.339 -165.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -80.42 55.2 2.21 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.512 0.725 . . . . 5.5 109.782 167.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -167.53 46.68 0.05 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 120.316 -0.554 . . . . 4.7599999999999998 111.067 102.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 69.2 mt-10 -91.33 -60.09 1.98 Allowed 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.473 1.509 . . . . 2.1800000000000002 108.577 162.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -45.2 -41.48 8.31 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 125.011 1.324 . . . . 3.5600000000000001 111.707 -175.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.461 ' C ' ' CD1' ' B' ' 77' ' ' TRP . 1.4 t90 -39.5 -48.93 2.07 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 124.527 1.142 . . . . 4.5199999999999996 109.312 178.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 48.6 mtp85 -42.58 -36.93 1.51 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.197 0.908 . . . . 4.3200000000000003 113.15 -176.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.1 tp -63.69 -45.26 90.83 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.829 1.195 . . . . 0.93000000000000005 111.177 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 8.2 pt -77.74 -31.52 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 C-N-CA 124.216 1.006 . . . . 3.6299999999999999 108.664 -177.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -46.83 -59.27 5.62 Favored Glycine 0 N--CA 1.433 -1.563 0 N-CA-C 108.461 -1.856 . . . . 1.78 108.461 165.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -74.51 -53.97 8.43 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 113.531 -1.334 . . . . 2.8700000000000001 110.916 -169.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.515 HD12 HG21 ' A' ' 13' ' ' ILE 0.292 4.5 pp -50.6 -29.28 10.5 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 121.116 1.78 . . . . 1.8500000000000001 113.157 -175.892 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.63 -46.63 77.39 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.761 0.652 . . . . 1.1399999999999999 112.761 168.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -77.45 -35.21 54.13 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 117.871 -1.062 . . . . 2.04 112.281 172.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -52.99 -31.92 43.47 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 120.753 1.615 . . . . 3.2200000000000002 112.17 -172.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 9.2 tt -43.34 -46.44 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 123.16 0.584 . . . . 1.52 111.61 170.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 9.5 ptm85 -85.55 -49.51 7.98 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.326 1.45 . . . . 3.8100000000000001 113.699 168.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 23.4 tttm . . . . . 0 CA--C 1.531 0.247 0 O-C-N 121.128 -0.983 . . . . 6.9100000000000001 111.659 -174.558 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 . . . . . 0 N--CA 1.451 -0.385 0 N-CA-C 109.031 -0.729 . . . . 4.9299999999999997 109.031 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -72.06 154.46 57.56 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 122.174 1.916 . . . . 2.1299999999999999 108.754 175.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 73.6 mt -109.33 169.68 8.54 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.187 0.995 . . . . 1.3200000000000001 108.577 -174.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.5 t -75.18 159.97 30.97 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 120.885 -1.134 . . . . 1.75 110.504 -176.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -46.45 -56.85 5.32 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.193 -0.942 . . . . 2.79 113.164 -175.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 mt -61.08 -44.44 97.37 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.532 -0.747 . . . . 1.5700000000000001 111.085 -178.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -54.36 -53.14 57.9 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.536 2.334 . . . . 2.6600000000000001 112.208 173.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -53.26 -55.7 22.43 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.406 1.082 . . . . 3.5800000000000001 109.274 172.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.0 t -53.08 -51.84 60.54 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.581 0.752 . . . . 1.72 112.076 -178.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.4 pp -65.56 -39.32 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-O 118.472 -0.775 . . . . 0.68000000000000005 110.155 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -56.06 -58.08 9.42 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 119.138 0.881 . . . . 2.4500000000000002 109.653 177.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.2 t -54.7 -40.86 69.59 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.351 0.596 . . . . 1.25 111.726 -172.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.4 m -74.28 -35.54 40.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 O-C-N 120.929 -1.107 . . . . 0.60999999999999999 111.401 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 37.4 t -60.6 -48.4 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 119.285 0.948 . . . . 0.52000000000000002 110.114 175.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.1 t -62.52 -42.08 99.27 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.077 0.853 . . . . 0.68000000000000005 110.623 177.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 48.4 m -57.52 -53.45 57.98 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 118.736 0.698 . . . . 0.72999999999999998 110.226 176.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -45.61 -54.1 8.18 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.109 0.964 . . . . 3.02 109.98 171.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -60.93 -50.19 74.39 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.578 0.751 . . . . 3.21 111.772 -173.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.0 t -63.94 -30.8 71.85 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.95 -0.469 . . . . 1.9399999999999999 110.836 -178.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -69.71 -42.64 73.75 Favored 'General case' 0 C--O 1.221 -0.406 0 O-C-N 121.631 -0.668 . . . . 2.8100000000000001 111.13 166.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.81 -22.48 66.93 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 125.259 1.423 . . . . 0.76000000000000001 112.747 -170.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.253 0.0 OUTLIER -80.66 -15.73 55.82 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 117.112 -1.423 . . . . 4.0800000000000001 113.543 175.046 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.69 -66.09 0.33 Allowed 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 120.071 1.305 . . . . 2.21 112.595 178.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -117.44 172.73 7.14 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 126.621 1.968 . . . . 2.4700000000000002 107.219 -173.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -3.52 112.5 0.01 OUTLIER Glycine 0 CA--C 1.531 1.059 0 C-N-CA 127.906 2.67 . . . . 1.6200000000000001 114.454 172.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.5 mtp180 62.99 106.54 0.03 OUTLIER 'General case' 0 C--O 1.236 0.387 0 N-CA-C 114.309 1.226 . . . . 6.0899999999999999 114.309 175.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 51.56 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.835 1.654 . . . . 4.6699999999999999 112.263 157.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -148.14 -53.13 0.19 Allowed 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 125.746 1.618 . . . . 3.9900000000000002 107.505 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -118.96 162.71 18.07 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 124.533 1.133 . . . . 1.6499999999999999 111.339 -175.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 mp -112.92 170.17 8.39 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 124.547 1.139 . . . . 2.3599999999999999 110.461 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.6 t -153.77 179.48 8.82 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.991 1.716 . . . . 3.3300000000000001 106.794 175.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.7 t -37.28 -62.85 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 125.768 1.627 . . . . 2.46 113.619 -166.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -66.2 -56.29 12.05 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.647 0.658 . . . . 2.1800000000000002 109.951 -174.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -38.84 -45.89 1.22 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.238 1.415 . . . . 1.72 112.704 171.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -67.53 -58.02 5.45 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 122.996 0.519 . . . . 2.7599999999999998 110.304 176.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -54.17 -39.98 67.1 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.071 0.396 . . . . 2.8399999999999999 111.11 -174.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -47.76 -40.43 20.65 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 112.741 0.645 . . . . 3.0299999999999998 112.741 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 tp -66.22 -45.92 79.01 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-N 119.404 1.002 . . . . 2.6299999999999999 108.787 -175.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.8 m -68.15 -53.6 28.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 N-CA-C 108.66 -0.867 . . . . 1.3500000000000001 108.66 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 93.9 m -53.08 -48.9 67.39 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.983 0.913 . . . . 1.23 111.983 179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -80.39 -52.88 7.16 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.751 0.42 . . . . 2.0299999999999998 111.433 -174.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -106.0 6.55 31.36 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.523 1.129 . . . . 3.3900000000000001 113.087 -162.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 tp -136.28 84.03 30.7 Favored Pre-proline 0 CA--C 1.537 0.457 0 O-C-N 121.079 -1.013 . . . . 1.96 108.36 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.07 -29.23 48.49 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.431 2.088 . . . . 2.3500000000000001 111.696 -170.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -141.22 -99.52 0.14 Allowed 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 118.901 -0.571 . . . . 3.8599999999999999 109.556 173.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.466 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 5.8 tp 51.39 -87.99 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.785 1.634 . . . . 1.5 113.127 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.4 mt -73.62 -29.52 62.41 Favored 'General case' 0 N--CA 1.458 -0.034 0 C-N-CA 125.743 1.617 . . . . 3.1000000000000001 110.66 177.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 49.4 -173.26 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.948 2.099 . . . . 6.6399999999999997 113.057 -179.097 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 46.64 42.59 11.6 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 125.958 1.703 . . . . 6.4100000000000001 111.482 170.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -61.74 2.08 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 127.985 2.514 . . . . 2.54 113.613 -177.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.17 -70.15 0.97 Allowed Glycine 0 CA--C 1.53 1.0 0 N-CA-C 109.502 -1.439 . . . . 1.74 109.502 164.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -81.9 63.81 6.31 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 122.664 1.221 . . . . 1.97 110.156 -174.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -73.23 -28.93 62.44 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 124.553 1.141 . . . . 1.6200000000000001 109.706 175.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 29.7 p-10 -42.02 -52.89 4.08 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.537 1.535 . . . . 4.7599999999999998 112.371 173.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -49.2 -50.75 36.81 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.647 0.779 . . . . 4.2699999999999996 110.082 176.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.45 -47.53 75.84 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.8 -0.444 . . . . 3.1200000000000001 109.8 -177.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 16.2 tmm? -52.41 -43.69 64.95 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 123.284 0.634 . . . . 3.2799999999999998 109.466 176.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.6 tptt -70.17 -38.32 75.38 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 122.663 0.385 . . . . 4.8899999999999997 111.658 178.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.2 m -58.97 -34.87 72.3 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.807 0.443 . . . . 2.4399999999999999 110.443 172.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 83.8 mt -69.37 -78.27 0.07 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 109.433 -0.58 . . . . 2.3999999999999999 109.433 168.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.62 80.13 4.1 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 122.012 0.91 . . . . 2.5499999999999998 110.443 -178.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.2 m -65.19 -19.16 25.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-N 115.617 -0.72 . . . . 3.5899999999999999 111.318 165.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -69.42 -58.36 4.09 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 118.92 -0.562 . . . . 4.0199999999999996 112.232 -168.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 121.85 -35.39 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 130.503 3.521 . . . . 3.9900000000000002 110.322 -167.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . 0.434 ' C ' ' H ' ' A' ' 70' ' ' GLU . 4.0 p-10 -62.54 99.99 0.17 Allowed 'General case' 0 C--N 1.347 0.464 0 N-CA-C 105.711 -1.959 . . . . 4.2199999999999998 105.711 169.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.0 m -78.94 36.15 0.27 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.222 1.409 . . . . 2.8300000000000001 111.664 -166.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . 0.434 ' H ' ' C ' ' A' ' 68' ' ' ASP . 12.1 mp0 -121.27 121.11 37.0 Favored 'General case' 0 N--CA 1.426 -1.656 0 C-N-CA 131.647 3.979 . . . . 5.9199999999999999 102.898 -178.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -93.15 101.25 13.54 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 106.734 -1.58 . . . . 0.97999999999999998 106.734 -177.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.95 160.05 15.67 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.51 1.124 . . . . 3.7200000000000002 108.575 169.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -40.45 -60.02 1.2 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.587 1.155 . . . . 5.2699999999999996 111.667 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -69.14 -25.7 64.51 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.565 0.746 . . . . 1.74 112.036 -176.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -68.04 -59.61 3.12 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 108.497 -0.927 . . . . 1.9299999999999999 108.497 172.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -55.44 -43.11 75.09 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.643 0.377 . . . . 3.1800000000000002 110.496 -175.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 8.2 t-105 -39.97 -37.2 0.55 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.688 1.195 . . . . 4.1699999999999999 112.171 173.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 44.2 mtt180 -39.49 -48.0 1.93 Allowed 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 120.302 1.41 . . . . 3.8399999999999999 112.12 173.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.7 tp -51.52 -38.85 56.08 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.703 0.801 . . . . 0.96999999999999997 111.492 -178.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 84.5 mt -67.05 -32.19 56.76 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 108.269 -1.011 . . . . 1.9399999999999999 108.269 -176.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.556 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -69.61 -46.19 55.76 Favored Glycine 0 CA--C 1.485 -1.822 0 N-CA-C 110.025 -1.23 . . . . 1.24 110.025 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -61.79 -57.2 12.77 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 105.716 -1.957 . . . . 2.4100000000000001 105.716 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.466 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 4.4 mp -38.39 -59.99 0.84 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 120.074 1.307 . . . . 2.75 112.339 172.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.46 -28.13 69.6 Favored 'General case' 0 C--O 1.225 -0.231 0 N-CA-C 113.153 0.798 . . . . 1.28 113.153 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.0 ttmt -81.45 -62.4 1.66 Allowed 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.814 1.246 . . . . 1.5600000000000001 110.522 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -39.85 -49.5 2.39 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 126.489 1.915 . . . . 2.4399999999999999 110.536 -174.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.513 HG21 HG21 ' B' ' 17' ' ' VAL . 12.2 tt -37.12 -43.71 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 125.513 1.525 . . . . 1.1899999999999999 113.128 177.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.31 67.36 1.08 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.392 1.077 . . . . 6.6600000000000001 109.86 165.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 84.6 tttt . . . . . 0 C--N 1.327 -0.384 0 C-N-CA 124.389 1.075 . . . . 4.25 109.252 170.753 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 46.7 mt . . . . . 0 CA--C 1.539 0.545 0 N-CA-C 111.536 0.198 . . . . 2.9199999999999999 111.536 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.494 HG23 ' N ' ' B' ' 8' ' ' GLU . 6.1 t -76.27 -68.52 0.58 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.38 1.472 . . . . 2.7200000000000002 114.276 178.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.494 ' N ' HG23 ' B' ' 7' ' ' THR . 43.6 tt0 -169.57 -71.69 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.09 1.356 . . . . 2.1899999999999999 108.702 -164.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.1 mt -51.58 -45.32 63.07 Favored 'General case' 0 C--N 1.341 0.199 0 O-C-N 121.37 -0.831 . . . . 1.1399999999999999 109.243 166.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . 0.463 ' OE1' HG22 ' B' ' 7' ' ' THR . 47.0 mt-10 -51.55 -47.27 63.49 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.514 1.526 . . . . 3.1699999999999999 111.621 172.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -59.4 -48.46 81.56 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.224 -0.923 . . . . 3.6899999999999999 110.072 176.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 14.4 p -62.93 -40.79 98.71 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.284 -0.885 . . . . 1.25 111.282 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.617 ' O ' HG23 ' B' ' 17' ' ' VAL 0.358 2.9 pp -62.15 -37.87 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 O-C-N 121.159 -0.963 . . . . 1.0 110.525 174.15 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -59.04 -46.07 89.16 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 119.189 -1.004 . . . . 3.2999999999999998 111.961 170.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . 0.29 1.3 t -56.03 -36.7 68.27 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 120.2 1.363 . . . . 1.3799999999999999 112.002 -177.056 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 8.8 m -76.17 -35.82 29.18 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 O-C-N 120.414 -1.429 . . . . 0.81000000000000005 111.578 174.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.617 HG23 ' O ' ' B' ' 13' ' ' ILE . 94.1 t -57.63 -46.69 86.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 119.188 0.903 . . . . 1.29 110.254 174.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.8 t -64.54 -40.84 96.32 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.411 -0.805 . . . . 1.5800000000000001 110.474 177.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 27.6 m -57.25 -54.87 41.89 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.478 1.036 . . . . 1.21 109.355 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -42.15 -60.79 1.33 Allowed 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 124.799 1.239 . . . . 4.4299999999999997 110.582 171.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -57.78 -54.18 49.79 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.035 0.934 . . . . 3.7200000000000002 111.683 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 36.9 p -57.33 -43.34 83.29 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 122.842 0.457 . . . . 2.3700000000000001 110.908 -177.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -68.49 -43.64 76.46 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 118.565 0.62 . . . . 2.8799999999999999 111.591 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.87 -32.77 63.96 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 125.48 1.512 . . . . 1.01 110.33 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.14 -26.34 66.2 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 117.781 -1.104 . . . . 4.2000000000000002 112.581 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.484 ' CB ' ' HG2' ' B' ' 37' ' ' GLU . 1.1 tp60 -52.96 -64.15 0.91 Allowed 'General case' 0 C--N 1.343 0.323 0 N-CA-C 114.799 1.407 . . . . 2.2599999999999998 114.799 -153.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -89.43 -72.86 0.53 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.891 0.853 . . . . 2.8900000000000001 110.535 -170.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.88 155.74 22.64 Favored Glycine 0 C--N 1.336 0.54 0 C-N-CA 126.634 2.064 . . . . 1.8300000000000001 110.594 164.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 39.06 105.23 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 116.367 1.988 . . . . 4.5899999999999999 116.367 131.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -72.74 15.33 0.2 Allowed 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.816 1.784 . . . . 4.7300000000000004 115.816 -171.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 27.7 p-10 -90.99 -39.9 11.96 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 126.238 1.815 . . . . 4.6399999999999997 110.205 175.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 11.6 p -99.67 141.33 32.62 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 127.889 2.475 . . . . 2.52 108.951 -164.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -89.25 179.62 6.07 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 107.779 -1.193 . . . . 2.1000000000000001 107.779 147.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 17.0 t -155.66 -168.32 2.77 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 123.279 1.514 . . . . 2.3500000000000001 112.191 -144.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 5.2 t -69.36 -157.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 N-CA-C 100.807 -3.775 . . . . 3.0800000000000001 100.807 135.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -76.66 57.74 1.3 Allowed 'General case' 0 CA--C 1.549 0.915 1 O-C-N 116.153 -4.092 . . . . 2.9300000000000002 112.866 -136.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.484 ' HG2' ' CB ' ' B' ' 26' ' ' GLN . 36.9 mt-10 -80.21 -44.53 19.6 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 127.504 2.322 . . . . 2.0699999999999998 108.259 125.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.413 ' CZ ' HD13 ' B' ' 63' ' ' LEU . 0.2 OUTLIER -65.33 -54.35 30.2 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 122.071 -0.393 . . . . 2.4500000000000002 111.756 -170.041 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 28.6 tttt -59.69 -32.5 70.55 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 118.706 -1.198 . . . . 3.25 110.367 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -57.56 -33.48 68.18 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 112.59 0.589 . . . . 2.79 112.59 172.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -63.46 -55.5 23.71 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 107.836 -1.172 . . . . 2.8100000000000001 107.836 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -69.66 -38.91 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 CA-C-N 116.028 -0.533 . . . . 0.84999999999999998 110.1 -171.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 98.1 m -62.57 -54.57 37.74 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.77 0.828 . . . . 0.83999999999999997 110.684 175.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -72.36 -60.07 2.42 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.107 -0.371 . . . . 3.02 110.755 -172.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -80.02 -58.41 3.17 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 122.301 -0.249 . . . . 3.3700000000000001 111.38 -159.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . 0.441 HD11 HD22 ' B' ' 83' ' ' LEU . 2.0 mm? -50.53 -38.57 42.16 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 124.729 1.211 . . . . 2.02 114.242 -155.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -52.54 -49.15 18.45 Favored 'Trans proline' 0 N--CA 1.452 -0.914 0 C-N-CA 119.783 -3.007 . . . . 2.0899999999999999 109.021 -76.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -51.34 -52.6 44.02 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 126.915 2.086 . . . . 3.2200000000000002 112.129 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.412 HD23 ' HB2' ' B' ' 83' ' ' LEU . 21.6 tp -54.52 -46.9 73.6 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.607 0.242 . . . . 1.02 110.941 -163.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 91.9 mt -106.16 68.03 0.76 Allowed 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 124.913 1.285 . . . . 1.6200000000000001 110.046 165.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.29 0.49 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 129.084 2.954 . . . . 6.1500000000000004 117.715 158.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -107.15 90.88 3.44 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 105.233 -2.136 . . . . 3.5499999999999998 105.233 162.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 30.2 m -97.38 21.0 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 115.391 -0.822 . . . . 2.23 109.133 164.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -95.17 -76.12 1.31 Allowed Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 108.239 -1.944 . . . . 2.5099999999999998 108.239 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 11.5 m -79.4 52.25 1.34 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 126.637 1.975 . . . . 2.4199999999999999 111.465 -164.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -67.98 -28.48 67.47 Favored 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 124.129 0.972 . . . . 1.28 109.4 178.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -65.12 -48.12 74.75 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.023 0.829 . . . . 4.0099999999999998 109.993 173.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -53.66 -53.0 58.15 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.673 0.789 . . . . 2.8700000000000001 109.126 173.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -57.75 -46.26 84.74 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 118.849 -0.596 . . . . 3.9900000000000002 110.231 178.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -53.07 -52.72 57.64 Favored 'General case' 0 N--CA 1.462 0.137 0 C-N-CA 124.215 1.006 . . . . 1.8999999999999999 109.604 178.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -55.73 -44.2 77.32 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.004 0.522 . . . . 3.5099999999999998 110.119 176.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 16.1 m -66.89 -30.78 71.03 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.028 0.751 . . . . 1.8700000000000001 113.028 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.413 HD13 ' CZ ' ' B' ' 38' ' ' PHE . 37.4 mt -80.47 -56.41 4.2 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 125.307 1.443 . . . . 1.4299999999999999 109.641 -177.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -67.24 -10.18 48.03 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 127.626 2.37 . . . . 1.5800000000000001 115.607 -167.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 21.4 m -33.01 -20.79 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 C-N-CA 130.349 3.46 . . . . 1.3999999999999999 119.613 -133.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -57.35 -27.86 62.64 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 121.117 1.78 . . . . 2.7599999999999998 110.978 160.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 64.88 60.93 0.81 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.397 1.479 . . . . 3.0800000000000001 110.589 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 44.6 p30 -107.22 -13.21 15.2 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.064 1.746 . . . . 1.98 111.656 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 14.3 m 69.41 15.14 8.42 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.412 1.485 . . . . 1.77 113.526 -173.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -114.48 101.12 8.83 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 106.185 -1.783 . . . . 3.1099999999999999 106.185 160.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -78.11 104.16 8.5 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.975 -1.861 . . . . 1.05 105.975 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -81.43 176.8 9.4 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 121.476 0.655 . . . . 4.6900000000000004 109.742 -171.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -80.57 82.71 6.52 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 107.809 -1.182 . . . . 5.1399999999999997 107.809 -174.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 97.68 50.21 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.325 1 C-N-CA 133.666 4.786 . . . . 2.4399999999999999 108.126 -172.593 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -89.05 -59.48 2.21 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 120.698 -1.251 . . . . 2.1600000000000001 108.521 107.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -38.49 -51.75 1.58 Allowed 'General case' 0 C--N 1.345 0.384 0 C-N-CA 126.525 1.93 . . . . 3.52 112.338 -172.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 46.2 t90 -44.61 -34.33 2.12 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 125.737 1.615 . . . . 3.6200000000000001 112.807 -176.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . 0.404 ' HB2' HD23 ' B' ' 63' ' ' LEU . 7.8 mmm180 -40.8 -45.51 2.48 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.947 0.899 . . . . 4.0899999999999999 111.7 172.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 6.1 tp -54.58 -44.49 73.03 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 118.547 0.612 . . . . 0.88 111.402 178.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 34.5 mt -64.08 -30.26 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.806 0 N-CA-C 107.302 -1.37 . . . . 1.49 107.302 -178.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.577 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -68.07 -44.43 77.35 Favored Glycine 0 CA--C 1.497 -1.057 0 C-N-CA 124.765 1.174 . . . . 1.5 112.088 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . 0.41 ' OE2' ' NZ ' ' B' ' 85' ' ' LYS . 2.3 mm-40 -65.57 -61.89 1.83 Allowed 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 107.203 -1.406 . . . . 2.7000000000000002 107.203 178.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.441 HD22 HD11 ' B' ' 46' ' ' LEU . 3.8 pp -56.85 -34.64 68.0 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.038 0.835 . . . . 1.8799999999999999 112.062 -178.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.67 -61.49 2.55 Favored 'General case' 0 C--N 1.34 0.188 0 O-C-N 121.611 -0.681 . . . . 1.53 110.315 172.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . 0.41 ' NZ ' ' OE2' ' B' ' 82' ' ' GLU . 0.1 OUTLIER -60.66 -33.85 73.43 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 118.291 -0.862 . . . . 1.73 110.138 -175.316 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -50.67 -33.75 23.83 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 125.457 1.503 . . . . 2.98 112.046 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 4.3 tt -56.95 -38.66 60.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 119.091 0.859 . . . . 1.1599999999999999 110.634 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -82.19 -41.59 20.12 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.779 1.632 . . . . 4.2199999999999998 110.225 175.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 82.1 tttt . . . . . 0 N--CA 1.448 -0.566 0 C-N-CA 125.018 1.327 . . . . 4.8099999999999996 111.254 -166.057 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 . . . . . 0 CA--C 1.54 0.574 0 N-CA-C 109.68 -0.489 . . . . 5.6600000000000001 109.68 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -76.97 101.32 1.5 Allowed 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.507 2.138 . . . . 3.23 109.853 -178.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 94.7 mt -70.54 157.75 37.34 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 121.66 0.743 . . . . 2.04 110.742 175.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.1 m -48.44 136.89 12.11 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.307 1.843 . . . . 2.2599999999999998 111.47 172.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -45.31 -54.17 7.49 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 119.027 0.83 . . . . 2.79 112.59 174.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.1 mt -57.67 -43.95 85.37 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 119.534 -0.867 . . . . 1.6599999999999999 111.167 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -58.96 -51.31 70.62 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.928 0.785 . . . . 2.5 112.132 175.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -50.36 -55.7 14.52 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.703 0.764 . . . . 3.1499999999999999 109.608 176.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.5 p -62.94 -42.22 99.74 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.625 -0.716 . . . . 1.4399999999999999 112.395 -175.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.54 -33.28 48.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 119.651 1.114 . . . . 1.01 111.006 177.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -61.3 -57.24 13.16 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 118.196 -0.907 . . . . 3.23 109.86 176.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.1 t -51.13 -41.29 59.98 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.712 1.142 . . . . 2.3599999999999999 111.876 -173.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.9 m -71.78 -37.35 61.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 O-C-N 120.945 -1.097 . . . . 0.98999999999999999 111.317 178.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 40.3 t -60.25 -52.29 62.98 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 119.542 1.064 . . . . 0.71999999999999997 110.693 172.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.1 t -59.53 -45.13 92.66 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.182 -0.949 . . . . 0.90000000000000002 110.376 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 88.5 m -57.44 -46.91 83.05 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.877 0.762 . . . . 1.1699999999999999 111.041 176.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -49.63 -56.69 9.15 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.232 -0.655 . . . . 3.5499999999999998 109.232 171.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -57.43 -48.43 79.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.976 0.51 . . . . 3.8399999999999999 111.478 -175.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.6 p -60.47 -56.54 20.16 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.451 -0.574 . . . . 2.3300000000000001 109.451 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -55.03 -39.15 68.82 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.729 0.695 . . . . 2.6299999999999999 111.469 178.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.52 -19.32 61.96 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 125.47 1.508 . . . . 0.95999999999999996 111.878 -177.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.05 -30.74 70.02 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 118.308 -0.854 . . . . 4.3099999999999996 111.618 175.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -45.73 -63.98 0.84 Allowed 'General case' 0 C--N 1.346 0.439 0 N-CA-C 113.493 0.923 . . . . 2.0499999999999998 113.493 -159.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -98.97 80.17 2.45 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 104.155 -2.535 . . . . 3.0800000000000001 104.155 177.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 34.96 -150.62 0.01 OUTLIER Glycine 0 CA--C 1.525 0.678 0 C-N-CA 127.746 2.593 . . . . 2.21 112.866 -177.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 72.2 mtp85 34.16 81.91 0.02 OUTLIER 'General case' 0 C--O 1.24 0.577 0 C-N-CA 126.122 1.769 . . . . 4.9000000000000004 110.513 164.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -74.23 29.64 0.08 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.703 2.001 . . . . 3.6499999999999999 113.681 -163.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -145.0 -45.77 0.23 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.068 1.347 . . . . 3.6299999999999999 107.624 -170.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.7 p -84.7 134.04 34.36 Favored 'General case' 0 C--O 1.244 0.798 0 O-C-N 121.366 -0.833 . . . . 1.8400000000000001 111.15 171.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.418 ' HB2' ' HB2' ' A' ' 71' ' ' LEU . 2.3 mm? -90.61 120.73 31.93 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.181 1.392 . . . . 2.21 107.896 171.464 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.3 t -85.55 -179.94 7.0 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.283 1.833 . . . . 2.1800000000000002 110.921 170.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.3 t -57.29 -58.17 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 124.925 1.29 . . . . 2.4700000000000002 111.532 -176.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -63.26 -48.3 78.77 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 108.138 -1.06 . . . . 3.2400000000000002 108.138 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -39.15 -52.44 1.91 Allowed 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 124.965 1.306 . . . . 2.0 112.921 172.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.417 ' CZ ' HD21 ' A' ' 56' ' ' LEU . 2.3 t80 -61.98 -53.82 50.23 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 120.941 -0.304 . . . . 2.8500000000000001 110.215 175.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.3 tttt -58.23 -36.99 74.01 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 122.047 -0.408 . . . . 3.5600000000000001 111.337 -172.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -53.72 -40.59 66.21 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.497 1.519 . . . . 2.3900000000000001 110.887 173.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 tp -66.83 -44.02 82.2 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 119.35 0.977 . . . . 2.6699999999999999 109.51 -176.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.424 ' HB ' HG12 ' A' ' 53' ' ' VAL . 5.8 m -76.79 -27.27 16.64 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 CA-C-N 115.914 -0.585 . . . . 1.4299999999999999 111.264 -174.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.3 m -73.37 -54.85 7.33 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.158 0.583 . . . . 1.77 110.013 172.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -82.68 -58.78 2.75 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.232 1.413 . . . . 2.7000000000000002 112.778 -167.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -83.57 -49.65 9.01 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.583 0.753 . . . . 3.2999999999999998 110.901 -167.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.68 121.58 85.39 Favored Pre-proline 0 CA--C 1.541 0.611 0 N-CA-C 109.089 -0.708 . . . . 3.3799999999999999 109.089 175.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.475 ' HD3' HG21 ' B' ' 7' ' ' THR . 97.9 Cg_endo -84.25 -37.4 0.14 Allowed 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.784 2.322 . . . . 3.3100000000000001 111.627 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -151.74 -47.94 0.11 Allowed 'General case' 0 C--N 1.34 0.166 0 CA-C-O 118.335 -0.84 . . . . 4.5 111.863 -166.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.467 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 9.6 tp -20.76 -78.26 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 127.43 2.292 . . . . 1.8899999999999999 113.409 -178.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.645 ' O ' HG13 ' A' ' 53' ' ' VAL . 49.8 mt -77.82 69.1 4.01 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.444 0.698 . . . . 2.6000000000000001 109.489 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.38 -8.68 0.14 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.084 1.354 . . . . 5.4699999999999998 114.091 175.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.4 -8.92 56.94 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 128.09 2.556 . . . . 5.2000000000000002 110.679 176.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . 0.645 HG13 ' O ' ' A' ' 50' ' ' LEU . 33.4 m -39.74 -37.24 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.404 0 C-N-CA 124.395 1.078 . . . . 1.99 113.44 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -46.53 -39.64 10.54 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 124.087 0.851 . . . . 2.1000000000000001 112.728 176.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.1 t -120.39 43.92 2.59 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.771 1.228 . . . . 2.5299999999999998 109.374 174.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.481 ' C ' HD13 ' A' ' 56' ' ' LEU . 2.1 tm? -43.55 -44.98 6.4 Favored 'General case' 0 C--N 1.339 0.111 0 CA-C-O 122.144 0.973 . . . . 1.03 110.052 173.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.65 -26.04 65.2 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 125.751 1.62 . . . . 4.7999999999999998 111.805 -172.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -73.02 -43.73 61.72 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.742 1.156 . . . . 3.5600000000000001 108.934 171.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.06 -41.69 79.19 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 108.605 -0.887 . . . . 2.6099999999999999 108.605 176.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -52.09 -50.28 61.91 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.038 0.535 . . . . 1.72 110.775 175.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.85 -43.21 94.75 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.427 0.558 . . . . 4.21 110.768 178.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.0 t -58.96 -40.09 83.67 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.938 0.399 . . . . 1.8600000000000001 110.929 174.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.844 ' HB3' HD11 ' A' ' 71' ' ' LEU . 1.4 tp -65.5 -56.45 12.32 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.635 0.774 . . . . 2.7400000000000002 109.884 -178.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -79.09 75.0 5.63 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.256 0.55 . . . . 1.8899999999999999 110.576 -177.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.7 m -52.48 -25.59 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 123.293 0.637 . . . . 1.76 112.616 177.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -79.23 -29.16 42.59 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.625 0.648 . . . . 2.4900000000000002 112.003 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 54.98 55.1 8.11 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.692 0.797 . . . . 3.6800000000000002 110.114 -160.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 56.4 p30 -110.28 -8.26 14.75 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.229 1.811 . . . . 2.3399999999999999 112.353 177.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.5 m 67.16 18.23 10.39 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.227 1.411 . . . . 2.1499999999999999 112.86 -175.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -123.53 118.58 27.69 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.877 1.271 . . . . 3.3199999999999998 108.023 166.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.844 HD11 ' HB3' ' A' ' 63' ' ' LEU . 4.1 mm? -83.22 100.94 10.9 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 106.194 -1.78 . . . . 1.24 106.194 165.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -62.79 164.99 7.11 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 109.19 -0.671 . . . . 3.2400000000000002 109.19 169.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -39.5 -58.96 1.17 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.913 1.285 . . . . 4.7599999999999998 111.218 176.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -70.4 -31.32 68.49 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.156 0.982 . . . . 1.6899999999999999 111.357 -170.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -69.07 -56.77 6.71 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.876 -0.787 . . . . 1.96 108.876 173.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -55.04 -42.22 72.4 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 110.058 -0.349 . . . . 3.6499999999999999 110.058 -178.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.658 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 37.3 t90 -46.18 -36.55 6.11 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 124.325 1.05 . . . . 4.5999999999999996 112.286 176.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 8.5 mtm180 -45.71 -42.94 12.33 Favored 'General case' 0 C--N 1.346 0.427 0 CA-C-N 119.129 0.877 . . . . 4.2800000000000002 111.023 174.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.4 tp -48.07 -50.09 29.3 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 123.398 0.679 . . . . 0.81999999999999995 111.045 176.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 19.5 mm -65.25 -27.85 43.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 108.091 -1.077 . . . . 2.1800000000000002 108.091 -175.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.538 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -61.13 -50.88 62.46 Favored Glycine 0 CA--C 1.494 -1.23 0 N-CA-C 109.429 -1.469 . . . . 1.5600000000000001 109.429 173.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -76.95 -32.31 57.22 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-O 117.8 -1.095 . . . . 2.2999999999999998 109.028 -171.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.467 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 7.0 mp -51.67 -58.02 7.56 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 120.297 1.408 . . . . 2.3399999999999999 109.9 161.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.46 -29.62 67.93 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.792 0.837 . . . . 1.55 112.032 -176.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.11 -60.09 2.42 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-O 118.587 -0.72 . . . . 1.8899999999999999 110.022 167.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -47.12 -48.63 23.06 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 127.103 2.161 . . . . 3.2000000000000002 111.41 -168.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.5 tt -51.24 -33.54 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 112.477 0.547 . . . . 1.6000000000000001 112.477 175.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.05 -46.44 6.81 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.597 2.359 . . . . 5.5300000000000002 111.603 -174.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 64.0 tttp . . . . . 0 CA--C 1.536 0.43 0 C-N-CA 128.035 2.534 . . . . 3.3799999999999999 112.959 -177.961 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.43 HD13 ' HB3' ' B' ' 10' ' ' GLU . 2.1 mt . . . . . 0 CA--C 1.542 0.655 0 N-CA-C 113.594 0.961 . . . . 2.2999999999999998 113.594 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.475 HG21 ' HD3' ' A' ' 47' ' ' PRO . 10.0 t -81.03 -173.25 4.18 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.758 1.223 . . . . 2.1899999999999999 110.088 166.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 73.8 tt0 -73.11 -54.66 7.93 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.256 0.622 . . . . 3.6800000000000002 111.875 -173.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mt -53.28 -46.66 69.39 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.199 -0.938 . . . . 1.6799999999999999 109.64 177.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . 0.445 ' OE1' HD13 ' A' ' 49' ' ' LEU . 15.7 mt-10 -51.8 -54.99 22.63 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 113.917 1.08 . . . . 2.9399999999999999 113.917 169.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -60.96 -33.97 74.03 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.882 1.219 . . . . 4.1600000000000001 110.331 -177.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 13.4 m -60.94 -55.74 29.39 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.213 0.605 . . . . 1.3200000000000001 110.891 173.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.28 2.3 pp -60.49 -39.23 80.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 O-C-N 121.505 -0.747 . . . . 1.3100000000000001 110.87 179.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -61.12 -55.94 26.59 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.75 0.704 . . . . 2.5899999999999999 110.241 175.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.1 t -54.54 -38.53 66.69 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.194 0.906 . . . . 1.4299999999999999 111.214 -173.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 12.8 m -75.41 -37.42 38.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 O-C-N 121.356 -0.84 . . . . 1.24 111.494 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 25.0 t -58.6 -46.68 90.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 119.759 1.163 . . . . 1.3300000000000001 110.785 173.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 15.0 t -65.83 -46.87 76.92 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.353 -0.842 . . . . 1.5600000000000001 110.516 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 86.1 m -59.21 -45.53 90.86 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 120.081 1.309 . . . . 1.3 110.861 176.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -47.07 -54.94 9.22 Favored 'General case' 0 C--O 1.225 -0.196 0 N-CA-C 109.231 -0.655 . . . . 4.2999999999999998 109.231 170.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -58.89 -51.66 69.07 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 122.977 0.511 . . . . 2.6699999999999999 111.697 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 41.5 p -62.15 -35.18 77.99 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.556 -0.715 . . . . 2.23 111.229 -177.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -70.03 -44.11 69.93 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.468 0.576 . . . . 2.98 111.016 170.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.93 -27.13 68.63 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.356 1.463 . . . . 1.1100000000000001 111.0 -173.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -55.72 -26.37 44.93 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 118.926 -0.559 . . . . 3.9900000000000002 110.957 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.61 -70.9 0.14 Allowed 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 116.085 1.883 . . . . 3.3700000000000001 116.085 -147.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -95.14 -76.92 0.48 Allowed 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 122.328 1.061 . . . . 3.0800000000000001 113.257 -169.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.43 112.38 4.22 Favored Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 127.447 2.451 . . . . 2.3300000000000001 109.557 168.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.6 ttt85 66.85 109.07 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 121.027 2.413 . . . . 4.4299999999999997 115.845 149.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 21.1 pttt -53.35 -13.64 0.6 Allowed 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 116.565 2.061 . . . . 4.1500000000000004 116.565 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -88.46 -46.41 9.15 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.761 0.824 . . . . 3.8700000000000001 110.494 -170.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 5.4 p -107.28 163.27 13.17 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 126.69 1.996 . . . . 1.8999999999999999 109.512 -175.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 mp -120.78 140.75 51.26 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-O 121.718 0.771 . . . . 2.7799999999999998 112.743 170.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 5.1 t -86.33 -170.06 2.92 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 128.473 2.709 . . . . 2.7000000000000002 110.427 174.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 67.7 t -66.65 -108.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.384 1 C-N-CA 132.056 4.142 . . . . 2.6600000000000001 100.215 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -75.42 58.01 0.96 Allowed 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 124.068 3.122 . . . . 2.6200000000000001 112.511 -175.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -123.97 -47.5 1.92 Allowed 'General case' 0 CA--C 1.542 0.639 1 C-N-CA 131.897 4.079 . . . . 2.1099999999999999 106.301 154.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -60.7 -48.02 83.65 Favored 'General case' 0 C--N 1.344 0.336 0 O-C-N 121.282 -0.886 . . . . 2.8399999999999999 109.925 166.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 13.7 ttmt -59.57 -31.84 69.82 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.217 0.532 . . . . 2.9900000000000002 110.121 -171.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -54.73 -41.37 70.29 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 123.461 0.705 . . . . 2.9300000000000002 112.241 173.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.1 tp -63.89 -47.24 81.41 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 120.391 1.45 . . . . 2.0699999999999998 109.403 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 16.9 m -69.66 -41.0 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 CA-C-N 115.346 -0.843 . . . . 0.90000000000000002 109.477 -172.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 85.4 m -68.13 -55.55 11.99 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 123.401 0.68 . . . . 1.1200000000000001 110.519 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -81.84 -58.84 2.81 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.627 1.571 . . . . 2.4500000000000002 111.635 -163.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.33 -41.23 25.19 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 122.017 -0.427 . . . . 3.9100000000000001 111.093 -172.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.9 tp -82.59 -14.55 0.21 Allowed Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 119.129 3.011 . . . . 2.0899999999999999 119.129 -158.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -38.96 -56.73 1.1 Allowed 'Trans proline' 0 CA--C 1.535 0.572 1 C-N-CA 125.601 4.201 . . . . 2.3300000000000001 116.274 -133.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -71.44 -26.58 62.79 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.741 -0.6 . . . . 3.4100000000000001 112.439 -169.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 39.0 tp -62.33 -77.01 0.05 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.081 0.552 . . . . 1.4399999999999999 111.402 -166.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.81 97.68 8.75 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.293 -1.003 . . . . 1.6299999999999999 108.293 168.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 15.6 pttp -63.54 179.33 0.47 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.007 0.432 . . . . 5.2699999999999996 110.209 167.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 57.65 34.98 25.18 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.248 1.019 . . . . 5.7699999999999996 109.882 177.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -55.55 -22.08 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 125.933 1.693 . . . . 3.1000000000000001 112.999 -173.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -46.01 -41.95 11.35 Favored Glycine 0 CA--C 1.531 1.075 0 N-CA-C 111.316 -0.714 . . . . 2.3399999999999999 111.316 168.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 82.5 p -76.28 43.11 0.29 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 117.723 0.761 . . . . 4.2300000000000004 112.179 -178.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.426 HD13 ' C ' ' B' ' 56' ' ' LEU . 3.2 tm? -74.94 -50.16 17.7 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 120.98 -1.075 . . . . 1.1599999999999999 109.055 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.46 -14.17 62.74 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.91 -0.494 . . . . 4.3600000000000003 112.327 -161.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -80.54 -41.42 24.17 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.702 0.801 . . . . 2.9100000000000001 111.517 165.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . 0.422 ' O ' HD12 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -55.37 -49.64 71.77 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 107.584 -1.265 . . . . 3.54 107.584 171.238 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -39.62 -53.83 2.09 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 124.033 0.933 . . . . 1.96 110.978 176.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -60.74 -37.61 82.34 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.361 0.504 . . . . 2.7799999999999998 112.361 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.0 t -67.18 -30.44 70.39 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.844 0.683 . . . . 2.4199999999999999 112.844 175.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.422 HD12 ' O ' ' B' ' 59' ' ' LYS . 5.9 mp -80.32 -54.52 5.64 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.455 -0.778 . . . . 1.53 110.385 176.046 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -54.31 -12.04 0.6 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 128.562 2.745 . . . . 1.51 116.051 -170.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -35.66 -21.99 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.408 1 C-N-CA 132.404 4.281 . . . . 2.6800000000000002 119.681 -130.367 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 16.8 p30 -64.82 -19.1 65.67 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 120.198 1.363 . . . . 2.3700000000000001 110.949 163.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 65.13 58.8 0.87 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.323 1.049 . . . . 2.8999999999999999 110.041 169.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -108.24 -6.54 16.3 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.395 1.878 . . . . 1.8300000000000001 110.839 -178.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m 67.97 12.66 8.9 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.448 1.499 . . . . 2.1600000000000001 113.753 -173.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -114.93 100.88 8.53 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.372 1.469 . . . . 3.02 107.106 162.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.92 100.55 0.21 Allowed 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 106.038 -1.838 . . . . 1.0800000000000001 106.038 166.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.8 tppt? -84.22 167.63 16.48 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.729 1.612 . . . . 4.21 110.199 -167.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -92.1 52.44 1.97 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.646 0.736 . . . . 4.3499999999999996 110.951 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -162.28 49.74 0.19 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 105.925 -1.88 . . . . 2.1099999999999999 105.925 113.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -95.68 -61.08 1.52 Allowed 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 119.914 -1.741 . . . . 2.0499999999999998 109.097 148.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -53.23 -37.73 62.31 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.567 1.147 . . . . 4.2699999999999996 110.786 -170.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.658 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 17.7 t-105 -39.35 -37.77 0.47 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.129 1.372 . . . . 4.4100000000000001 111.535 172.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 -37.77 -49.39 1.16 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.595 1.558 . . . . 5.4699999999999998 111.605 173.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.8 tp -53.4 -40.79 65.34 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-O 119.741 -0.171 . . . . 0.88 110.582 -176.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 76.4 mt -63.75 -28.15 44.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 N-CA-C 108.602 -0.888 . . . . 1.73 108.602 -173.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.58 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -76.01 -45.8 15.13 Favored Glycine 0 CA--C 1.487 -1.671 0 N-CA-C 109.857 -1.297 . . . . 1.3 109.857 178.343 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -68.2 -34.63 76.62 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 107.823 -1.177 . . . . 2.2799999999999998 107.823 -175.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 5.4 mt -49.23 -60.16 3.05 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 120.642 1.565 . . . . 2.1400000000000001 111.087 169.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.46 -50.83 68.83 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 122.092 0.949 . . . . 1.1799999999999999 110.127 -179.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 12.7 ttpp -60.18 -40.15 89.01 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 123.769 0.828 . . . . 1.5700000000000001 110.329 -177.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -64.37 -43.11 95.54 Favored 'General case' 0 C--O 1.226 -0.144 0 C-N-CA 125.716 1.606 . . . . 2.77 110.417 176.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -32.14 47.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 119.545 -0.862 . . . . 1.6200000000000001 110.836 171.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.91 -36.27 42.15 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 113.75 1.019 . . . . 3.54 113.75 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 16.6 pttp . . . . . 0 N--CA 1.469 0.514 0 C-N-CA 125.25 1.42 . . . . 6.4699999999999998 112.285 -168.141 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 . . . . . 0 CA--C 1.539 0.548 0 N-CA-C 107.495 -1.298 . . . . 6.5999999999999996 107.495 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -65.82 164.89 25.24 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 121.359 1.373 . . . . 3.04 111.049 170.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.1 mt -112.13 -178.38 3.4 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 127.046 2.138 . . . . 1.77 109.921 -164.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.5 t -70.96 167.08 19.91 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.733 -1.229 . . . . 2.0299999999999998 110.093 176.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -61.56 -54.38 43.85 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.166 -0.959 . . . . 2.2400000000000002 111.607 -166.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.7 mt -60.97 -44.24 97.6 Favored 'General case' 0 C--O 1.222 -0.357 0 O-C-N 121.344 -0.847 . . . . 1.4399999999999999 111.232 177.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -50.87 -51.47 51.16 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.207 2.203 . . . . 2.3999999999999999 112.21 174.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -49.84 -58.41 5.45 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.569 0.748 . . . . 4.4299999999999997 109.157 170.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.0 m -56.08 -50.65 70.42 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.973 0.909 . . . . 2.3799999999999999 111.719 -173.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.276 2.7 pp -61.92 -43.61 97.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 109.004 -0.739 . . . . 1.1399999999999999 109.004 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -61.29 -45.69 93.42 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.305 0.957 . . . . 4.21 110.925 175.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.25 -36.53 68.64 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.614 0.766 . . . . 1.8300000000000001 111.747 -178.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . 0.252 31.2 m -79.46 -40.13 21.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 O-C-N 120.926 -1.109 . . . . 1.0600000000000001 111.5 172.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.8 t -51.2 -48.46 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 120.48 1.491 . . . . 1.0600000000000001 110.989 175.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.2 t -59.55 -40.9 88.79 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.866 -0.522 . . . . 0.75 110.524 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . 0.782 HG21 HD21 ' B' ' 9' ' ' LEU . 28.7 m -58.94 -50.08 75.39 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.434 0.694 . . . . 1.0800000000000001 110.039 176.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -52.36 -57.25 10.4 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 123.423 0.689 . . . . 6.6100000000000003 109.191 175.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -56.51 -53.38 58.19 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.635 1.174 . . . . 3.6200000000000001 110.382 -172.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.8 t -63.4 -48.5 77.6 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 120.008 -0.677 . . . . 1.8300000000000001 110.403 -176.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -60.62 -42.39 96.74 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 119.458 1.027 . . . . 3.4700000000000002 110.773 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.2 -17.71 58.94 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 124.804 1.242 . . . . 1.05 111.965 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.7 ptt180 -71.04 -20.14 62.42 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 117.363 -1.304 . . . . 5.0300000000000002 111.772 173.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -42.35 -63.0 0.83 Allowed 'General case' 0 C--N 1.346 0.456 0 CA-C-N 119.282 0.947 . . . . 2.73 112.009 -175.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -120.7 171.42 8.6 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 126.405 1.882 . . . . 2.3900000000000001 106.781 -176.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -11.1 119.45 0.01 OUTLIER Glycine 0 CA--C 1.53 0.989 0 C-N-CA 127.546 2.498 . . . . 1.3799999999999999 114.298 175.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.6 ttm180 72.56 105.16 0.07 Allowed 'General case' 0 C--O 1.237 0.421 0 C-N-CA 123.446 0.698 . . . . 4.0199999999999996 112.731 167.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -75.1 50.17 0.47 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.56 1.144 . . . . 3.73 112.868 177.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -147.73 -57.6 0.24 Allowed 'General case' 0 C--O 1.227 -0.121 0 C-N-CA 125.802 1.641 . . . . 3.7200000000000002 106.914 174.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.0 144.66 28.98 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 124.311 1.044 . . . . 1.6599999999999999 111.181 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.6 mp -99.87 121.76 41.79 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.087 -1.079 . . . . 2.75 108.087 172.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.6 m -79.54 166.82 21.53 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 107.772 -1.195 . . . . 2.5800000000000001 107.772 177.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -54.88 -44.66 73.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 O-C-N 120.92 -1.112 . . . . 2.04 112.695 -169.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -62.04 -58.18 8.83 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.468 -0.568 . . . . 1.9099999999999999 109.468 176.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -37.76 -52.04 1.27 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.743 2.017 . . . . 1.8799999999999999 111.744 172.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -58.27 -55.59 32.97 Favored 'General case' 0 N--CA 1.442 -0.834 0 C-N-CA 124.764 1.225 . . . . 2.8399999999999999 109.15 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.6 tttt -59.85 -42.51 93.81 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 119.28 -0.968 . . . . 3.3100000000000001 112.307 178.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 73.2 mt-10 -52.23 -42.46 63.62 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-N 119.172 0.897 . . . . 2.2000000000000002 110.621 174.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.4 tt -66.13 -47.18 74.96 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 107.758 -1.201 . . . . 3.0099999999999998 107.758 -173.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -64.32 -51.85 63.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 118.581 -1.248 . . . . 1.22 109.393 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 95.1 m -48.13 -53.99 14.79 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.446 1.098 . . . . 1.3600000000000001 111.999 178.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -80.23 -54.83 5.38 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.337 1.055 . . . . 2.4300000000000002 110.641 -172.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -83.31 -39.63 20.53 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.634 1.174 . . . . 6.0 110.457 -167.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -115.48 68.94 2.82 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-N 119.266 0.939 . . . . 2.46 111.288 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -64.78 -37.53 35.09 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.36 2.04 . . . . 2.46 112.302 -178.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -123.84 -34.08 3.06 Favored 'General case' 0 C--N 1.342 0.257 0 N-CA-C 113.307 0.854 . . . . 6.4800000000000004 113.307 -174.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.702 HD13 ' CD1' ' B' ' 6' ' ' LEU . 30.2 tp -54.9 -59.85 4.17 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-N 118.471 0.578 . . . . 2.23 110.182 -175.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.0 mt -74.92 124.3 26.66 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 105.21 -2.145 . . . . 2.9100000000000001 105.21 152.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.2 -7.37 21.26 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 125.455 1.502 . . . . 7.8600000000000003 110.039 -176.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -110.22 87.89 2.63 Favored 'General case' 0 N--CA 1.435 -1.188 0 N-CA-C 104.844 -2.28 . . . . 4.46 104.844 169.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.5 m -98.26 22.63 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 114.59 -1.187 . . . . 2.4399999999999999 108.865 161.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -93.2 -76.02 1.32 Allowed Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 107.319 -2.312 . . . . 2.2799999999999998 107.319 176.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.7 m -79.22 61.52 3.35 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 126.147 1.779 . . . . 2.3500000000000001 110.085 -171.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.07 -29.56 64.25 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 125.768 1.627 . . . . 1.48 109.327 178.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -53.72 -63.49 1.13 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.869 1.667 . . . . 4.6699999999999999 112.726 174.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -58.13 -33.66 69.4 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 120.489 -1.382 . . . . 3.0299999999999998 111.046 177.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 -56.76 17.11 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.584 -0.895 . . . . 2.5800000000000001 108.584 172.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -46.99 -50.53 18.97 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 123.877 0.871 . . . . 2.1499999999999999 110.01 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -60.19 -38.39 83.12 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 117.981 0.355 . . . . 3.8500000000000001 111.183 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.7 m -68.67 -47.81 65.57 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.642 0.377 . . . . 1.73 111.95 178.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.3 mp -73.94 -48.89 27.45 Favored 'General case' 0 C--O 1.232 0.137 0 O-C-N 121.815 -0.553 . . . . 1.9099999999999999 111.122 -176.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -75.7 78.44 2.66 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.48 0.712 . . . . 2.4199999999999999 109.961 -169.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 17.5 m -47.63 -37.4 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 124.152 0.981 . . . . 2.3500000000000001 113.412 -170.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -96.06 -8.51 33.29 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.059 0.763 . . . . 2.7799999999999998 113.059 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 54.39 55.03 8.58 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 125.969 1.708 . . . . 3.04 111.329 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.3 p30 -87.43 -42.83 12.53 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.57 0.748 . . . . 2.0899999999999999 110.22 174.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.5 m 101.9 13.96 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 130.088 3.355 . . . . 1.6599999999999999 112.727 -171.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -112.93 111.35 22.04 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 105.514 -2.032 . . . . 3.25 105.514 162.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -79.93 89.93 5.32 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 103.421 -2.807 . . . . 1.0800000000000001 103.421 175.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.3 ttpt -71.26 160.27 33.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.441 1.097 . . . . 3.3700000000000001 108.349 -178.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -40.09 -60.71 0.99 Allowed 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.561 1.144 . . . . 5.0300000000000002 112.975 -168.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -69.66 -20.02 63.59 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.195 0.813 . . . . 1.9099999999999999 113.195 -177.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -76.7 -61.35 2.0 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-N 119.866 1.212 . . . . 1.8300000000000001 108.288 172.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -45.33 -39.75 7.04 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 125.586 1.554 . . . . 2.8900000000000001 110.792 176.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.489 ' HE1' ' HA3' ' B' ' 81' ' ' GLY . 11.6 t90 -39.07 -43.59 1.04 Allowed 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 125.243 1.417 . . . . 4.71 114.686 174.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.53 -38.92 32.58 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 109.793 -0.447 . . . . 6.5800000000000001 109.793 178.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 tp -57.06 -42.39 80.51 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.862 -0.59 . . . . 1.0800000000000001 111.278 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 14.9 mm -70.76 -41.07 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 107.195 -1.409 . . . . 1.75 107.195 -177.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.521 ' HA2' ' CD2' ' B' ' 77' ' ' TRP . . . -60.97 -38.35 95.34 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-N 115.24 -0.891 . . . . 1.24 111.687 178.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -81.02 -49.36 11.02 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-O 117.789 -1.1 . . . . 3.5899999999999999 111.331 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.464 HD12 HG21 ' B' ' 13' ' ' ILE 0.258 4.0 pp -55.34 -34.0 63.84 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 120.885 1.675 . . . . 2.4399999999999999 110.881 174.735 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.42 -40.34 78.13 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.219 -0.925 . . . . 2.04 112.52 168.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.3 -48.42 75.74 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 125.068 1.347 . . . . 2.8900000000000001 111.484 173.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -62.38 -28.11 69.54 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.679 1.592 . . . . 2.8399999999999999 111.936 -158.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.0 tt -50.73 -38.05 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 123.497 0.719 . . . . 1.8899999999999999 111.279 169.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . 2.306 0.0 OUTLIER -86.73 -55.13 4.0 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 129.342 3.057 . . . . 5.1100000000000003 110.472 176.324 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 13.1 tttm . . . . . 0 CA--C 1.537 0.466 0 C-N-CA 127.465 2.306 . . . . 4.9199999999999999 112.471 -168.839 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.702 ' CD1' HD13 ' A' ' 49' ' ' LEU . 0.1 OUTLIER . . . . . 0 CA--C 1.552 1.049 0 N-CA-C 115.718 1.747 . . . . 3.54 115.718 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.471 ' H ' ' HG2' ' B' ' 10' ' ' GLU . 9.2 t -130.04 -140.97 0.23 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 127.84 2.456 . . . . 2.1299999999999999 111.409 -171.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -87.46 -63.58 1.28 Allowed 'General case' 0 C--N 1.34 0.157 0 C-N-CA 125.448 1.499 . . . . 3.1200000000000001 107.948 177.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . 0.782 HD21 HG21 ' A' ' 19' ' ' THR . 0.6 OUTLIER -50.23 -34.13 21.93 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.628 0.771 . . . . 3.2799999999999998 111.354 -179.395 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . 0.471 ' HG2' ' H ' ' B' ' 7' ' ' THR . 0.0 OUTLIER -46.72 -46.83 20.52 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 122.89 0.476 . . . . 6.5300000000000002 110.933 175.202 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.402 ' N ' ' HG3' ' B' ' 10' ' ' GLU . 19.8 mt-10 -65.04 -44.15 90.04 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 108.149 -1.056 . . . . 5.0199999999999996 108.149 -171.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 24.6 p -75.09 -27.09 59.75 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.157 -0.929 . . . . 1.29 111.682 -173.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.464 HG21 HD12 ' A' ' 83' ' ' LEU 0.268 2.0 pp -74.89 -40.66 46.15 Favored 'Isoleucine or valine' 0 C--N 1.34 0.19 0 CA-C-N 119.47 1.032 . . . . 1.5 111.215 166.197 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -53.2 -56.84 13.27 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 119.305 0.957 . . . . 4.0099999999999998 109.093 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.1 t -52.2 -42.35 63.44 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.048 0.451 . . . . 1.8 111.668 -173.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 19.8 m -79.3 -29.58 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 120.942 -1.099 . . . . 1.21 111.804 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 25.3 t -63.42 -41.65 93.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 119.041 0.837 . . . . 1.6299999999999999 109.551 172.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . 0.255 9.8 t -67.2 -42.98 83.24 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.091 -0.957 . . . . 1.8100000000000001 110.482 174.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 4.2 m -51.56 -56.63 12.43 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.855 1.661 . . . . 1.25 110.382 171.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -40.47 -62.0 0.84 Allowed 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 125.097 1.359 . . . . 4.5099999999999998 110.189 172.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -64.81 -48.42 74.45 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.772 0.32 . . . . 2.4300000000000002 111.596 -171.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 54.8 p -60.29 -35.54 75.79 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.07 0.548 . . . . 2.3199999999999998 111.754 -178.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 -69.66 -54.66 12.82 Favored 'General case' 0 N--CA 1.458 -0.07 0 CA-C-O 121.325 0.583 . . . . 2.8599999999999999 110.403 168.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.62 -18.48 64.96 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 126.199 1.8 . . . . 1.1100000000000001 112.072 -166.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -52.55 -27.25 15.87 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 118.816 -0.611 . . . . 4.0499999999999998 111.804 169.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.02 -68.9 0.17 Allowed 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 117.677 2.473 . . . . 2.2799999999999998 117.677 -151.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -89.18 -76.85 0.4 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.209 0.913 . . . . 2.7400000000000002 111.922 -161.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.16 167.43 29.11 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 127.722 2.582 . . . . 1.77 110.472 150.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . 0.407 ' NH1' ' OE2' ' B' ' 70' ' ' GLU . 36.8 ttm180 53.63 101.13 0.01 OUTLIER 'General case' 0 C--O 1.238 0.458 0 C-N-CA 124.336 1.054 . . . . 3.6000000000000001 113.81 136.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 14.7 pttm -60.5 -39.01 86.18 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 113.479 0.918 . . . . 3.8900000000000001 113.479 -175.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -77.88 -19.25 55.11 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.343 0.868 . . . . 4.5999999999999996 113.343 -168.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 96.8 p -130.32 160.52 33.69 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-N 119.544 1.065 . . . . 1.7 111.639 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.507 HD13 ' CD1' ' B' ' 76' ' ' TYR . 5.2 mp -113.22 161.84 16.71 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.281 1.032 . . . . 2.2000000000000002 111.717 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 15.2 m -140.97 170.45 15.72 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 127.095 2.158 . . . . 2.46 105.852 -178.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 33.0 m -88.91 54.07 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 O-C-N 121.279 -0.888 . . . . 2.8700000000000001 112.024 -170.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -152.12 54.29 0.81 Allowed 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 105.934 -1.876 . . . . 2.1299999999999999 105.934 141.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -160.56 -58.52 0.06 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 127.952 2.501 . . . . 1.73 104.722 -174.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -56.36 -60.01 4.13 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.741 -1.118 . . . . 2.1200000000000001 110.309 177.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 41.3 tttm -58.66 -35.03 71.92 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.303 0.573 . . . . 3.75 109.565 -175.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . 0.288 16.3 mm-40 -63.01 -18.7 63.6 Favored 'General case' 0 N--CA 1.44 -0.954 0 N-CA-C 112.824 0.676 . . . . 5.2699999999999996 112.824 -174.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 24.7 tp -62.24 -50.78 70.39 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.573 -0.899 . . . . 1.8400000000000001 108.573 169.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 16.6 m -70.72 -42.73 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 109.816 -0.438 . . . . 0.90000000000000002 109.816 -174.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 24.1 m -51.96 -55.22 21.69 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 122.688 0.395 . . . . 1.01 110.275 173.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -82.33 -58.72 2.81 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.835 1.05 . . . . 2.3700000000000001 113.835 -168.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -79.57 -48.53 13.66 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.51 1.3 . . . . 3.8900000000000001 114.51 -164.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . 0.434 HD11 HD11 ' B' ' 83' ' ' LEU . 1.5 mm? -52.43 -38.78 59.93 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 115.69 1.737 . . . . 2.1400000000000001 115.69 -148.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -63.94 -39.3 33.43 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.569 -1.846 . . . . 2.3100000000000001 109.619 -58.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -89.09 -30.6 18.54 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.139 1.375 . . . . 3.5600000000000001 112.365 -168.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 19.3 tp -47.57 -63.28 1.1 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.491 1.516 . . . . 1.1699999999999999 111.405 -175.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' B' ' 50' ' ' LEU . 33.0 mt -93.09 72.42 4.65 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.372 -0.973 . . . . 1.6599999999999999 108.372 163.13 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.9 147.29 0.22 Allowed 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.81 1.244 . . . . 5.5300000000000002 110.305 174.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 32.0 t0 61.9 41.08 11.86 Favored 'General case' 0 C--N 1.343 0.286 0 N-CA-C 106.856 -1.535 . . . . 4.1699999999999999 106.856 173.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 5.9 m 32.25 50.54 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 C-N-CA 127.748 2.419 . . . . 3.79 112.924 -172.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 65.07 19.16 65.61 Favored Glycine 0 CA--C 1.525 0.698 0 CA-C-O 118.718 -1.046 . . . . 7.3700000000000001 114.174 174.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 5.6 p 42.22 61.24 2.04 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 118.288 1.044 . . . . 5.0300000000000002 108.658 -168.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -45.51 -46.75 14.08 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 126.416 1.886 . . . . 2.04 112.648 -148.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -40.37 -47.72 2.59 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.598 1.959 . . . . 3.25 112.812 174.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -54.22 -60.47 3.29 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 109.332 -0.618 . . . . 4.6299999999999999 109.332 176.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -44.69 95.84 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 118.458 -0.782 . . . . 5.1799999999999997 109.242 -175.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 9.2 mtp -47.54 -60.89 2.22 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.586 1.085 . . . . 3.79 110.508 175.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -63.31 -36.8 84.89 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.382 -0.372 . . . . 3.9100000000000001 110.546 -175.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 14.7 t -62.92 -41.28 99.4 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.015 0.526 . . . . 2.6899999999999999 111.204 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 29.9 mt -77.19 -51.25 11.29 Favored 'General case' 0 CA--C 1.527 0.079 0 C-N-CA 125.317 1.447 . . . . 1.21 110.394 -172.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -53.39 -14.9 0.85 Allowed 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 116.615 2.08 . . . . 2.1800000000000002 116.615 -165.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 17.8 m -36.43 -32.35 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 129.71 3.204 . . . . 1.9299999999999999 117.468 -139.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -65.55 -12.61 54.49 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.352 0.978 . . . . 2.8199999999999998 112.393 175.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 61.51 41.99 11.89 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 124.363 1.065 . . . . 3.1800000000000002 113.012 167.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 48.9 p30 -91.92 -7.93 47.76 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.456 1.502 . . . . 2.1800000000000002 111.48 163.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.0 m 65.31 10.14 6.24 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.985 1.314 . . . . 2.6400000000000001 113.78 -172.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . 0.407 ' OE2' ' NH1' ' B' ' 29' ' ' ARG . 35.5 mt-10 -99.44 154.12 18.46 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 108.447 -0.945 . . . . 2.8999999999999999 108.447 167.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -111.81 93.51 4.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 106.215 -1.772 . . . . 1.1100000000000001 106.215 168.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.69 178.98 7.72 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.412 0.685 . . . . 3.8399999999999999 110.705 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 40.6 p90 -91.61 52.28 2.02 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.885 0.698 . . . . 4.4800000000000004 112.885 -171.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -155.52 49.84 0.55 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 107.002 -1.481 . . . . 2.79 107.002 114.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -90.99 -60.88 1.8 Allowed 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 106.066 -1.828 . . . . 1.8999999999999999 106.066 140.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.507 ' CD1' HD13 ' B' ' 33' ' ' LEU . 65.3 t80 -52.8 -49.74 65.01 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 124.103 0.961 . . . . 4.0199999999999996 113.259 -168.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.521 ' CD2' ' HA2' ' A' ' 81' ' ' GLY . 0.3 OUTLIER -43.9 -34.32 1.61 Allowed 'General case' 0 C--N 1.341 0.233 0 O-C-N 123.786 0.679 . . . . 5.3300000000000001 111.206 177.34 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . 0.425 ' HA ' ' CH2' ' A' ' 77' ' ' TRP . 45.3 mtp180 -51.84 -52.95 45.69 Favored 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 120.098 -0.641 . . . . 4.9699999999999998 110.933 -175.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.632 ' O ' HD13 ' B' ' 83' ' ' LEU . 3.2 tp -57.56 -28.04 63.2 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 118.251 -1.38 . . . . 1.3799999999999999 110.811 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 45.1 mt -71.84 -47.89 53.82 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.346 0 N-CA-C 107.041 -1.466 . . . . 2.3399999999999999 107.041 -168.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.489 ' HA3' ' HE1' ' A' ' 77' ' ' TRP . . . -80.95 -27.99 47.74 Favored Glycine 0 N--CA 1.42 -2.37 0 CA-C-O 117.863 -1.521 . . . . 2.71 111.227 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -57.28 -47.45 81.42 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 105.264 -2.124 . . . . 3.3900000000000001 105.264 -173.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.632 HD13 ' O ' ' B' ' 79' ' ' LEU . 7.8 mp -38.54 -47.94 1.36 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.904 1.282 . . . . 2.6099999999999999 113.173 174.283 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.74 -29.8 70.96 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.87 0.868 . . . . 1.3500000000000001 111.573 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -80.28 -45.9 17.11 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 123.876 0.87 . . . . 1.47 111.24 167.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.39 -50.39 73.15 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.831 1.196 . . . . 3.5699999999999998 108.193 -171.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 14.3 tt -50.49 -39.22 17.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 123.454 0.701 . . . . 1.45 111.651 174.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.66 -19.11 42.37 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.537 1.535 . . . . 3.71 112.598 -176.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 42.3 tttp . . . . . 0 CA--C 1.535 0.368 0 C-N-CA 123.984 0.914 . . . . 5.3799999999999999 111.888 -161.626 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 . . . . . 0 N--CA 1.442 -0.854 0 N-CA-C 108.61 -0.885 . . . . 5.9500000000000002 108.61 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -70.14 141.15 42.97 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 121.951 1.767 . . . . 2.3300000000000001 108.133 173.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 86.7 mt -99.1 163.73 12.45 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 108.325 -0.991 . . . . 1.3300000000000001 108.325 -175.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.3 t -73.8 153.01 40.14 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 120.739 -1.225 . . . . 1.96 109.898 -175.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -45.07 -51.63 9.91 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 121.232 -0.918 . . . . 2.46 112.855 -174.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -58.9 -52.08 67.28 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 118.311 -0.852 . . . . 1.54 111.255 178.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -48.87 -55.05 12.82 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.083 2.153 . . . . 2.5600000000000001 111.767 173.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -52.52 -52.31 55.29 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.164 0.985 . . . . 3.0600000000000001 109.932 174.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.9 t -57.74 -50.6 72.68 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.385 0.674 . . . . 2.3900000000000001 111.08 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.279 2.8 pp -62.61 -37.68 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 O-C-N 121.247 -0.908 . . . . 0.66000000000000003 110.431 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -57.26 -59.4 5.16 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 119.344 0.974 . . . . 2.7200000000000002 109.965 174.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.6 t -53.92 -40.78 67.02 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 118.986 0.812 . . . . 1.8100000000000001 111.552 -172.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.1 m -76.34 -30.66 19.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 120.525 -1.359 . . . . 0.78000000000000003 112.108 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.3 t -64.37 -44.69 97.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 119.679 1.127 . . . . 0.59999999999999998 110.065 173.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.4 t -65.42 -42.25 92.7 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.46 -0.775 . . . . 0.90000000000000002 110.242 175.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 50.5 m -55.5 -50.62 69.46 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.906 0.775 . . . . 0.96999999999999997 110.147 173.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -48.25 -60.04 2.96 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 123.405 0.682 . . . . 3.2599999999999998 110.089 172.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -52.93 -51.56 60.91 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.226 1.01 . . . . 3.4300000000000002 111.571 -173.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.1 t -63.78 -25.15 68.05 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 118.493 -0.765 . . . . 2.2000000000000002 112.17 -176.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -81.54 -42.84 19.59 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 118.951 0.796 . . . . 2.6299999999999999 111.456 169.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -52.43 -40.25 61.98 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 120.872 -1.142 . . . . 1.1000000000000001 110.671 -179.09 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -19.21 61.04 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 116.065 -1.921 . . . . 4.9800000000000004 113.342 -178.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -45.0 -61.81 1.48 Allowed 'General case' 0 C--N 1.345 0.395 0 CA-C-N 120.758 1.617 . . . . 2.5499999999999998 110.133 -168.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -128.77 96.74 4.46 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 126.348 1.859 . . . . 5.5800000000000001 107.613 -177.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.38 149.83 0.11 Allowed Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.425 1.488 . . . . 1.3500000000000001 114.334 167.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 51.92 82.43 0.07 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.134 0.974 . . . . 5.8899999999999997 110.806 175.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -71.27 31.31 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.731 1.382 . . . . 3.6200000000000001 114.731 -175.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -139.57 22.06 2.52 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.604 1.562 . . . . 4.5099999999999998 108.657 167.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.8 m -154.82 140.48 17.99 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.925 -1.109 . . . . 2.71 113.165 -179.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.1 mp -103.94 117.36 34.13 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.14 1.376 . . . . 2.5800000000000001 112.705 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.2 t -83.69 177.04 8.55 Favored 'General case' 0 C--O 1.227 -0.131 0 O-C-N 120.84 -1.162 . . . . 2.7200000000000002 109.784 171.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.5 m -55.43 -50.18 67.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 112.903 0.705 . . . . 2.7799999999999998 112.903 -163.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -62.37 -57.4 11.45 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 118.604 0.638 . . . . 2.5299999999999998 109.781 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -38.1 -50.87 1.4 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.306 1.442 . . . . 2.1499999999999999 110.787 173.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.405 ' CD2' ' HG ' ' A' ' 71' ' ' LEU . 0.8 OUTLIER -58.64 -53.6 56.5 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 114.728 -1.124 . . . . 3.7200000000000002 110.226 177.892 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -60.71 -37.21 80.91 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 120.618 -0.433 . . . . 3.2400000000000002 110.06 -174.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -53.81 -37.45 63.56 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 119.076 -0.488 . . . . 3.6299999999999999 110.937 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.8 tp -68.63 -45.72 71.11 Favored 'General case' 0 C--N 1.339 0.115 0 CA-C-N 119.881 1.219 . . . . 2.3799999999999999 109.27 -177.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 10.2 m -69.42 -38.46 77.18 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.178 0 CA-C-O 121.457 0.646 . . . . 1.22 109.359 -173.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 74.8 m -69.42 -43.39 73.48 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 124.276 1.031 . . . . 1.3500000000000001 110.224 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -80.14 -60.47 2.32 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.095 0.558 . . . . 2.0699999999999998 111.783 -173.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . 0.507 ' O ' HG21 ' B' ' 7' ' ' THR . 3.1 mm-40 -79.45 -37.75 36.24 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 118.407 -0.806 . . . . 3.9100000000000001 113.011 -167.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.84 83.51 0.55 Allowed Pre-proline 0 N--CA 1.469 0.478 0 C-N-CA 125.127 1.371 . . . . 2.29 111.732 -165.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -64.81 -32.14 56.46 Favored 'Trans proline' 0 N--CA 1.449 -1.115 0 C-N-CA 122.659 2.239 . . . . 1.6200000000000001 111.898 178.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.37 -3.36 0.42 Allowed 'General case' 0 C--N 1.347 0.487 0 N-CA-C 118.332 2.716 . . . . 4.9900000000000002 118.332 -174.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.653 HD23 ' HB2' ' A' ' 83' ' ' LEU . 10.5 tp -58.89 -64.44 0.94 Allowed 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 120.536 1.516 . . . . 1.21 110.487 174.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 45.6 mt -78.67 -42.12 29.45 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 115.952 -0.567 . . . . 3.1000000000000001 110.97 -175.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 28.5 40.66 0.0 OUTLIER 'General case' 0 C--N 1.343 0.305 0 C-N-CA 129.281 3.032 . . . . 4.4100000000000001 114.603 -170.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -136.06 24.76 3.3 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.405 2.282 . . . . 5.0499999999999998 109.236 -176.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.1 m -58.02 -28.94 35.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 124.405 1.082 . . . . 2.0699999999999998 110.82 -178.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.16 -41.97 16.15 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 124.047 0.832 . . . . 1.98 111.877 172.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 87.3 p -104.43 34.23 3.19 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-N 117.979 0.889 . . . . 3.3300000000000001 111.166 -177.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -54.47 -35.02 62.59 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 121.001 -1.062 . . . . 1.3 110.567 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -56.07 -40.35 73.44 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.395 -0.816 . . . . 4.1600000000000001 111.954 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -69.2 -49.83 52.93 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 108.019 -1.104 . . . . 3.2400000000000002 108.019 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.92 -42.78 65.7 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 109.328 -0.619 . . . . 2.6600000000000001 109.328 177.111 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.5 tmm? -61.7 -52.53 63.9 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 124.686 1.194 . . . . 2.0 110.093 178.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -53.97 -38.93 65.52 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 118.744 -0.646 . . . . 2.9900000000000002 111.906 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.1 t -60.79 -61.54 2.51 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-N 118.908 0.776 . . . . 2.6099999999999999 109.198 168.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 28.5 mt -53.27 -61.31 2.38 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 125.29 1.436 . . . . 1.3999999999999999 112.36 -166.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -72.13 88.77 1.12 Allowed 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.028 -0.73 . . . . 2.0899999999999999 109.028 -171.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.9 m -49.07 -28.07 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 C-N-CA 124.299 1.04 . . . . 2.3399999999999999 113.71 -175.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -104.56 -11.66 16.86 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.031 1.332 . . . . 2.5800000000000001 112.845 178.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 52.69 50.4 18.22 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.473 1.109 . . . . 4.1399999999999997 111.361 177.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.0 p30 -82.33 -20.62 37.0 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 109.077 -0.712 . . . . 1.6499999999999999 109.077 166.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 78.95 26.57 0.45 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.244 1.418 . . . . 2.0899999999999999 111.449 176.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -135.13 120.73 19.37 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 104.313 -2.477 . . . . 5.3899999999999997 104.313 162.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.405 ' HG ' ' CD2' ' A' ' 38' ' ' PHE . 0.8 OUTLIER -93.31 90.99 7.01 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.057 -1.46 . . . . 1.1899999999999999 107.057 -168.037 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.0 pttt -76.22 169.59 17.93 Favored 'General case' 0 CA--C 1.528 0.113 0 O-C-N 123.147 0.279 . . . . 4.0999999999999996 110.726 -178.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.2 p90 -36.66 -61.63 0.52 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.441 1.275 . . . . 6.2599999999999998 114.441 -163.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.98 -26.56 54.05 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.539 1.063 . . . . 2.23 111.212 -175.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -64.98 -56.75 11.36 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 108.374 -0.973 . . . . 2.0800000000000001 108.374 174.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -48.9 -54.93 13.34 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.871 1.268 . . . . 3.1499999999999999 109.775 173.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 59.2 t90 -46.85 -41.89 16.44 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.955 0.902 . . . . 4.2300000000000004 111.956 -168.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 23.6 ttp85 -45.06 -40.67 6.91 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 118.305 -0.855 . . . . 3.6800000000000002 111.357 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 6.6 tp -45.09 -50.35 11.1 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 118.154 -0.927 . . . . 0.94999999999999996 111.87 177.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 92.1 mt -58.81 -32.03 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 108.316 -0.994 . . . . 1.6399999999999999 108.316 -176.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.616 ' HA3' ' CE2' ' B' ' 77' ' ' TRP . . . -70.0 -50.14 30.63 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 127.072 2.273 . . . . 1.24 112.103 177.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.444 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 3.0 mt-10 -58.2 -62.9 1.49 Allowed 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 106.775 -1.565 . . . . 2.8999999999999999 106.775 177.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.653 ' HB2' HD23 ' A' ' 49' ' ' LEU 0.262 4.3 pp -53.34 -37.42 62.31 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.301 0.955 . . . . 2.1099999999999999 112.305 177.23 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.52 -62.11 1.9 Allowed 'General case' 0 C--N 1.342 0.245 0 CA-C-N 119.179 0.9 . . . . 2.1899999999999999 111.073 173.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . 0.275 0.0 OUTLIER -70.2 -20.09 63.13 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 119.095 -1.042 . . . . 1.98 112.042 -174.75 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 5.3 mm-40 -56.31 -31.35 63.6 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 118.144 -0.931 . . . . 2.6200000000000001 110.676 173.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.5 tt -58.81 -12.49 2.64 Favored 'Isoleucine or valine' 0 C--N 1.348 0.501 0 N-CA-C 113.417 0.895 . . . . 1.5600000000000001 113.417 173.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 5.5 ptm85 -118.75 -38.43 3.11 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 118.918 0.781 . . . . 4.2199999999999998 112.079 172.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.536 0.408 0 N-CA-C 116.565 2.061 . . . . 3.3100000000000001 116.565 -177.028 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 66.1 mt . . . . . 0 CA--C 1.555 1.141 0 N-CA-C 112.675 0.62 . . . . 3.5299999999999998 112.675 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.688 HG22 ' CG ' ' B' ' 10' ' ' GLU . 2.2 t -66.51 178.04 1.37 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.451 1.501 . . . . 2.0499999999999998 111.224 178.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -59.26 -61.54 2.55 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.436 -0.79 . . . . 2.6899999999999999 112.387 -175.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 14.4 mt -53.63 -43.61 68.84 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.162 -0.961 . . . . 1.28 111.68 175.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . 0.688 ' CG ' HG22 ' B' ' 7' ' ' THR . 69.5 mt-10 -53.73 -48.19 69.87 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 124.761 1.225 . . . . 3.54 111.785 175.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -59.15 -46.99 86.93 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 120.609 -1.307 . . . . 4.5199999999999996 109.772 173.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 16.1 m -57.44 -43.78 84.17 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.479 0.712 . . . . 1.6699999999999999 110.977 -175.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.256 2.3 pp -67.05 -41.32 87.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.149 0 CA-C-O 118.479 -0.772 . . . . 1.05 111.385 172.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -53.49 -56.75 14.37 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.258 0.935 . . . . 2.3999999999999999 110.661 178.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.9 t -49.33 -45.8 45.97 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 118.996 0.816 . . . . 1.3 111.968 -174.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 20.3 m -72.62 -38.18 58.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 O-C-N 120.808 -1.182 . . . . 0.92000000000000004 111.395 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 43.8 t -58.04 -41.28 80.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 O-C-N 121.823 -0.548 . . . . 1.0600000000000001 110.218 174.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . 0.257 11.9 t -70.64 -41.23 72.43 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 118.205 -0.902 . . . . 1.1899999999999999 111.257 176.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 4.0 m -51.21 -52.43 44.58 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-N 120.649 1.568 . . . . 1.0900000000000001 109.991 171.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . 0.461 ' CZ ' HD23 ' B' ' 33' ' ' LEU . 25.2 t80 -51.9 -61.07 2.49 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.362 0.665 . . . . 4.2300000000000004 110.09 174.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -61.74 -40.92 96.79 Favored 'General case' 0 C--N 1.334 -0.107 0 C-N-CA 123.463 0.705 . . . . 3.3100000000000001 111.517 -168.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 41.1 p -60.96 -60.09 4.35 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.474 -0.565 . . . . 2.25 109.474 173.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -57.99 -35.12 70.76 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.417 0.553 . . . . 3.6600000000000001 111.346 -174.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.04 -29.31 43.38 Favored 'General case' 0 CA--C 1.513 -0.448 0 C-N-CA 127.182 2.193 . . . . 1.0600000000000001 110.929 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -47.06 -34.31 5.71 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 124.241 0.963 . . . . 4.5300000000000002 111.873 175.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.84 -66.55 0.48 Allowed 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 115.963 1.838 . . . . 1.71 115.963 -146.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -91.2 -75.89 0.46 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 119.24 -0.984 . . . . 3.0299999999999998 113.089 -167.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.44 156.19 23.18 Favored Glycine 0 C--N 1.338 0.667 0 C-N-CA 127.394 2.426 . . . . 2.3900000000000001 109.666 160.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 47.4 102.37 0.0 OUTLIER 'General case' 0 C--O 1.242 0.684 0 N-CA-C 114.775 1.398 . . . . 4.6100000000000003 114.775 144.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -71.5 47.28 0.12 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.13 1.372 . . . . 4.1699999999999999 112.867 176.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -157.24 -51.69 0.07 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.674 0.79 . . . . 3.1699999999999999 109.448 -173.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 33.9 p -85.36 146.39 27.03 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 123.126 0.57 . . . . 1.6299999999999999 110.366 172.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.461 HD23 ' CZ ' ' B' ' 20' ' ' PHE . 0.7 OUTLIER -92.5 178.41 5.82 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 108.2 -1.037 . . . . 2.0800000000000001 108.2 164.013 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . 0.41 ' C ' ' O ' ' B' ' 35' ' ' VAL . 28.0 m -154.23 -175.98 5.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 122.077 0.941 . . . . 2.8999999999999999 110.46 -143.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.41 ' O ' ' C ' ' B' ' 34' ' ' SER . 21.7 t -73.18 -166.15 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 N-CA-C 100.781 -3.785 . . . . 3.3700000000000001 100.781 141.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.47 51.85 1.93 Allowed 'General case' 0 CA--C 1.552 1.057 0 O-C-N 116.709 -3.744 . . . . 3.71 113.114 -111.038 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -61.58 -59.41 5.25 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 126.796 2.038 . . . . 1.6299999999999999 108.887 125.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.472 ' CE2' HD13 ' B' ' 63' ' ' LEU . 0.4 OUTLIER -54.96 -44.42 74.35 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 119.727 -0.789 . . . . 2.2200000000000002 111.786 -163.252 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.87 -35.36 68.83 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.477 -0.764 . . . . 2.8999999999999999 111.806 176.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -56.39 -31.98 64.37 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.474 0.579 . . . . 3.1000000000000001 111.726 177.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -64.43 -55.11 23.07 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 119.294 0.952 . . . . 2.6600000000000001 108.648 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 13.8 m -69.05 -38.47 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 114.486 -1.233 . . . . 0.93999999999999995 109.256 -170.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 85.5 m -63.63 -57.67 9.33 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.328 1.051 . . . . 1.23 110.958 174.09 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -76.01 -60.79 2.17 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 122.136 -0.353 . . . . 2.46 111.025 -165.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.81 -47.37 12.93 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 122.314 -0.241 . . . . 3.0600000000000001 111.096 -171.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 2.1 tp -84.3 -16.44 0.23 Allowed Pre-proline 0 CA--C 1.544 0.738 0 N-CA-C 120.893 3.664 . . . . 2.0699999999999998 120.893 -151.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -44.4 -50.97 7.45 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 123.51 2.806 . . . . 1.8700000000000001 116.053 -143.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 42.6 t-80 -76.91 48.95 0.62 Allowed 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.777 0.717 . . . . 3.4100000000000001 112.215 -176.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' B' ' 49' ' ' LEU . 13.2 tp -150.99 -61.62 0.18 Allowed 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 124.257 1.023 . . . . 0.95999999999999996 109.738 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 96.7 mt -109.59 112.37 24.42 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.378 -0.971 . . . . 1.6899999999999999 108.378 169.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.3 -165.06 0.71 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 108.779 -0.823 . . . . 5.0300000000000002 108.779 170.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 64.64 24.84 13.03 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.849 1.26 . . . . 3.9700000000000002 110.626 169.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 33.0 m -61.62 -18.94 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 125.009 1.324 . . . . 1.76 113.03 -168.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.15 -52.85 49.35 Favored Glycine 0 CA--C 1.53 1.016 0 N-CA-C 110.305 -1.118 . . . . 2.77 110.305 168.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 22.6 t -81.29 34.66 0.37 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.797 1.239 . . . . 2.3900000000000001 111.534 -171.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -60.03 -25.19 65.12 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.201 1.4 . . . . 1.22 110.246 -174.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -52.29 -33.01 40.25 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.113 1.365 . . . . 3.3700000000000001 113.215 173.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -58.25 -44.67 88.44 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 120.044 1.293 . . . . 2.5800000000000001 109.049 175.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -70.73 -49.18 49.73 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 107.419 -1.326 . . . . 4.0800000000000001 107.419 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 13.9 tpt -39.68 -55.89 1.81 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.687 1.13 . . . . 2.54 110.615 176.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -60.92 -52.46 64.95 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.592 -0.276 . . . . 3.3199999999999998 111.088 178.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.2 m -58.62 -30.37 67.21 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.082 0.771 . . . . 1.6799999999999999 113.082 -178.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.472 HD13 ' CE2' ' B' ' 38' ' ' PHE . 60.3 mt -81.67 -55.28 4.75 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 126.183 1.793 . . . . 1.25 109.855 -176.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.26 2.9 t70 -68.72 -10.96 59.47 Favored 'General case' 0 C--O 1.218 -0.602 0 N-CA-C 115.083 1.512 . . . . 2.23 115.083 -170.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 18.9 m -31.98 -23.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 N-CA-C 120.069 3.359 . . . . 1.71 120.069 -134.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -51.43 -34.38 34.67 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 121.106 1.776 . . . . 2.98 110.223 157.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 65.48 47.5 2.25 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.993 1.317 . . . . 2.9300000000000002 109.163 174.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 27.2 p30 -76.9 -29.13 55.6 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.188 -0.915 . . . . 1.9299999999999999 108.815 168.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 4.0 m 96.14 -5.98 0.08 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 128.25 2.62 . . . . 2.3599999999999999 113.503 178.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -101.68 119.13 38.29 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 107.094 -1.447 . . . . 2.77 107.094 170.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.23 112.33 20.65 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.696 -1.224 . . . . 1.27 107.696 178.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.43 173.35 11.58 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.932 2.093 . . . . 2.9500000000000002 110.719 -177.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -82.72 52.73 2.18 Favored 'General case' 0 C--N 1.345 0.407 0 O-C-N 121.08 -1.013 . . . . 3.8500000000000001 111.004 176.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -169.58 48.07 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 106.498 -1.667 . . . . 2.54 106.498 125.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -97.38 -64.18 1.06 Allowed 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 119.841 -1.787 . . . . 1.98 109.265 152.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.455 ' CD2' ' CZ ' ' B' ' 38' ' ' PHE . 22.6 t80 -49.07 -48.71 43.89 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 125.327 1.451 . . . . 3.4500000000000002 110.138 -177.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 0.7 OUTLIER -53.28 -31.64 44.76 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.494 -1.23 . . . . 4.7599999999999998 110.886 -169.626 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . 0.469 ' HB2' ' CD2' ' B' ' 63' ' ' LEU . 28.4 mmt180 -40.16 -46.71 2.27 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.951 0.9 . . . . 4.4900000000000002 112.283 170.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 2.8 tp -54.45 -37.18 64.87 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 117.908 0.322 . . . . 0.97999999999999998 110.886 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 84.3 mt -63.85 -32.93 58.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 108.31 -0.996 . . . . 1.3600000000000001 108.31 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.54 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -72.24 -40.88 54.78 Favored Glycine 0 CA--C 1.491 -1.459 0 C-N-CA 124.523 1.059 . . . . 1.46 110.688 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' B' ' 86' ' ' GLU . 1.2 mm-40 -64.67 -64.92 0.75 Allowed 'General case' 0 N--CA 1.433 -1.308 0 N-CA-C 106.075 -1.824 . . . . 2.25 106.075 177.085 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 3.8 pp -55.44 -34.58 64.58 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 118.533 0.606 . . . . 1.8200000000000001 112.341 -173.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.65 -62.13 2.08 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 118.346 0.521 . . . . 1.49 111.042 170.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.302 0.0 OUTLIER -63.41 -30.63 71.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 118.219 -0.896 . . . . 1.8300000000000001 111.428 -173.574 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' B' ' 82' ' ' GLU . 12.1 mm-40 -54.21 -26.14 26.79 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.15 0.98 . . . . 2.8599999999999999 111.952 177.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 3.5 tt -59.4 -38.28 74.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 119.802 1.183 . . . . 1.24 110.834 172.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -82.35 -41.84 19.49 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.6 1.96 . . . . 3.7799999999999998 110.583 176.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.224 -0.247 0 C-N-CA 126.442 1.897 . . . . 5.0499999999999998 111.011 -165.981 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 . . . . . 0 CA--C 1.538 0.502 0 CA-C-O 117.924 -1.036 . . . . 7.5899999999999999 110.969 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -71.64 161.98 43.57 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 CA-C-N 121.05 1.411 . . . . 3.9100000000000001 109.727 170.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.5 mt -130.62 -157.9 0.85 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.716 1.606 . . . . 1.9199999999999999 108.344 -171.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 57.3 m -60.55 144.79 50.75 Favored 'General case' 0 C--O 1.224 -0.243 0 O-C-N 120.506 -1.371 . . . . 3.8199999999999998 109.909 176.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -35.58 -66.86 0.18 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.948 1.299 . . . . 3.7000000000000002 111.756 170.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.21 -32.69 74.15 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.377 -1.297 . . . . 2.0899999999999999 113.022 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -52.91 -49.5 65.82 Favored 'General case' 0 C--N 1.347 0.477 0 CA-C-N 120.855 1.661 . . . . 2.25 111.515 168.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -49.5 -51.77 34.04 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 108.493 -0.929 . . . . 3.0800000000000001 108.493 175.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.5 m -60.43 -53.14 61.1 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.647 -0.706 . . . . 1.99 111.862 -175.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.272 2.7 pp -64.88 -38.49 82.9 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 O-C-N 121.577 -0.702 . . . . 0.80000000000000004 109.741 -176.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -62.47 -50.13 72.65 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.645 -0.66 . . . . 3.0299999999999998 111.222 175.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 t -58.93 -34.65 71.96 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.073 0.851 . . . . 1.2 111.749 -173.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 23.0 m -77.13 -41.44 30.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 O-C-N 121.171 -0.956 . . . . 0.72999999999999998 110.878 174.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.9 t -53.91 -47.7 63.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 118.923 0.783 . . . . 0.76000000000000001 110.81 175.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.9 t -62.67 -43.16 99.51 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.454 -0.779 . . . . 0.88 110.897 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 39.1 m -59.9 -50.2 74.7 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.877 -0.514 . . . . 1.05 109.689 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -47.73 -56.93 6.26 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.461 0.705 . . . . 3.0699999999999998 110.585 169.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -60.3 -45.32 93.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.077 0.551 . . . . 3.29 111.178 -169.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.4 t -61.31 -32.36 72.22 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 120.061 -0.656 . . . . 2.5299999999999998 110.789 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -70.19 -43.95 69.69 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-N 119.432 1.015 . . . . 3.0299999999999998 110.72 168.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.13 -38.59 39.76 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 124.748 1.219 . . . . 1.05 111.797 -171.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.8 ptt85 -75.63 -20.45 58.5 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 117.563 -1.208 . . . . 4.5700000000000003 113.877 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -47.77 -57.9 5.01 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 120.1 1.318 . . . . 2.3300000000000001 112.898 -166.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -120.66 93.57 4.08 Favored 'General case' 0 C--O 1.242 0.704 0 C-N-CA 128.541 2.736 . . . . 3.1299999999999999 106.08 -171.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 48.59 -174.19 0.03 OUTLIER Glycine 0 CA--C 1.526 0.736 0 C-N-CA 125.699 1.619 . . . . 1.71 112.37 -176.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.3 mmt-85 29.74 97.46 0.0 OUTLIER 'General case' 0 C--O 1.24 0.596 0 C-N-CA 126.09 1.756 . . . . 4.75 112.846 164.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.53 40.87 0.38 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.598 1.559 . . . . 5.5999999999999996 109.167 177.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -154.81 -51.87 0.09 Allowed 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 106.285 -1.746 . . . . 4.9699999999999998 106.285 -145.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.5 p -115.16 139.3 50.03 Favored 'General case' 0 C--O 1.246 0.889 0 C-N-CA 125.566 1.546 . . . . 2.2400000000000002 111.097 172.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -101.4 117.64 35.35 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 113.727 -1.579 . . . . 2.5 108.241 -176.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 19.0 m -88.35 174.98 7.84 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.074 1.75 . . . . 2.1200000000000001 110.999 178.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.5 m -58.82 -48.82 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 O-C-N 121.395 -0.816 . . . . 2.6800000000000002 112.979 -172.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -68.35 -47.38 67.62 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-O 118.4 -0.81 . . . . 2.9500000000000002 109.518 -178.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -41.81 -46.91 4.04 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.059 0.845 . . . . 2.1000000000000001 112.02 168.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.401 ' CZ ' HD13 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -56.71 -59.99 4.21 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.168 0.587 . . . . 2.8999999999999999 110.602 172.986 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -57.93 -41.18 82.23 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.491 0.716 . . . . 2.6899999999999999 111.32 -172.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -47.84 -40.63 21.85 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.137 0.975 . . . . 3.1899999999999999 112.122 174.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.32 -52.47 65.49 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 119.617 1.098 . . . . 3.1800000000000002 108.113 -178.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.1 m -72.94 -50.87 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 CA-C-N 114.919 -1.037 . . . . 1.6100000000000001 109.703 -169.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.2 m -57.36 -44.31 84.27 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 125.401 1.48 . . . . 1.6000000000000001 111.656 178.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -60.22 -62.34 1.94 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.78 0.718 . . . . 3.7400000000000002 110.999 -173.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -145.15 38.53 1.17 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.493 0.923 . . . . 4.6900000000000004 113.493 -173.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.58 HD21 HD22 ' A' ' 83' ' ' LEU . 0.6 OUTLIER -129.13 31.75 0.22 Allowed Pre-proline 0 CA--C 1.549 0.934 0 N-CA-C 116.074 1.879 . . . . 2.2400000000000002 116.074 178.857 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -62.38 -60.52 0.19 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.852 2.368 . . . . 2.5099999999999998 114.232 -165.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -66.3 -37.96 86.63 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 121.337 -0.852 . . . . 4.2599999999999998 111.421 -175.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.459 HD13 HD12 ' B' ' 6' ' ' LEU . 22.5 tp -65.66 -54.32 29.11 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.993 0.517 . . . . 1.48 110.027 -173.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.5 mt -107.63 87.71 2.56 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-O 121.841 0.829 . . . . 2.1000000000000001 109.533 169.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.69 160.35 0.66 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 113.981 -1.463 . . . . 5.5300000000000002 111.645 170.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 57.53 39.66 27.62 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.205 1.002 . . . . 5.3899999999999997 111.098 168.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -41.28 -34.57 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 128.186 2.594 . . . . 2.6299999999999999 112.658 177.073 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -39.75 -48.69 3.23 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.153 0.883 . . . . 1.71 112.006 174.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.6 t -91.95 20.72 5.49 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.763 0.825 . . . . 1.9099999999999999 113.226 -172.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.498 ' C ' HD13 ' A' ' 56' ' ' LEU . 1.5 tm? -39.2 -46.38 1.48 Allowed 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 125.642 1.577 . . . . 1.72 111.897 173.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -49.94 -37.5 32.22 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.932 2.093 . . . . 4.5599999999999996 111.75 -174.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -58.49 -52.9 63.67 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 121.535 0.683 . . . . 2.96 109.781 173.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -49.51 76.05 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 107.933 -1.136 . . . . 2.9300000000000002 107.933 -178.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -49.51 -54.6 17.02 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.414 0.686 . . . . 1.6100000000000001 110.651 177.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -59.83 -43.78 94.41 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 122.346 -0.221 . . . . 2.9500000000000002 111.203 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.6 t -60.24 -44.1 95.53 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.831 0.824 . . . . 1.8899999999999999 111.185 178.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.401 HD13 ' CZ ' ' A' ' 38' ' ' PHE . 11.0 mt -64.69 -46.3 82.96 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.531 1.133 . . . . 2.1699999999999999 110.601 -179.046 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -69.11 77.0 0.34 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.439 1.096 . . . . 1.6399999999999999 110.629 -177.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.0 m -46.15 -43.35 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 C-N-CA 124.673 1.189 . . . . 1.6799999999999999 113.648 -172.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -96.82 6.6 48.36 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.436 0.694 . . . . 2.2400000000000002 112.254 -176.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 37.5 56.8 1.42 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.831 2.053 . . . . 3.1000000000000001 112.189 -177.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 50.6 p30 -94.42 -5.92 45.22 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.929 1.292 . . . . 1.6299999999999999 110.565 177.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.9 m 67.8 19.94 9.49 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.892 1.277 . . . . 1.73 111.583 -174.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -131.03 109.39 10.47 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.685 -1.598 . . . . 3.0299999999999998 106.685 174.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.422 ' CD2' ' N ' ' A' ' 71' ' ' LEU . 0.1 OUTLIER -83.53 105.39 14.42 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 103.86 -2.644 . . . . 1.23 103.86 171.838 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 164.86 1.24 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 108.71 -0.848 . . . . 4.04 108.71 169.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -38.05 -60.55 0.74 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.923 1.289 . . . . 4.7000000000000002 110.98 175.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -67.78 -26.64 66.2 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.229 1.012 . . . . 1.5600000000000001 112.264 -175.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -73.36 -59.07 2.88 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.804 0.729 . . . . 2.1600000000000001 109.067 174.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -51.8 -47.86 64.08 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 109.422 -0.584 . . . . 2.5499999999999998 109.422 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.675 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 55.4 t90 -46.5 -39.53 10.95 Favored 'General case' 0 N--CA 1.44 -0.94 0 O-C-N 124.312 1.007 . . . . 4.1299999999999999 111.528 -175.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 70.6 mtt180 -43.43 -40.99 4.04 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.676 0.671 . . . . 4.0300000000000002 112.756 175.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 28.7 tp -52.55 -44.64 65.97 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.065 0.546 . . . . 1.05 111.149 179.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 55.1 mt -60.23 -28.34 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 N-CA-C 108.0 -1.111 . . . . 1.47 108.0 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.587 ' CA ' ' CZ2' ' B' ' 77' ' ' TRP . . . -68.88 -52.76 22.68 Favored Glycine 0 CA--C 1.492 -1.367 0 C-N-CA 126.547 2.022 . . . . 1.27 111.896 178.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.43 -59.71 5.01 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 105.792 -1.929 . . . . 2.3799999999999999 105.792 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.58 HD22 HD21 ' A' ' 46' ' ' LEU 0.298 4.3 pp -54.35 -38.43 66.07 Favored 'General case' 0 CA--C 1.551 1.015 0 O-C-N 121.339 -0.851 . . . . 1.95 112.768 179.016 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . 0.463 ' O ' HG22 ' A' ' 87' ' ' ILE . . . -62.84 -29.01 70.41 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.091 -1.005 . . . . 1.25 113.528 175.016 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -81.06 -44.16 18.42 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.601 1.56 . . . . 1.6899999999999999 109.691 174.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -63.29 -25.73 68.45 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.82 1.248 . . . . 2.5899999999999999 111.162 -175.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 84' ' ' ALA . 12.4 tt -48.23 -34.37 4.85 Favored 'Isoleucine or valine' 0 C--N 1.344 0.34 0 CA-C-N 119.259 0.936 . . . . 1.4199999999999999 112.825 167.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 38.1 ttp180 -96.51 -48.6 5.48 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.611 1.164 . . . . 5.1100000000000003 108.669 177.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 74.1 tttt . . . . . 0 CA--C 1.539 0.553 0 N-CA-C 113.527 0.936 . . . . 2.8599999999999999 113.527 -173.197 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.81 HD12 ' HG3' ' B' ' 10' ' ' GLU . 5.9 mt . . . . . 0 CA--C 1.544 0.72 0 N-CA-C 113.759 1.022 . . . . 4.2400000000000002 113.759 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 6.8 t -170.09 -175.41 2.0 Allowed 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 120.204 1.366 . . . . 2.25 110.989 -172.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 70.8 tt0 -71.42 -67.25 0.53 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.848 1.204 . . . . 2.71 112.118 -167.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 11.9 mt -48.97 -42.34 37.31 Favored 'General case' 0 C--N 1.34 0.196 0 O-C-N 121.615 -0.678 . . . . 1.26 110.793 173.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . 0.81 ' HG3' HD12 ' B' ' 6' ' ' LEU . 11.3 tm-20 -48.94 -61.29 2.14 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 117.76 -1.114 . . . . 5.8399999999999999 112.472 169.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -51.51 -41.6 61.11 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 121.402 1.91 . . . . 3.75 109.946 178.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.2 t -61.83 -30.4 70.81 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 118.334 -0.841 . . . . 1.6299999999999999 112.839 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.408 ' CD1' HD12 ' A' ' 87' ' ' ILE 0.284 2.7 pp -80.51 -35.68 15.4 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 119.842 1.201 . . . . 1.0900000000000001 110.892 167.341 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -52.38 -53.32 46.33 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 108.066 -1.087 . . . . 3.0299999999999998 108.066 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 7.8 t -55.02 -35.4 64.38 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.115 0.783 . . . . 1.25 113.115 -175.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 20.0 m -80.11 -37.09 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 O-C-N 120.807 -1.183 . . . . 0.77000000000000002 110.172 175.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 43.4 t -58.65 -45.57 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 123.807 0.843 . . . . 0.87 110.593 177.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 8.9 t -60.79 -44.08 97.29 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 119.853 1.206 . . . . 1.3400000000000001 110.609 175.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 23.1 m -57.77 -52.16 66.61 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 119.094 0.861 . . . . 1.0600000000000001 109.733 178.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -46.83 -60.88 2.13 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.186 1.394 . . . . 3.8999999999999999 110.968 171.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -59.49 -49.72 76.68 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.977 1.311 . . . . 2.8300000000000001 110.975 -171.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 34.6 p -56.15 -56.68 17.96 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 118.915 -0.564 . . . . 2.1899999999999999 109.819 177.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -52.71 -47.24 67.43 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 119.099 0.863 . . . . 2.8300000000000001 111.338 175.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.39 -29.7 58.99 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.366 1.467 . . . . 1.2 110.653 -175.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.07 -21.25 58.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 117.435 -1.269 . . . . 5.5199999999999996 113.289 177.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.08 -65.03 0.71 Allowed 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 118.148 -1.421 . . . . 2.0299999999999998 114.56 -156.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -88.41 -80.21 0.29 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 119.279 -0.968 . . . . 3.48 112.774 -162.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.34 170.05 29.62 Favored Glycine 0 C--N 1.34 0.774 0 C-N-CA 128.802 3.096 . . . . 2.29 110.834 148.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 61.29 87.58 0.09 Allowed 'General case' 0 C--O 1.241 0.622 0 N-CA-C 112.283 0.475 . . . . 4.9299999999999997 112.283 140.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -74.83 52.72 0.55 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 125.631 1.572 . . . . 3.52 110.833 174.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -161.94 -58.74 0.05 OUTLIER 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 107.842 -1.17 . . . . 3.9199999999999999 107.842 -172.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 17.1 m -96.66 142.27 28.9 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 124.135 0.974 . . . . 3.5499999999999998 110.486 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -83.18 131.96 35.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.313 1.045 . . . . 2.1099999999999999 109.058 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 1.3 p -114.8 174.44 5.97 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.848 1.259 . . . . 2.5299999999999998 108.724 171.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.81 51.23 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.338 0.087 0 O-C-N 121.255 -0.903 . . . . 2.5499999999999998 111.143 -170.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -155.2 53.74 0.63 Allowed 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 105.416 -2.068 . . . . 2.0299999999999998 105.416 145.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -149.24 -54.45 0.17 Allowed 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 130.683 3.593 . . . . 2.0099999999999998 104.527 173.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.48 -55.11 28.05 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.174 -0.921 . . . . 2.2799999999999998 109.192 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 42.5 tttt -61.21 -41.73 97.36 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 120.296 -0.561 . . . . 2.98 111.118 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 83.4 mt-10 -51.41 -40.39 59.22 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 118.134 0.425 . . . . 3.1099999999999999 111.587 177.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 10.2 tt -67.98 -47.3 68.94 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 109.15 -0.685 . . . . 1.8899999999999999 109.15 -175.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.4 m -68.52 -47.82 75.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 109.873 -0.417 . . . . 0.83999999999999997 109.873 -176.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 55.8 m -60.29 -55.26 35.83 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.381 1.072 . . . . 0.92000000000000004 111.501 178.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -79.02 -58.81 3.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 118.25 0.477 . . . . 2.46 110.52 -171.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -80.98 -50.67 9.41 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 121.203 0.525 . . . . 2.9399999999999999 110.387 -166.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.79 -16.93 0.23 Allowed Pre-proline 0 CA--C 1.543 0.702 0 N-CA-C 120.158 3.392 . . . . 1.8600000000000001 120.158 -163.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -39.91 -50.69 3.26 Favored 'Trans proline' 0 CA--C 1.532 0.386 0 C-N-CA 125.038 3.825 . . . . 2.3999999999999999 116.841 -134.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 13.2 t-160 -66.46 -30.94 71.39 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.968 0.729 . . . . 2.2200000000000002 112.968 -172.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 29.2 tp -67.64 -73.49 0.14 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.573 0.624 . . . . 1.1899999999999999 110.096 -170.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 60.6 mt -79.42 78.96 5.91 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 108.218 -1.03 . . . . 1.6699999999999999 108.218 170.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.18 169.91 0.76 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.67 -0.695 . . . . 4.9299999999999997 110.243 167.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 66.85 40.03 3.23 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.233 1.413 . . . . 4.7599999999999998 109.602 -167.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 27.3 m -59.78 -24.3 28.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 C-N-CA 124.188 0.995 . . . . 2.0 111.854 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.6 -67.03 2.28 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 109.408 -1.477 . . . . 2.4700000000000002 109.408 171.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.8 m -72.02 61.73 0.44 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 127.032 2.133 . . . . 3.1699999999999999 111.292 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -80.9 -37.62 29.39 Favored 'General case' 0 N--CA 1.439 -1.019 0 C-N-CA 124.449 1.1 . . . . 1.1200000000000001 109.178 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -54.63 -49.76 69.75 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.55 0.74 . . . . 3.5299999999999998 111.342 -175.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.63 -38.39 81.22 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 121.872 -0.517 . . . . 3.0800000000000001 111.348 176.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.23 -54.13 48.05 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.352 0.661 . . . . 4.04 109.392 176.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -52.75 -52.68 55.44 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 126.321 1.848 . . . . 1.6000000000000001 110.136 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 77.3 mttt -58.33 -45.96 87.1 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.183 0.593 . . . . 4.2999999999999998 110.358 178.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 12.3 t -57.96 -44.72 87.2 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.095 0.558 . . . . 1.6000000000000001 110.551 177.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 22.9 mt -63.42 -45.03 92.83 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.136 0.575 . . . . 1.75 111.356 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.328 16.1 t0 -51.66 -8.35 0.06 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 118.799 2.888 . . . . 2.1099999999999999 118.799 -169.202 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 26.9 m -34.07 -19.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.539 1 C-N-CA 131.982 4.113 . . . . 1.8700000000000001 119.276 -137.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -36.62 62.79 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 120.366 1.439 . . . . 3.1800000000000002 109.656 160.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 66.62 63.51 0.5 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 125.586 1.555 . . . . 4.3300000000000001 109.268 -171.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 30.0 p30 -120.35 -16.13 8.48 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.859 2.063 . . . . 2.4399999999999999 112.668 -175.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.5 m 70.87 22.37 4.74 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.247 1.819 . . . . 2.6899999999999999 113.093 -176.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -128.5 112.44 14.34 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.16 -1.793 . . . . 3.3700000000000001 106.16 166.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -81.02 110.57 16.68 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 106.403 -1.703 . . . . 1.4099999999999999 106.403 174.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 10.5 tppt? -79.0 168.66 19.37 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.518 -0.919 . . . . 3.7200000000000002 108.518 -173.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 20.0 p90 -91.26 50.42 1.75 Allowed 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.999 -0.438 . . . . 5.3300000000000001 110.314 174.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -156.7 48.43 0.46 Allowed 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 106.661 -1.607 . . . . 2.25 106.661 119.158 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -94.65 -62.12 1.38 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.897 1.679 . . . . 2.6200000000000001 109.078 142.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -44.91 -48.73 11.26 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 125.883 1.673 . . . . 3.7400000000000002 110.078 -173.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.675 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 4.1 t-105 -44.74 -37.13 3.55 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.627 -1.178 . . . . 4.7000000000000002 111.76 -178.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 1.7 ttt85 -40.11 -47.26 2.32 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 119.987 1.267 . . . . 6.7999999999999998 110.864 174.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 15.8 tp -44.19 -47.07 9.16 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.637 0.775 . . . . 0.85999999999999999 110.599 -178.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 53.9 mt -62.76 -34.0 63.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.988 0.899 . . . . 1.6000000000000001 109.559 -173.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.572 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -72.53 -42.81 46.86 Favored Glycine 0 CA--C 1.487 -1.7 0 N-CA-C 109.544 -1.423 . . . . 1.47 109.544 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.262 5.0 mm-40 -67.07 -48.41 68.34 Favored 'General case' 0 N--CA 1.421 -1.882 0 N-CA-C 105.535 -2.024 . . . . 3.29 105.535 -175.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 7.7 mt -42.9 -58.07 2.55 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 121.262 1.846 . . . . 2.2200000000000002 111.896 166.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.42 -23.46 49.62 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.618 0.767 . . . . 1.3 112.536 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.01 -57.21 3.74 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.453 1.101 . . . . 2.0299999999999998 110.581 170.47 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -57.53 -28.03 63.13 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 129.01 2.924 . . . . 2.79 111.68 -168.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 2.9 tt -49.58 -44.17 18.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 O-C-N 122.014 -0.429 . . . . 1.1399999999999999 110.662 168.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -85.56 -61.65 1.71 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.62 1.568 . . . . 3.8599999999999999 113.67 167.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 35.3 tttm . . . . . 0 CA--C 1.534 0.329 0 C-N-CA 125.75 1.62 . . . . 7.1399999999999997 110.947 -173.652 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 . . . . . 0 N--CA 1.45 -0.426 0 CA-C-O 118.995 -0.526 . . . . 4.6600000000000001 110.565 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.51 113.1 3.63 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 122.346 2.031 . . . . 2.4300000000000002 109.269 178.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 61.5 mt -69.23 164.2 23.25 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.076 0.55 . . . . 1.4399999999999999 110.312 177.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.4 t -76.63 162.21 27.93 Favored 'General case' 0 CA--C 1.528 0.109 0 N-CA-C 108.992 -0.744 . . . . 2.0 108.992 176.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.91 -53.28 59.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.171 0.988 . . . . 3.1800000000000002 111.216 -169.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.5 mt -62.77 -49.87 73.29 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 118.046 -0.978 . . . . 1.4199999999999999 112.563 178.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -51.1 -54.46 24.81 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 119.687 1.13 . . . . 2.1200000000000001 110.683 175.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -49.26 -56.18 10.22 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.066 1.347 . . . . 3.8399999999999999 110.161 174.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.3 t -53.5 -46.97 70.24 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.999 0.92 . . . . 2.1499999999999999 111.392 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.311 2.8 pp -70.04 -35.49 64.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 O-C-N 120.966 -1.084 . . . . 0.98999999999999999 111.42 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -59.14 -51.84 68.26 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.2 0.909 . . . . 2.79 109.977 176.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . 0.256 12.5 t -53.26 -38.94 63.49 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 121.801 -0.562 . . . . 1.8700000000000001 112.177 -176.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 m -72.92 -39.35 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 O-C-N 120.461 -1.399 . . . . 0.90000000000000002 111.226 175.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.4 t -55.22 -47.3 77.76 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.112 0 CA-C-N 118.252 0.478 . . . . 0.81000000000000005 110.184 175.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . 0.253 10.2 t -62.11 -48.57 79.56 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 117.937 -1.03 . . . . 1.23 111.334 178.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 16.4 m -49.92 -52.26 34.6 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 120.395 1.452 . . . . 1.51 110.803 173.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -50.92 -60.0 3.55 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.228 0.611 . . . . 3.0099999999999998 110.163 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -61.89 -45.16 94.95 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.96 0.504 . . . . 3.1299999999999999 111.384 -170.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -65.3 -19.22 65.86 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 119.252 -0.404 . . . . 2.1600000000000001 111.902 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.526 ' HB3' HD21 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -81.54 -44.11 17.78 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 118.401 0.546 . . . . 3.1099999999999999 111.899 164.947 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.17 -33.11 67.12 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.453 1.501 . . . . 0.78000000000000003 111.655 -168.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 34.2 ptt180 -62.73 -34.96 78.27 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.545 1.138 . . . . 4.6600000000000001 112.439 177.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -40.86 -64.69 0.5 Allowed 'General case' 0 C--N 1.344 0.365 0 CA-C-O 122.139 0.971 . . . . 1.8999999999999999 113.255 -160.039 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -106.08 81.93 1.7 Allowed 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 103.889 -2.634 . . . . 3.1600000000000001 103.889 -178.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 48.06 -172.94 0.04 OUTLIER Glycine 0 CA--C 1.53 1.012 0 C-N-CA 126.835 2.16 . . . . 2.1699999999999999 114.518 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 34.73 88.54 0.01 OUTLIER 'General case' 0 C--O 1.235 0.333 0 C-N-CA 127.267 2.227 . . . . 4.75 112.367 169.05 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -75.97 57.84 1.11 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.955 1.302 . . . . 3.9900000000000002 112.784 -166.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -163.53 -44.79 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 126.646 1.979 . . . . 4.3700000000000001 106.906 174.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 m -82.08 113.39 19.91 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 125.479 1.512 . . . . 1.8600000000000001 109.59 -179.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.645 HD22 ' CE1' ' A' ' 76' ' ' TYR . 4.8 mp -84.33 136.62 33.82 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.149 -0.478 . . . . 2.7200000000000002 110.05 168.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.9 t -81.2 174.59 11.4 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.519 1.928 . . . . 2.8599999999999999 108.625 172.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 11.5 p -62.21 -43.01 97.4 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 O-C-N 122.079 -0.388 . . . . 2.1699999999999999 110.01 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -67.58 -57.29 6.72 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 118.182 -0.913 . . . . 2.0499999999999998 109.113 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.408 ' HB3' HD23 ' A' ' 33' ' ' LEU . 5.5 mt-10 -37.6 -49.16 1.08 Allowed 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.361 1.464 . . . . 1.8300000000000001 112.072 169.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -60.03 -59.99 4.53 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.967 -0.458 . . . . 3.3599999999999999 110.597 174.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -52.92 -40.67 63.78 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.281 0.491 . . . . 3.2000000000000002 111.671 -176.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -51.82 -39.97 59.68 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 123.968 0.907 . . . . 3.2799999999999998 110.574 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 57.5 tp -68.58 -45.8 71.08 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 119.543 1.065 . . . . 2.3700000000000001 109.435 -176.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.491 HG12 HD22 ' A' ' 46' ' ' LEU . 35.6 m -69.62 -28.1 36.27 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.123 0 CA-C-O 120.99 0.424 . . . . 1.8899999999999999 110.4 -175.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 63.7 m -81.09 -40.23 24.42 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 124.383 1.073 . . . . 1.8 111.105 177.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -82.78 -55.86 4.18 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 124.176 0.991 . . . . 2.5600000000000001 110.067 -172.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.2 mp0 -96.71 -146.51 0.29 Allowed 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 107.616 -1.253 . . . . 3.9700000000000002 107.616 169.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.537 HD21 HD11 ' A' ' 83' ' ' LEU . 8.0 mp 38.63 44.95 0.68 Allowed Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 126.243 1.817 . . . . 2.5299999999999998 113.15 -167.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.456 ' HD2' HG21 ' B' ' 7' ' ' THR . 58.3 Cg_endo -59.93 -32.86 95.77 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 122.55 2.167 . . . . 1.9199999999999999 111.966 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.94 -6.33 3.11 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 114.485 1.291 . . . . 3.2000000000000002 114.485 179.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.567 HD23 ' HG ' ' A' ' 83' ' ' LEU 2.134 10.8 mp -2.05 -144.83 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 120.989 3.7 . . . . 2.1699999999999999 120.989 129.485 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.422 ' C ' ' H ' ' A' ' 52' ' ' ASP . 6.2 mt -82.73 88.13 6.74 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 113.33 -1.759 . . . . 2.0600000000000001 107.714 174.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.73 18.88 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.899 1.444 . . . . 5.0700000000000003 114.899 177.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.422 ' H ' ' C ' ' A' ' 50' ' ' LEU . 64.9 m-20 -115.57 20.67 14.55 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 128.192 2.597 . . . . 5.6699999999999999 109.289 -172.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.0 m -53.33 -15.18 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 126.681 1.992 . . . . 2.6899999999999999 114.833 -172.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -56.33 -51.85 53.47 Favored Glycine 0 CA--C 1.529 0.936 0 N-CA-C 110.048 -1.221 . . . . 2.3799999999999999 110.048 170.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.8 t -84.92 60.45 6.23 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 122.361 1.077 . . . . 2.8900000000000001 109.826 -173.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -77.38 -36.5 53.46 Favored 'General case' 0 N--CA 1.438 -1.057 0 O-C-N 121.628 -0.67 . . . . 1.6000000000000001 109.79 -176.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -59.61 -46.7 88.19 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.783 0.719 . . . . 4.6699999999999999 110.496 178.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -45.04 -57.92 3.53 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.576 1.15 . . . . 3.3300000000000001 109.413 170.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 6.0 mmpt? -60.28 -45.15 94.32 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 118.735 -0.65 . . . . 5.3399999999999999 110.78 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -51.34 -54.94 21.4 Favored 'General case' 0 C--N 1.334 -0.087 0 CA-C-N 119.428 1.013 . . . . 1.51 109.59 178.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 44.6 mtmt -57.57 -37.64 73.48 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 122.584 0.354 . . . . 3.1499999999999999 111.001 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 14.5 m -62.9 -47.75 81.95 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.863 -0.523 . . . . 1.8799999999999999 112.165 175.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.418 HD21 ' HB2' ' A' ' 79' ' ' LEU . 7.2 mp -66.77 -60.24 2.86 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 121.27 -0.894 . . . . 2.0299999999999998 109.32 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -75.98 74.7 2.88 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.175 1.39 . . . . 1.5800000000000001 109.683 -168.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.1 m -45.55 -37.19 2.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 124.93 1.292 . . . . 1.75 113.17 -175.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 11.0 p-10 -102.37 8.18 40.28 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 113.131 0.789 . . . . 2.8399999999999999 113.131 -176.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 46.81 59.14 4.14 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.76 1.624 . . . . 3.3599999999999999 112.359 172.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 40.5 p30 -108.69 -9.57 15.25 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.36 1.464 . . . . 2.0 111.76 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.2 m 62.47 25.7 15.31 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.173 0.989 . . . . 1.6599999999999999 111.9 -170.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -122.81 100.91 7.15 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 126.194 1.798 . . . . 3.23 107.57 169.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -86.49 79.97 8.79 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 105.926 -1.879 . . . . 0.96999999999999997 105.926 170.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -69.24 171.78 7.94 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 122.776 0.43 . . . . 3.96 110.706 174.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -37.92 -61.15 0.67 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.563 1.545 . . . . 5.29 112.842 -167.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -68.39 -44.5 74.97 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.582 -0.699 . . . . 2.4700000000000002 111.432 -177.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -57.53 -33.15 67.79 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.209 0.603 . . . . 1.8600000000000001 111.203 178.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.645 ' CE1' HD22 ' A' ' 33' ' ' LEU . 35.5 t80 -78.67 -48.19 15.51 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 118.102 0.41 . . . . 3.23 110.363 175.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.622 ' CD1' ' HA2' ' B' ' 81' ' ' GLY . 44.5 t-105 -48.54 -29.09 3.85 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.823 0.849 . . . . 5.0800000000000001 111.72 176.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.406 ' HA ' ' CH2' ' B' ' 77' ' ' TRP . 14.4 mmm180 -37.23 -56.62 0.93 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.347 1.059 . . . . 3.6600000000000001 110.859 166.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.418 ' HB2' HD21 ' A' ' 63' ' ' LEU . 26.0 tp -49.07 -43.33 40.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 123.905 0.882 . . . . 0.80000000000000004 111.219 -179.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mp -80.72 -29.64 11.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 107.925 -1.139 . . . . 1.95 107.925 -168.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.43 ' HA3' ' CE2' ' B' ' 77' ' ' TRP . . . -56.22 -51.11 58.04 Favored Glycine 0 N--CA 1.439 -1.141 0 N-CA-C 110.259 -1.137 . . . . 1.1299999999999999 110.259 164.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -63.22 -33.93 76.57 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-O 118.596 -0.716 . . . . 2.4300000000000002 110.456 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.567 ' HG ' HD23 ' A' ' 49' ' ' LEU . 8.0 mp -57.84 -55.58 33.04 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 119.793 1.179 . . . . 2.3999999999999999 109.708 173.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.12 -48.25 64.91 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.346 0.593 . . . . 1.55 109.914 177.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -55.65 -34.65 65.15 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 117.849 -1.072 . . . . 2.3999999999999999 112.271 174.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -78.91 -14.22 59.35 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 127.406 2.283 . . . . 2.1299999999999999 112.624 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -91.5 -26.72 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 N-CA-C 113.773 1.027 . . . . 2.75 113.773 157.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -65.5 0.75 Allowed 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 119.851 1.205 . . . . 4.8200000000000003 111.579 175.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt . . . . . 0 C--O 1.214 -0.784 0 N-CA-C 104.106 -2.553 . . . . 3.5899999999999999 104.106 145.345 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . 2.316 0.2 OUTLIER . . . . . 0 CA--C 1.536 0.436 0 N-CA-C 112.751 0.648 . . . . 2.4399999999999999 112.751 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.593 HG22 ' HB2' ' B' ' 10' ' ' GLU . 1.1 t -118.51 -109.68 0.35 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.738 2.015 . . . . 1.8700000000000001 108.001 178.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -105.75 -68.72 0.85 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 126.351 1.86 . . . . 5.1200000000000001 107.483 172.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 3.7 mp -65.79 -51.09 61.89 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.807 -0.558 . . . . 2.7200000000000002 110.032 -177.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . 0.593 ' HB2' HG22 ' B' ' 7' ' ' THR . 4.2 mp0 -52.25 -39.58 60.52 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 119.22 -0.419 . . . . 3.8399999999999999 111.375 173.301 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.57 -56.09 20.12 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.179 -0.675 . . . . 4.9500000000000002 109.179 172.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 35.9 p -71.35 -39.63 71.19 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 119.926 -0.71 . . . . 2.1899999999999999 110.822 -167.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.3 pp -69.67 -35.54 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 O-C-N 121.261 -0.899 . . . . 1.45 109.863 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -60.83 -55.46 32.86 Favored 'General case' 0 C--N 1.342 0.249 0 CA-C-N 119.199 0.909 . . . . 3.1000000000000001 109.615 171.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.4 t -55.43 -38.84 69.5 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-O 121.911 0.862 . . . . 1.5800000000000001 111.564 -170.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 17.0 m -72.89 -39.17 58.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 O-C-N 120.667 -1.271 . . . . 1.1699999999999999 111.402 174.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 45.2 t -60.85 -44.1 96.98 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 119.447 1.021 . . . . 1.3899999999999999 111.389 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 10.1 t -62.46 -45.92 90.84 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.725 1.148 . . . . 1.52 110.257 177.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 60.3 m -52.93 -55.18 25.31 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.345 0.593 . . . . 1.47 109.73 174.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -49.99 -49.83 49.19 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.611 1.164 . . . . 4.2000000000000002 111.101 175.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -62.18 -54.31 42.9 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.889 0.875 . . . . 2.6899999999999999 110.649 -175.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 15.0 t -62.13 -29.32 70.26 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 119.555 -0.858 . . . . 3.4399999999999999 110.797 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -63.4 -54.02 43.29 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 118.4 0.545 . . . . 3.1600000000000001 111.092 167.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.57 -30.28 62.97 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 126.336 1.854 . . . . 1.6799999999999999 110.407 -172.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -54.85 -26.88 38.3 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.01 0.924 . . . . 3.9700000000000002 112.657 176.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.451 ' HB3' ' CG ' ' B' ' 37' ' ' GLU . 11.2 tt0 -62.87 -68.64 0.32 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 114.063 1.134 . . . . 4.3499999999999996 114.063 -157.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . 0.469 ' CD ' ' H ' ' B' ' 28' ' ' GLY . 0.0 OUTLIER -90.2 -74.91 0.47 Allowed 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 115.026 1.491 . . . . 5.0700000000000003 115.026 -163.245 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . 0.469 ' H ' ' CD ' ' B' ' 27' ' ' GLU . . . -92.08 170.1 32.76 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 127.943 2.687 . . . . 2.6600000000000001 109.779 154.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 38.41 102.09 0.0 OUTLIER 'General case' 0 C--O 1.24 0.58 0 C-N-CA 125.63 1.572 . . . . 4.04 114.792 142.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -71.09 49.73 0.14 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.631 1.572 . . . . 3.3599999999999999 112.578 176.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -153.84 -53.67 0.1 Allowed 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.072 1.349 . . . . 3.7200000000000002 108.17 -172.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.4 p -104.78 157.58 17.1 Favored 'General case' 0 C--O 1.244 0.799 0 C-N-CA 124.219 1.007 . . . . 2.29 113.305 -177.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.416 HD13 ' HB3' ' B' ' 37' ' ' GLU . 1.4 mm? -111.03 151.34 28.13 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 127.86 2.464 . . . . 2.3399999999999999 109.39 -173.054 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 8.2 t -149.95 178.18 9.16 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.378 1.071 . . . . 3.5299999999999998 108.323 169.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 9.2 p -83.89 53.09 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-O 121.865 0.84 . . . . 2.8399999999999999 111.127 -171.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.25 56.12 0.51 Allowed 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 105.618 -1.993 . . . . 2.9100000000000001 105.618 150.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.451 ' CG ' ' HB3' ' B' ' 26' ' ' GLN . 1.3 tt0 -173.78 -59.92 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 104.037 -2.579 . . . . 1.8300000000000001 104.037 -172.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -57.55 -56.46 21.6 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.33 -0.85 . . . . 2.0800000000000001 109.52 172.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.495 ' HE3' HD12 ' B' ' 56' ' ' LEU . 16.3 ttmt -57.05 -37.8 72.31 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 122.074 -0.391 . . . . 3.0 111.179 -177.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.74 -30.03 71.12 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.449 -0.782 . . . . 2.9300000000000002 111.683 177.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.25 -52.54 63.32 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 107.978 -1.119 . . . . 2.6600000000000001 107.978 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . 0.408 ' HA ' HD23 ' B' ' 46' ' ' LEU . 2.6 m -68.17 -42.55 84.9 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 115.125 -0.943 . . . . 0.81999999999999995 109.969 -174.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 96.6 m -54.08 -54.16 43.24 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.941 -0.572 . . . . 1.28 110.054 173.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -82.15 -62.78 1.53 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.796 1.035 . . . . 1.96 113.796 -167.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -83.19 -36.13 24.91 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 115.932 1.827 . . . . 3.6899999999999999 115.932 -163.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' B' ' 42' ' ' VAL . 1.5 mm? -46.67 -38.82 12.7 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 114.027 1.121 . . . . 1.79 114.027 -159.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -64.04 -20.87 68.21 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 C-N-CA 122.191 -2.004 . . . . 2.1800000000000002 109.978 -62.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -93.09 -56.27 3.03 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.058 0.943 . . . . 2.8700000000000001 110.986 -169.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.474 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 7.4 tp -30.56 -72.12 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.133 1.773 . . . . 1.2 113.34 -167.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 79.7 mt -90.24 128.74 36.48 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 106.464 -1.68 . . . . 1.8899999999999999 106.464 169.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.43 -5.28 10.81 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.797 1.239 . . . . 6.7599999999999998 111.835 -173.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -88.74 16.61 6.51 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 128.168 2.587 . . . . 4.75 111.201 -177.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 14.4 m -52.42 -28.09 11.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 125.259 1.424 . . . . 1.72 111.404 177.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.08 -35.13 8.29 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 124.308 0.956 . . . . 3.3900000000000001 112.657 172.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.6 t -124.77 47.83 2.07 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 117.817 0.808 . . . . 2.75 109.23 171.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.534 HD13 ' C ' ' B' ' 56' ' ' LEU . 2.3 tm? -45.63 -39.69 8.06 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.159 0.984 . . . . 1.3300000000000001 110.134 172.304 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -58.38 -25.62 62.28 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.196 0.998 . . . . 4.2699999999999996 111.854 -174.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -58.53 -54.24 49.22 Favored 'General case' 0 C--N 1.344 0.332 0 O-C-N 121.326 -0.859 . . . . 2.8700000000000001 109.399 165.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -49.29 75.49 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 108.421 -0.955 . . . . 3.23 108.421 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 16.3 tpt -46.23 -60.24 2.43 Favored 'General case' 0 N--CA 1.462 0.13 0 C-N-CA 123.635 0.774 . . . . 2.4900000000000002 108.953 177.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -57.46 -42.15 81.96 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 122.516 0.326 . . . . 3.6699999999999999 111.367 -178.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.5 m -65.48 -34.83 79.19 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.116 0.566 . . . . 2.71 112.442 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 39.2 mt -80.02 -44.91 19.31 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.884 1.274 . . . . 1.77 109.645 -176.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -49.35 -8.76 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 128.346 2.658 . . . . 2.3199999999999998 117.17 -175.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 19.8 m -33.65 -28.27 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 131.024 3.73 . . . . 2.3799999999999999 118.923 -124.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -67.4 -20.62 65.56 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 120.724 1.602 . . . . 3.48 110.977 170.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 69.85 65.52 0.24 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.059 1.344 . . . . 3.6600000000000001 110.617 172.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 48.9 p30 -119.56 -7.39 10.13 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.37 1.868 . . . . 2.5499999999999998 112.321 -176.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 14.8 m 72.73 18.61 4.17 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.337 1.855 . . . . 2.5299999999999998 112.673 -174.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -126.11 110.28 13.33 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.362 1.465 . . . . 4.1200000000000001 108.798 170.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -80.44 104.08 10.74 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 106.813 -1.551 . . . . 1.55 106.813 170.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -91.21 166.64 12.84 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.533 1.933 . . . . 4.0700000000000003 110.023 -176.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -89.73 56.7 3.61 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.636 -0.665 . . . . 5.7699999999999996 111.525 179.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -158.52 49.26 0.37 Allowed 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 106.861 -1.533 . . . . 2.75 106.861 109.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 77.7 mt-10 -95.58 -61.32 1.48 Allowed 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.906 2.083 . . . . 2.5600000000000001 108.843 145.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -48.13 -38.34 17.65 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 125.779 1.632 . . . . 3.48 110.968 -174.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.43 ' CE2' ' HA3' ' A' ' 81' ' ' GLY . 23.0 t90 -39.75 -41.94 1.18 Allowed 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 124.228 0.955 . . . . 5.2800000000000002 111.525 176.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 31.8 mmt180 -49.3 -30.28 7.16 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-O 117.666 -1.159 . . . . 5.1299999999999999 113.095 179.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' B' ' 79' ' ' LEU . 18.3 tp -57.66 -44.43 85.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 121.776 2.08 . . . . 1.1000000000000001 111.184 174.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 1.4 mt -80.94 -26.94 10.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 C-N-CA 124.2 1.0 . . . . 1.8300000000000001 108.832 178.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.622 ' HA2' ' CD1' ' A' ' 77' ' ' TRP . . . -37.56 -57.02 1.55 Allowed Glycine 0 C--N 1.347 1.159 0 C-N-CA 127.7 2.572 . . . . 1.8 110.189 159.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . 0.402 ' C ' ' HG2' ' B' ' 86' ' ' GLU . 45.0 mm-40 -82.46 -63.78 1.31 Allowed 'General case' 0 N--CA 1.421 -1.895 0 CA-C-N 111.644 -2.278 . . . . 2.4900000000000002 108.252 -172.146 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.474 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 1.7 mp -38.49 -59.6 0.89 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 120.45 1.477 . . . . 2.1000000000000001 113.428 -169.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.34 -36.1 65.92 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 123.148 0.579 . . . . 1.4099999999999999 111.365 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 22.0 ttpp -80.69 -39.9 26.35 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.031 0.933 . . . . 1.6100000000000001 112.329 175.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.402 ' HG2' ' C ' ' B' ' 82' ' ' GLU . 5.3 mm-40 -60.45 -25.61 66.13 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 119.757 1.162 . . . . 3.1899999999999999 112.266 -177.039 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 1.5 tp -44.1 -44.44 2.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 N-CA-C 109.566 -0.531 . . . . 1.3300000000000001 109.566 167.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 -85.71 -60.15 2.1 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.805 2.042 . . . . 4.7800000000000002 113.198 171.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 29.0 tttm . . . . . 0 CA--C 1.531 0.229 0 C-N-CA 125.616 1.566 . . . . 6.3399999999999999 111.574 -166.9 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 . . . . . 0 N--CA 1.446 -0.625 0 CA-C-O 118.712 -0.661 . . . . 4.9199999999999999 109.685 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -79.53 98.87 1.18 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.559 2.172 . . . . 2.6000000000000001 109.575 -177.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.61 177.47 7.47 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.586 -0.524 . . . . 2.3900000000000001 109.586 170.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.1 m -58.05 147.07 30.75 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.394 -0.816 . . . . 3.9100000000000001 110.778 -173.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -53.96 -49.38 68.89 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.526 -0.734 . . . . 2.7000000000000002 110.285 175.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.7 mt -59.22 -39.87 84.07 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 117.98 -1.009 . . . . 1.6100000000000001 112.891 172.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -54.31 -50.27 67.73 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 120.583 1.538 . . . . 2.6200000000000001 111.465 170.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.1 mm-40 -50.48 -53.33 30.66 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.322 -0.622 . . . . 4.1500000000000004 109.322 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.9 p -67.14 -43.53 82.12 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 121.746 -0.596 . . . . 1.79 111.932 -174.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.482 HG21 HD12 ' B' ' 83' ' ' LEU 0.276 1.8 pp -62.2 -41.04 89.86 Favored 'Isoleucine or valine' 0 C--N 1.342 0.242 0 CA-C-N 119.961 1.255 . . . . 0.80000000000000004 110.587 176.08 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -58.36 -47.48 83.68 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.285 0.948 . . . . 3.2200000000000002 110.388 174.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -59.53 -35.32 73.97 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.626 0.602 . . . . 1.22 112.626 -175.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.0 m -80.16 -38.83 18.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 O-C-N 120.541 -1.35 . . . . 0.73999999999999999 111.187 173.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.5 t -57.95 -44.12 86.09 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 118.708 0.685 . . . . 0.53000000000000003 110.528 178.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.6 t -61.08 -46.69 89.62 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.375 -0.828 . . . . 0.66000000000000003 110.075 177.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.7 m -56.68 -49.9 73.73 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.687 0.676 . . . . 0.85999999999999999 109.778 177.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -47.83 -57.45 5.62 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.986 0.914 . . . . 3.3100000000000001 110.951 170.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -67.26 -46.83 72.52 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.124 0.57 . . . . 2.71 111.123 -168.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 40.1 p -56.67 -28.49 60.81 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.577 0.751 . . . . 2.6099999999999999 111.517 176.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -75.49 -55.18 5.94 Favored 'General case' 0 C--O 1.222 -0.384 0 C-N-CA 123.339 0.655 . . . . 2.5099999999999998 111.969 165.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.61 -28.37 54.82 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 126.907 2.083 . . . . 0.91000000000000003 112.173 -169.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -74.35 -18.79 60.63 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.563 1.145 . . . . 3.6800000000000002 113.083 -179.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.66 -67.93 0.22 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.204 0.911 . . . . 2.6400000000000001 112.516 -175.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -108.48 172.69 6.7 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 126.861 2.064 . . . . 2.6000000000000001 106.703 -174.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -9.35 116.73 0.01 OUTLIER Glycine 0 CA--C 1.532 1.127 0 C-N-CA 127.481 2.467 . . . . 1.95 114.814 172.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? 64.03 107.34 0.03 OUTLIER 'General case' 0 C--O 1.239 0.529 0 C-N-CA 124.701 1.201 . . . . 4.3700000000000001 113.279 171.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -65.57 58.82 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.086 0.954 . . . . 3.6099999999999999 111.298 164.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -166.51 -47.91 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.788 1.635 . . . . 4.46 108.834 -171.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 13.9 p -95.85 129.2 43.16 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 125.446 1.499 . . . . 1.8 109.164 173.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.412 HD22 ' CD1' ' A' ' 76' ' ' TYR . 6.7 mp -84.11 136.24 34.08 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.018 -1.105 . . . . 2.5499999999999998 108.018 161.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.1 t -80.24 170.91 15.77 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 125.097 1.359 . . . . 2.77 107.808 167.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.4 p -58.99 -41.33 82.88 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 O-C-N 121.882 -0.511 . . . . 3.0699999999999998 109.872 176.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -66.33 -59.6 3.56 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 118.481 -0.771 . . . . 1.8 109.211 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -37.51 -54.16 1.14 Allowed 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 124.145 0.978 . . . . 1.9199999999999999 112.048 169.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -59.88 -51.89 67.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.633 -0.258 . . . . 2.9700000000000002 111.128 178.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.8 tttm -56.9 -38.96 73.55 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.568 0.622 . . . . 3.8399999999999999 109.67 -176.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -66.32 -19.94 65.95 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 118.816 -0.611 . . . . 5.0199999999999996 112.125 -176.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -61.52 -55.82 26.86 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-N 119.638 1.108 . . . . 2.71 108.053 169.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.0 m -71.0 -44.21 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-O 121.811 0.815 . . . . 1.6399999999999999 109.605 -169.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 38.2 m -68.38 -42.2 79.45 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 124.979 1.312 . . . . 1.3999999999999999 110.179 -175.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -75.79 -50.76 14.28 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.769 0.713 . . . . 2.5899999999999999 110.646 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -149.45 73.23 1.18 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.314 0.506 . . . . 3.7999999999999998 112.185 -173.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.8 tp -154.65 45.79 0.27 Allowed Pre-proline 0 CA--C 1.549 0.904 0 N-CA-C 112.766 0.654 . . . . 2.0499999999999998 112.766 155.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -62.59 -74.58 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 124.116 3.211 . . . . 1.98 114.726 -162.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 23.0 t-160 -63.62 -24.4 67.78 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 121.47 -0.769 . . . . 4.5300000000000002 111.107 -169.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.6 tp -74.2 -75.43 0.16 Allowed 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 122.617 0.367 . . . . 1.5700000000000001 110.447 177.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.6 mt -95.71 65.78 2.64 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 108.636 -0.876 . . . . 2.5699999999999998 108.636 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.464 ' CD ' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -54.68 -30.75 56.41 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 114.253 -1.34 . . . . 5.7699999999999996 111.936 178.599 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.421 ' OD2' ' NZ ' ' A' ' 59' ' ' LYS . 33.3 t70 -73.35 72.16 1.29 Allowed 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.988 0.899 . . . . 3.4700000000000002 108.906 162.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.2 t -77.11 -6.52 9.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 127.954 2.501 . . . . 2.9900000000000002 109.557 161.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.89 -69.56 1.36 Allowed Glycine 0 C--N 1.345 1.041 0 C-N-CA 124.745 1.164 . . . . 2.27 110.493 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.54 52.89 1.47 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 123.159 1.457 . . . . 4.1500000000000004 109.766 -176.347 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.3 -25.61 59.57 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 126.818 2.047 . . . . 2.0600000000000001 110.049 -174.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -42.32 -45.67 4.32 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 126.513 1.925 . . . . 4.5 111.576 169.158 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -45.94 -52.83 10.97 Favored 'General case' 0 C--N 1.346 0.433 0 N-CA-C 108.992 -0.744 . . . . 6.3899999999999997 108.992 177.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.477 ' HE2' ' H ' ' A' ' 59' ' ' LYS . 1.5 mppt? -74.83 -63.28 1.29 Allowed 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 106.015 -1.846 . . . . 4.2400000000000002 106.015 -174.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -47.5 -55.4 9.2 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 123.56 0.744 . . . . 2.27 110.369 -170.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.2 ttpp -73.22 -19.0 61.18 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 115.252 -0.885 . . . . 5.7800000000000002 111.557 -169.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 44.9 m -82.81 -38.11 23.56 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.365 0.666 . . . . 2.1699999999999999 112.536 166.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 72.0 mt -69.09 -51.1 42.19 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.391 1.476 . . . . 1.9199999999999999 109.91 -172.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -72.74 73.35 1.09 Allowed 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.108 -1.071 . . . . 2.27 108.108 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.6 m -52.58 -40.86 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 124.222 1.009 . . . . 2.7200000000000002 112.512 -170.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -88.99 -2.79 58.75 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.317 0.488 . . . . 2.4700000000000002 112.317 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 58.07 55.08 5.44 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.001 1.32 . . . . 3.98 110.958 170.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 53.0 p30 -108.48 -3.24 18.31 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.667 1.587 . . . . 2.21 112.378 -177.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.8 m 80.35 0.05 1.96 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.66 1.984 . . . . 2.2000000000000002 113.511 -178.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -110.4 131.23 55.23 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 119.065 0.848 . . . . 3.0499999999999998 109.023 168.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -87.9 90.83 8.53 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 105.898 -1.89 . . . . 1.5900000000000001 105.898 161.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.94 148.78 7.22 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.568 1.076 . . . . 3.6299999999999999 108.25 169.26 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -38.78 -49.53 1.62 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.026 1.284 . . . . 4.9900000000000002 113.494 178.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -66.46 -34.9 78.97 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.986 0.736 . . . . 2.2799999999999998 112.986 177.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.53 -55.31 18.48 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 119.272 0.942 . . . . 2.6499999999999999 109.476 172.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . 0.412 ' CD1' HD22 ' A' ' 33' ' ' LEU . 30.9 t80 -45.86 -51.63 12.69 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 123.848 0.859 . . . . 3.1299999999999999 109.664 175.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.68 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 2.1 t-105 -45.89 -33.56 3.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 117.41 -1.281 . . . . 4.3399999999999999 112.275 178.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -40.64 -47.97 2.84 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 120.237 1.381 . . . . 6.0300000000000002 110.471 171.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 28.0 tp -41.7 -50.34 4.23 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 124.528 1.131 . . . . 1.47 111.524 176.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 85.5 mt -62.51 -30.7 49.76 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 N-CA-C 108.888 -0.782 . . . . 1.79 108.888 -172.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.543 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -74.67 -44.97 24.19 Favored Glycine 0 CA--C 1.491 -1.435 0 N-CA-C 109.996 -1.242 . . . . 1.3600000000000001 109.996 176.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -61.21 -31.03 70.8 Favored 'General case' 0 N--CA 1.436 -1.134 0 N-CA-C 107.752 -1.203 . . . . 2.1000000000000001 107.752 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.6 mt -71.08 -56.86 5.24 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 119.266 0.939 . . . . 2.1899999999999999 110.826 172.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.45 -24.75 47.63 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.963 0.905 . . . . 1.3200000000000001 111.856 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -80.41 -61.01 2.11 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 126.709 2.004 . . . . 1.5700000000000001 109.013 171.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -50.39 -40.92 51.13 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.978 1.311 . . . . 2.5499999999999998 111.237 -176.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 10.0 tt -54.85 -34.57 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 O-C-N 120.671 -1.268 . . . . 1.3700000000000001 112.345 177.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -93.07 -62.56 1.36 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.46 1.504 . . . . 4.8600000000000003 108.588 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 57.3 tttp . . . . . 0 C--O 1.222 -0.377 0 C-N-CA 125.491 1.516 . . . . 4.0599999999999996 108.422 168.079 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 49.3 mt . . . . . 0 CA--C 1.547 0.839 0 N-CA-C 114.338 1.236 . . . . 2.6400000000000001 114.338 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 2.0 t -166.28 -111.02 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 120.944 1.702 . . . . 2.71 112.991 -166.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -125.28 -72.74 0.65 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.762 2.025 . . . . 2.3500000000000001 110.434 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.9 mt -48.89 -49.51 39.42 Favored 'General case' 0 C--O 1.233 0.209 0 O-C-N 121.656 -0.653 . . . . 1.3200000000000001 110.798 175.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -44.29 -52.74 7.3 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.185 0.994 . . . . 3.8900000000000001 112.515 171.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -57.38 -36.81 71.72 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 119.235 0.925 . . . . 4.6100000000000003 110.396 178.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 3.8 t -63.01 -50.14 71.9 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 122.947 0.499 . . . . 1.8600000000000001 110.606 178.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.3 2.6 pp -61.44 -35.24 65.37 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 O-C-N 121.335 -0.853 . . . . 0.94999999999999996 110.979 173.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -58.95 -57.78 11.57 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.874 -0.584 . . . . 3.1099999999999999 110.145 174.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.8 t -52.49 -38.54 59.71 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.618 1.099 . . . . 1.3100000000000001 111.685 -170.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 26.2 m -73.93 -39.82 51.96 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 O-C-N 121.414 -0.804 . . . . 0.94999999999999996 111.492 175.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 38.4 t -57.73 -48.34 83.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 119.092 0.86 . . . . 1.1000000000000001 111.015 173.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.1 t -64.38 -38.89 92.61 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.567 1.076 . . . . 1.3200000000000001 110.856 177.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 85.8 m -58.16 -52.95 63.4 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 120.022 1.283 . . . . 1.23 109.666 174.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -47.26 -54.76 10.07 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.208 1.003 . . . . 3.71 110.279 173.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -55.2 -46.47 75.87 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.809 1.244 . . . . 3.9100000000000001 111.329 -179.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 58.8 m -54.45 -44.27 72.36 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.403 0.681 . . . . 3.2000000000000002 110.052 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -68.04 -47.3 68.76 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 120.457 -0.497 . . . . 3.0899999999999999 110.959 171.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.45 -30.68 65.21 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.77 1.628 . . . . 1.21 111.467 -170.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 -19.32 64.79 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 118.153 -0.927 . . . . 3.7799999999999998 112.665 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.456 ' HB3' ' HG3' ' B' ' 37' ' ' GLU . 2.3 tt0 -56.16 -68.13 0.24 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 117.902 -1.047 . . . . 3.75 111.562 -160.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -74.82 0.47 Allowed 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 114.433 1.272 . . . . 4.4900000000000002 114.433 -162.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.77 160.16 27.37 Favored Glycine 0 N--CA 1.442 -0.924 0 C-N-CA 127.637 2.542 . . . . 1.8899999999999999 109.906 156.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 36.56 104.95 0.0 OUTLIER 'General case' 0 C--O 1.237 0.42 0 N-CA-C 115.961 1.837 . . . . 5.2599999999999998 115.961 140.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -69.01 46.13 0.06 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.866 1.266 . . . . 3.4700000000000002 114.331 174.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -128.29 -58.2 1.2 Allowed 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 126.481 1.913 . . . . 3.5299999999999998 106.341 168.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 2.1 p -94.15 146.49 23.95 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 125.209 1.403 . . . . 2.21 112.463 -166.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -102.95 154.27 19.39 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 126.094 1.757 . . . . 2.1000000000000001 107.894 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 11.1 t -154.49 176.8 11.92 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 107.512 -1.292 . . . . 2.6099999999999999 107.512 169.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 11.3 p -84.47 53.74 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-O 121.862 0.839 . . . . 2.73 111.188 -170.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.65 54.75 0.48 Allowed 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 105.895 -1.891 . . . . 2.5 105.895 149.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.456 ' HG3' ' HB3' ' B' ' 26' ' ' GLN . 1.8 tt0 -172.38 -52.61 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.292 1.837 . . . . 2.2200000000000002 106.532 -170.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.46 ' CZ ' HD13 ' B' ' 63' ' ' LEU . 3.7 t80 -55.96 -57.82 10.47 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.564 -1.198 . . . . 2.0299999999999998 109.771 173.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -56.22 -34.29 66.18 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.882 -0.599 . . . . 4.4299999999999997 111.302 -175.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -54.31 -38.25 65.75 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.337 0.655 . . . . 3.4500000000000002 110.765 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tt -67.15 -49.43 64.81 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.83 -0.804 . . . . 2.29 108.83 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 10.7 m -70.27 -35.08 61.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.295 -0.866 . . . . 0.93000000000000005 110.155 -174.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 86.7 m -69.93 -50.79 38.58 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.018 0.927 . . . . 0.93999999999999995 110.619 176.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -75.65 -61.52 1.89 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.565 0.746 . . . . 2.4399999999999999 111.135 -169.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -80.79 -53.48 6.45 Favored 'General case' 0 C--O 1.227 -0.101 0 CA-C-O 121.343 0.592 . . . . 4.3899999999999997 109.715 -175.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.61 -16.37 0.23 Allowed Pre-proline 0 CA--C 1.541 0.633 1 N-CA-C 121.857 4.021 . . . . 2.4900000000000002 121.857 -144.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -48.96 -43.22 36.38 Favored 'Trans proline' 0 C--N 1.349 0.576 0 CA-C-N 123.473 2.276 . . . . 3.1899999999999999 115.56 -149.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 65.4 t-80 -75.41 59.5 1.08 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.938 0.79 . . . . 2.6200000000000001 110.669 173.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.566 HD23 ' HB2' ' B' ' 83' ' ' LEU . 10.3 tp -164.13 -91.57 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.209 1.404 . . . . 1.6699999999999999 107.227 175.414 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 80.5 mt -78.79 86.98 4.68 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 120.968 -1.083 . . . . 2.0800000000000001 109.126 171.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.33 169.51 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.386 -1.279 . . . . 6.4199999999999999 111.566 153.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 88.78 5.12 0.19 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 127.446 2.299 . . . . 5.3200000000000003 112.025 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 24.7 m -50.6 -34.09 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.96 0.904 . . . . 1.9299999999999999 112.543 -175.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -49.83 -33.62 20.45 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.623 1.106 . . . . 3.25 112.992 175.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 8.3 t -130.71 57.15 1.74 Allowed 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.444 -0.947 . . . . 3.9399999999999999 108.444 170.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -44.23 -39.18 4.25 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 124.645 1.178 . . . . 1.0600000000000001 109.878 167.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -30.81 -47.68 0.1 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.331 2.653 . . . . 4.0599999999999996 113.134 168.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -61.75 -52.47 64.08 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.073 0.464 . . . . 3.1699999999999999 110.505 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.97 -47.97 81.37 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 107.963 -1.125 . . . . 3.6000000000000001 107.963 177.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -50.15 -52.49 34.84 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 123.464 0.706 . . . . 1.72 110.295 179.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 17.8 ttmm -60.13 -44.13 95.15 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 122.305 -0.247 . . . . 2.9399999999999999 110.911 178.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 16.1 m -63.22 -28.79 70.28 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.379 0.672 . . . . 2.29 112.394 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.46 HD13 ' CZ ' ' B' ' 38' ' ' PHE . 26.2 mt -80.04 -57.15 3.77 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.353 1.061 . . . . 1.1599999999999999 110.231 178.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -58.34 -9.76 1.72 Allowed 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 126.96 2.104 . . . . 1.6299999999999999 116.487 -166.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . 0.403 HG13 ' H ' ' B' ' 65' ' ' VAL . 27.7 m -34.06 -19.47 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 130.869 3.668 . . . . 1.5900000000000001 119.705 -140.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 7.8 p-10 -61.61 -22.71 65.48 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 121.314 1.87 . . . . 3.1200000000000001 111.397 162.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 61.25 62.18 1.42 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 125.979 1.712 . . . . 2.96 111.099 175.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 38.9 p30 -105.84 -15.94 14.79 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.662 1.585 . . . . 2.25 110.954 174.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 74.31 9.42 4.45 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.366 1.466 . . . . 2.6000000000000001 111.968 -173.3 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -111.03 101.93 10.43 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 105.915 -1.883 . . . . 3.6499999999999999 105.915 171.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -75.66 108.93 8.84 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 106.653 -1.61 . . . . 1.0900000000000001 106.653 174.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -83.98 160.28 21.07 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.436 1.894 . . . . 4.1699999999999999 109.356 -176.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -86.05 52.68 2.55 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.775 -0.578 . . . . 4.2000000000000002 111.933 172.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -159.37 48.65 0.31 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.881 -1.155 . . . . 2.2400000000000002 107.881 114.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -93.31 -61.72 1.51 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.685 1.594 . . . . 2.1499999999999999 107.779 142.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -48.54 -46.05 38.28 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 125.816 1.646 . . . . 3.6899999999999999 111.011 -175.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.68 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 50.1 t90 -49.79 -36.48 26.41 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 123.883 0.74 . . . . 3.5600000000000001 112.455 -169.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -42.24 -40.1 2.3 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.969 0.908 . . . . 4.3799999999999999 111.91 173.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 10.6 tp -53.59 -45.28 69.93 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.212 1.005 . . . . 0.82999999999999996 111.888 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 59.2 mt -64.3 -31.26 52.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 N-CA-C 107.211 -1.403 . . . . 1.46 107.211 178.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.559 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -64.59 -48.29 74.56 Favored Glycine 0 CA--C 1.492 -1.398 0 C-N-CA 125.894 1.711 . . . . 1.3300000000000001 112.079 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -66.59 -62.72 1.31 Allowed 'General case' 0 N--CA 1.425 -1.708 0 CA-C-O 117.294 -1.336 . . . . 2.3900000000000001 107.648 177.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.566 ' HB2' HD23 ' B' ' 49' ' ' LEU . 3.4 pp -54.47 -35.29 62.9 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 120.48 1.491 . . . . 1.8300000000000001 113.041 -175.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.69 -61.63 2.38 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.347 0.522 . . . . 1.6399999999999999 110.435 170.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -65.96 -31.95 73.16 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 117.763 -1.113 . . . . 1.6799999999999999 111.79 -171.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -42.73 -38.09 1.97 Allowed 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 128.335 2.654 . . . . 2.7400000000000002 111.226 175.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 2.7 tt -50.56 -40.49 19.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 122.622 0.369 . . . . 1.3100000000000001 110.216 177.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.4 -59.51 2.36 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.983 2.113 . . . . 5.2000000000000002 112.738 166.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 14.1 tttt . . . . . 0 CA--C 1.535 0.39 0 C-N-CA 129.247 3.019 . . . . 6.8200000000000003 111.672 -172.022 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 . . . . . 0 N--CA 1.45 -0.427 0 N-CA-C 110.701 -0.111 . . . . 5.3600000000000003 110.701 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.24 103.62 1.43 Allowed 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.761 2.308 . . . . 2.52 109.128 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -61.41 152.82 28.67 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 108.124 -1.065 . . . . 1.3 108.124 169.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.4 t -71.25 173.51 7.64 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 119.867 -0.733 . . . . 1.77 109.564 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -65.45 -59.76 3.67 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 121.536 -0.728 . . . . 3.0099999999999998 110.101 -171.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.6 mp -55.33 -42.26 73.55 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 121.628 -0.67 . . . . 1.47 110.188 -176.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -53.25 -54.35 37.5 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.733 2.013 . . . . 2.1299999999999999 111.655 171.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.03 -49.94 70.31 Favored 'General case' 0 C--N 1.341 0.204 0 N-CA-C 108.877 -0.786 . . . . 5.4000000000000004 108.877 178.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.1 m -65.6 -46.85 77.78 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 111.765 0.283 . . . . 1.99 111.765 -175.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 pp -65.51 -34.77 72.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 O-C-N 120.969 -1.082 . . . . 0.91000000000000003 108.878 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -60.3 -55.0 38.99 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.864 0.757 . . . . 2.9900000000000002 109.351 170.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -51.53 -40.1 58.99 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.857 0.863 . . . . 1.1299999999999999 111.686 -174.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 m -74.8 -41.18 47.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 O-C-N 120.971 -1.081 . . . . 0.70999999999999996 111.4 173.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 40.2 t -57.53 -48.24 83.45 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 119.588 1.085 . . . . 0.70999999999999996 111.535 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -59.32 -43.1 92.73 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 119.666 1.121 . . . . 0.63 110.455 178.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 60.1 m -59.22 -54.71 43.78 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.179 0.514 . . . . 0.72999999999999998 109.78 176.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.421 ' CE2' HD23 ' A' ' 33' ' ' LEU . 2.2 t80 -44.15 -52.15 7.53 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.994 1.318 . . . . 3.0699999999999998 110.676 171.144 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 26.9 t80 -66.2 -49.35 67.6 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.908 1.283 . . . . 2.79 110.691 -171.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 t -62.91 -36.95 85.07 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 110.093 -0.336 . . . . 2.1000000000000001 110.093 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -64.52 -48.17 76.11 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 118.539 0.608 . . . . 2.6099999999999999 111.236 169.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -52.76 -35.37 56.25 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 125.235 1.414 . . . . 0.83999999999999997 110.998 -171.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -59.16 -34.29 71.93 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 126.427 1.891 . . . . 5.5300000000000002 112.818 177.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -46.17 -61.63 1.69 Allowed 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.451 1.023 . . . . 2.3399999999999999 112.738 -167.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -104.92 114.02 27.97 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 128.524 2.73 . . . . 2.9199999999999999 106.375 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 40.17 99.99 0.01 OUTLIER Glycine 0 CA--C 1.533 1.204 0 C-N-CA 126.36 1.933 . . . . 1.76 116.432 162.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 72.93 106.47 0.07 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.554 0.742 . . . . 4.8700000000000001 112.899 168.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.0 pttt -66.59 18.78 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 115.913 1.82 . . . . 4.54 115.913 178.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.3 p-10 -89.16 -34.32 16.74 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.816 1.246 . . . . 4.2599999999999998 109.53 162.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.7 p -83.86 128.6 34.65 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.471 1.109 . . . . 3.2000000000000002 110.834 -171.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.421 HD23 ' CE2' ' A' ' 20' ' ' PHE . 2.7 mm? -86.09 123.6 31.58 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 107.338 -1.356 . . . . 1.98 107.338 151.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.1 m -109.53 176.05 5.22 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 126.318 1.847 . . . . 3.71 109.074 -171.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 71.4 t -63.69 -49.65 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 O-C-N 121.814 -0.554 . . . . 2.6899999999999999 111.519 -167.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -70.12 -48.89 55.65 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.272 -1.01 . . . . 2.2799999999999998 108.272 -176.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -42.67 -53.54 4.44 Favored 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 124.672 1.189 . . . . 1.8100000000000001 112.343 173.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.01 -56.05 14.41 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.184 -0.673 . . . . 2.4500000000000002 109.184 176.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 30.4 ttmt -58.61 -39.1 79.49 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 120.283 -0.567 . . . . 2.7799999999999998 111.766 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -54.55 -38.85 67.11 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.615 0.643 . . . . 3.2000000000000002 111.755 176.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -61.07 -54.03 49.77 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 107.582 -1.266 . . . . 2.48 107.582 -177.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 16.4 m -68.98 -40.88 81.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 114.581 -1.19 . . . . 1.1399999999999999 109.852 -170.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 98.1 m -59.99 -51.91 67.65 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 124.197 0.999 . . . . 1.8999999999999999 110.61 174.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -74.16 -57.18 4.13 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.425 0.29 . . . . 3.23 110.976 -170.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -136.43 68.11 1.44 Allowed 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.669 0.387 . . . . 4.0700000000000003 111.907 -177.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.3 tp -155.9 56.32 1.28 Allowed Pre-proline 0 CA--C 1.54 0.562 0 O-C-N 121.538 -0.727 . . . . 1.8 111.062 161.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -63.34 -61.12 0.14 Allowed 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 123.835 3.023 . . . . 1.8500000000000001 112.715 -170.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -84.64 -51.62 6.71 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 119.351 0.978 . . . . 3.9100000000000001 110.38 -172.261 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -31.9 -62.3 0.21 Allowed 'General case' 0 C--O 1.234 0.28 0 C-N-CA 126.402 1.881 . . . . 1.54 113.506 -172.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.5 mt -125.59 54.5 1.48 Allowed 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.047 1.339 . . . . 2.0600000000000001 108.399 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.75 3.6 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 116.913 2.19 . . . . 5.1399999999999997 116.913 -175.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -109.04 46.3 0.99 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.543 1.537 . . . . 4.7999999999999998 107.331 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.9 m -55.85 -17.52 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 C-N-CA 125.766 1.627 . . . . 2.0699999999999998 112.567 -176.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -44.43 -44.91 8.22 Favored Glycine 0 CA--C 1.532 1.135 0 N-CA-C 110.912 -0.875 . . . . 1.4299999999999999 110.912 167.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.7 t -91.84 31.55 1.22 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 117.213 0.507 . . . . 2.25 112.088 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.402 HD13 ' C ' ' A' ' 56' ' ' LEU . 3.0 tm? -52.61 -43.75 65.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 121.419 -0.801 . . . . 1.3400000000000001 109.21 168.118 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -39.9 -57.35 1.61 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.982 1.313 . . . . 3.5499999999999998 111.565 170.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.2 tp10 -60.12 -51.33 70.05 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 116.485 -0.325 . . . . 5.2599999999999998 110.253 -178.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.92 -39.88 75.28 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 118.92 -1.112 . . . . 6.3600000000000003 110.628 -179.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -57.3 -57.4 12.81 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 122.848 0.459 . . . . 1.51 110.673 176.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.13 -33.48 74.56 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 120.394 -0.522 . . . . 4.0 111.218 -176.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.3 t -59.45 -50.93 72.03 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.289 1.436 . . . . 1.79 110.997 172.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.8 mp -63.76 -50.09 70.4 Favored 'General case' 0 C--O 1.239 0.547 0 O-C-N 121.385 -0.822 . . . . 1.75 111.562 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -80.07 71.5 6.8 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 121.0 -0.28 . . . . 1.72 110.478 -167.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.8 m -49.53 -40.36 14.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.644 1.177 . . . . 2.0600000000000001 113.525 -174.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -82.5 -8.64 59.61 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 123.519 0.728 . . . . 1.8999999999999999 112.504 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 55.92 50.39 14.03 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.766 1.626 . . . . 3.4199999999999999 110.426 168.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.5 p30 -100.49 -12.46 19.3 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.766 1.626 . . . . 2.0099999999999998 110.96 179.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 20.7 m 72.43 17.41 4.76 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 125.893 1.677 . . . . 1.5700000000000001 111.864 -179.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -116.06 113.26 22.94 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 106.11 -1.811 . . . . 3.96 106.11 163.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.82 89.07 7.12 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 104.543 -2.391 . . . . 1.05 104.543 173.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.9 tttp -75.87 158.04 32.58 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.921 -0.77 . . . . 4.8300000000000001 108.921 -176.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -38.63 -61.07 0.75 Allowed 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.099 1.148 . . . . 4.7599999999999998 114.099 -163.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -69.23 -26.55 64.85 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.684 -0.635 . . . . 2.2599999999999998 112.209 -177.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -68.52 -59.69 2.97 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.639 -0.874 . . . . 2.0699999999999998 108.639 171.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -56.37 -38.84 71.99 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 118.786 -0.626 . . . . 3.2799999999999998 111.057 -175.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.495 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.1 OUTLIER -38.19 -45.19 0.92 Allowed 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 116.609 -1.662 . . . . 5.5599999999999996 107.85 174.75 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 48.3 mtm-85 -38.55 -44.96 1.01 Allowed 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.85 1.659 . . . . 5.9000000000000004 112.529 -179.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 23.5 tp -52.05 -56.97 11.01 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 120.593 1.542 . . . . 0.98999999999999999 111.75 174.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 19.1 mm -59.44 -38.97 77.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 C-N-CA 126.403 1.881 . . . . 1.8700000000000001 108.245 -179.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.58 -56.88 11.7 Favored Glycine 0 N--CA 1.437 -1.245 0 N-CA-C 108.497 -1.841 . . . . 1.9299999999999999 108.497 172.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -63.51 -49.67 72.62 Favored 'General case' 0 N--CA 1.438 -1.056 0 C-N-CA 125.804 1.642 . . . . 2.6499999999999999 108.617 -171.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 21.5 mt -42.34 -53.53 4.14 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 119.451 1.023 . . . . 2.0 112.12 -173.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.32 -35.18 62.4 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.97 1.308 . . . . 1.29 112.665 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.4 ttpp -77.7 -51.25 10.88 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.461 -0.774 . . . . 1.79 110.233 172.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.6 mm-40 -60.99 -30.74 70.46 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.059 0.943 . . . . 4.1699999999999999 112.243 -171.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 5.2 tt -56.61 -40.21 67.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 119.046 0.839 . . . . 1.29 110.736 170.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.92 -55.52 5.69 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.422 -0.955 . . . . 4.9800000000000004 108.422 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 3.8 tttm . . . . . 0 N--CA 1.441 -0.904 0 C-N-CA 126.617 1.967 . . . . 3.5899999999999999 109.897 -170.74 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 53.2 mt . . . . . 0 CA--C 1.536 0.442 0 N-CA-C 110.474 -0.195 . . . . 2.71 110.474 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 14.0 t -94.39 -167.98 1.76 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 124.642 1.177 . . . . 1.8200000000000001 108.971 164.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -71.83 -63.74 1.07 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.598 0.759 . . . . 2.5299999999999998 112.765 -169.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 28.0 mt -50.77 -51.32 51.49 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 120.62 1.554 . . . . 1.1599999999999999 111.26 173.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -51.98 -41.37 62.08 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.897 2.479 . . . . 3.3900000000000001 110.416 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -64.73 -58.57 5.9 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.203 1.401 . . . . 4.3499999999999996 110.437 171.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 86.0 p -53.89 -36.07 62.28 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.409 -0.807 . . . . 1.3500000000000001 112.292 -172.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.9 -32.95 46.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 O-C-N 121.952 -0.467 . . . . 1.0700000000000001 112.185 174.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.97 -54.11 43.52 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 119.261 0.937 . . . . 3.6299999999999999 109.047 170.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.2 m -38.75 -51.69 1.7 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.498 1.119 . . . . 2.3100000000000001 111.663 -178.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 34.2 m -70.57 -39.46 76.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 121.098 -1.002 . . . . 0.85999999999999999 111.99 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 55.6 t -57.1 -54.11 34.52 Favored 'Isoleucine or valine' 0 C--N 1.339 0.114 0 CA-C-N 118.655 0.661 . . . . 1.1599999999999999 109.859 174.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -59.24 -46.42 88.53 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.47 0.577 . . . . 1.0900000000000001 110.798 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 96.7 m -55.26 -51.52 66.37 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.014 -1.054 . . . . 1.1699999999999999 110.627 174.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -51.47 -47.2 63.25 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.67 -0.644 . . . . 6.8899999999999997 111.442 173.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -57.68 -48.36 79.76 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.586 1.154 . . . . 2.6099999999999999 111.227 -179.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 81.4 p -57.27 -37.44 72.37 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.767 -0.583 . . . . 2.0899999999999999 111.143 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -72.44 -40.67 66.89 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 118.145 0.43 . . . . 3.1800000000000002 110.568 173.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -51.73 -37.56 51.54 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 125.868 1.667 . . . . 1.0900000000000001 110.025 -176.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -55.18 -29.72 58.44 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 118.081 -0.962 . . . . 4.0300000000000002 112.088 -178.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.431 ' HB2' ' HG2' ' B' ' 37' ' ' GLU . 0.0 OUTLIER -51.73 -65.61 0.53 Allowed 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 114.786 1.402 . . . . 1.8600000000000001 114.786 -151.921 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -91.02 -77.35 0.42 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 119.082 -1.047 . . . . 3.98 113.521 -166.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.71 159.27 24.68 Favored Glycine 0 C--N 1.337 0.593 0 C-N-CA 127.279 2.371 . . . . 1.8899999999999999 109.86 153.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 80.4 mtt-85 49.51 102.91 0.01 OUTLIER 'General case' 0 C--O 1.242 0.706 0 N-CA-C 115.127 1.529 . . . . 3.7599999999999998 115.127 142.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -67.99 32.62 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.775 2.03 . . . . 3.1600000000000001 114.473 173.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -144.41 -58.47 0.37 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 106.911 -1.515 . . . . 4.1200000000000001 106.911 -164.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 32.4 p -79.18 111.68 15.64 Favored 'General case' 0 N--CA 1.438 -1.042 0 N-CA-C 107.345 -1.354 . . . . 2.02 107.345 168.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -57.55 135.16 56.62 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 106.993 -1.484 . . . . 1.96 106.993 162.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 13.0 m -109.65 152.36 25.68 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.84 1.256 . . . . 3.4700000000000002 108.952 -174.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 10.4 p -87.6 49.15 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 O-C-N 120.254 -1.529 . . . . 2.3999999999999999 110.83 -179.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -157.75 52.71 0.46 Allowed 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 106.08 -1.822 . . . . 2.1800000000000002 106.08 138.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.431 ' HG2' ' HB2' ' B' ' 26' ' ' GLN . 70.2 mt-10 -131.74 -49.32 0.96 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 130.963 3.705 . . . . 1.73 105.233 161.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -50.28 -57.16 8.47 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 120.506 -0.478 . . . . 2.9100000000000001 110.09 171.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . 0.292 15.7 ttmt -59.73 -41.81 91.75 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-O 117.94 -1.029 . . . . 2.73 111.522 -178.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -50.5 -48.71 56.81 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 119.461 1.028 . . . . 3.2599999999999998 110.267 173.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.97 -46.58 77.55 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.507 -0.923 . . . . 1.73 108.507 -169.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.0 m -68.93 -44.41 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 C-N-CA 120.728 -0.389 . . . . 0.78000000000000003 110.294 -176.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 86.1 m -58.63 -50.27 74.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.567 0.747 . . . . 1.26 110.466 178.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -80.14 -59.65 2.63 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 123.585 0.754 . . . . 2.0099999999999998 110.981 -169.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -75.54 -50.58 15.22 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 113.143 0.794 . . . . 3.23 113.143 -169.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.08 -27.91 3.57 Favored Pre-proline 0 CA--C 1.539 0.523 0 N-CA-C 115.248 1.574 . . . . 1.79 115.248 -151.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -63.56 -12.1 29.4 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 121.824 -2.157 . . . . 2.3900000000000001 111.046 -68.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 35.2 t60 -113.64 -32.44 6.17 Favored 'General case' 0 C--N 1.344 0.347 0 C-N-CA 125.736 1.614 . . . . 2.5699999999999998 111.373 -174.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 23.3 tp -50.77 -51.99 45.09 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.399 0.545 . . . . 1.3700000000000001 110.22 -175.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 98.1 mt -99.89 140.77 33.62 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 105.694 -1.965 . . . . 2.1000000000000001 105.694 153.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.0 28.29 2.13 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 126.756 2.022 . . . . 4.9800000000000004 108.273 -167.192 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -142.47 32.22 1.48 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 125.858 1.663 . . . . 6.0999999999999996 108.562 -156.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 11.4 m -74.7 -10.58 13.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 C-N-CA 125.599 1.56 . . . . 1.7 112.711 -173.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.91 -65.32 3.48 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 107.165 -2.374 . . . . 2.4500000000000002 107.165 162.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 2.4 p -72.01 40.01 0.07 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.016 2.126 . . . . 3.6899999999999999 112.724 175.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -64.26 -30.01 71.08 Favored 'General case' 0 N--CA 1.441 -0.887 0 O-C-N 120.986 -1.071 . . . . 1.23 108.205 165.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.1 -52.78 32.04 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.942 -0.551 . . . . 4.5 110.302 173.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -47.17 -59.5 3.11 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 124.023 0.929 . . . . 3.2999999999999998 109.351 175.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 7.6 mmpt? -60.75 -51.38 69.57 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.047 -0.524 . . . . 4.6900000000000004 109.752 -172.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.5 ttp -56.0 -47.05 78.46 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 123.259 0.624 . . . . 2.0800000000000001 110.419 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -60.62 -40.8 93.2 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.738 1.215 . . . . 4.1299999999999999 110.355 179.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 20.0 m -71.43 -31.21 66.95 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.868 0.867 . . . . 1.48 112.269 175.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 22.2 mt -73.04 -55.33 6.67 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.988 0.915 . . . . 1.52 109.54 179.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . 0.411 ' O ' ' N ' ' B' ' 66' ' ' ASN . 23.8 t70 -71.04 -10.45 59.77 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.628 2.371 . . . . 1.55 116.892 -161.162 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 24.7 m -33.26 -17.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 131.626 3.971 . . . . 1.6899999999999999 119.36 -142.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' B' ' 64' ' ' ASP . 2.3 m120 -40.63 -43.69 1.97 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.831 1.196 . . . . 2.27 110.559 151.366 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 65.53 61.16 0.7 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.324 1.45 . . . . 2.8599999999999999 109.677 -170.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 18.0 p30 -119.63 -16.45 8.83 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.059 2.144 . . . . 2.27 113.0 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 8.2 t 74.44 5.24 4.55 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.384 1.874 . . . . 3.3999999999999999 114.47 -178.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -106.21 109.72 21.74 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 124.991 1.316 . . . . 3.52 107.791 166.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -90.63 89.36 7.5 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.681 0.792 . . . . 1.27 108.918 -179.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 3.3 ttpp -84.79 177.48 7.99 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 128.082 2.553 . . . . 3.5299999999999998 112.08 -171.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -82.03 53.42 2.21 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.493 -1.38 . . . . 4.4800000000000004 113.869 -168.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -168.19 51.62 0.05 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 124.841 2.258 . . . . 2.6000000000000001 106.12 122.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -95.6 -63.25 1.18 Allowed 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 126.93 2.092 . . . . 2.0699999999999998 108.815 150.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -68.8 -26.34 65.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.308 -1.315 . . . . 6.5099999999999998 112.824 -165.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.504 ' C ' ' CD1' ' B' ' 77' ' ' TRP . 0.0 OUTLIER -45.13 -50.1 11.46 Favored 'General case' 0 C--N 1.347 0.472 0 N-CA-C 107.58 -1.267 . . . . 4.7800000000000002 107.58 170.7 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 75.5 mtm-85 -48.12 -36.41 13.27 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-O 117.203 -1.379 . . . . 6.0199999999999996 113.402 -165.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 5.4 tp -53.63 -51.42 63.16 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 120.923 1.692 . . . . 0.98999999999999999 111.299 174.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 24.5 mt -63.74 -40.18 88.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 126.045 1.738 . . . . 1.4199999999999999 107.587 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -45.27 -54.79 7.04 Favored Glycine 0 N--CA 1.443 -0.85 0 N-CA-C 108.891 -1.683 . . . . 1.9399999999999999 108.891 171.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . 0.411 ' OE2' ' NZ ' ' B' ' 85' ' ' LYS . 1.1 mm-40 -68.0 -53.71 23.97 Favored 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 125.964 1.706 . . . . 2.1800000000000002 109.004 -172.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 18.3 mt -40.31 -49.18 2.74 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.18 1.392 . . . . 2.2400000000000002 111.401 -177.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -47.1 -45.17 21.89 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.489 0.716 . . . . 1.6599999999999999 111.687 177.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . 0.411 ' NZ ' ' OE2' ' B' ' 82' ' ' GLU . 0.7 OUTLIER -81.06 -37.98 28.14 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.651 0.612 . . . . 1.3899999999999999 112.651 172.324 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -65.68 -21.14 66.52 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.388 0.994 . . . . 3.2999999999999998 112.508 -172.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 1.9 tp -45.33 -45.31 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 O-C-N 120.92 -1.113 . . . . 1.28 109.217 165.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.4 -54.29 5.59 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.191 0.996 . . . . 6.0099999999999998 111.035 174.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 68.1 mttt . . . . . 0 C--O 1.219 -0.509 0 C-N-CA 125.454 1.502 . . . . 4.7300000000000004 112.072 -171.563 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 . . . . . 0 CA--C 1.538 0.489 0 N-CA-C 108.747 -0.834 . . . . 4.3499999999999996 108.747 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.77 105.48 2.09 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.407 2.071 . . . . 3.0299999999999998 110.0 -173.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.72 160.71 26.14 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 108.206 -1.035 . . . . 2.8199999999999998 108.206 168.427 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.456 HG23 ' H ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -64.15 154.99 32.99 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 121.056 -1.027 . . . . 2.8700000000000001 110.388 -174.812 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -33.47 -48.29 0.25 Allowed 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 125.287 1.435 . . . . 2.1099999999999999 112.297 160.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.2 mt -67.15 -45.01 78.35 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 118.257 -0.878 . . . . 1.27 110.223 -175.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.456 ' H ' HG23 ' A' ' 7' ' ' THR . 63.6 mt-10 -58.12 -53.35 59.24 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.519 1.527 . . . . 2.46 111.013 172.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -47.29 -60.35 2.55 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.366 1.066 . . . . 3.3599999999999999 109.017 176.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.4 p -60.67 -49.12 78.79 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.732 0.642 . . . . 1.3999999999999999 112.732 -177.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.254 2.4 pp -62.38 -38.79 82.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 O-C-N 120.854 -1.154 . . . . 0.58999999999999997 109.99 -177.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -62.32 -48.79 78.28 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 119.736 -0.785 . . . . 3.3599999999999999 110.699 173.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -55.98 -40.66 73.63 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.755 0.788 . . . . 1.22 111.652 -176.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.8 m -75.2 -36.94 38.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 O-C-N 120.573 -1.329 . . . . 0.78000000000000003 111.088 176.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.4 t -56.42 -46.69 82.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 119.592 1.087 . . . . 0.60999999999999999 110.648 174.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.3 t -64.76 -43.08 94.47 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.565 -0.709 . . . . 0.79000000000000004 110.877 178.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.8 m -57.55 -51.99 67.25 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.487 0.585 . . . . 0.93000000000000005 110.068 176.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -45.74 -56.6 5.1 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 124.052 0.941 . . . . 3.1899999999999999 109.883 170.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -53.14 -51.61 61.4 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 123.441 0.696 . . . . 3.5099999999999998 111.543 -175.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.9 t -60.38 -36.72 78.72 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 120.1 -0.64 . . . . 2.3999999999999999 111.571 -178.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -69.92 -39.91 75.86 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 119.901 1.228 . . . . 2.5 111.096 171.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.02 -31.7 71.32 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 121.072 -1.017 . . . . 1.1399999999999999 111.525 -168.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -80.02 -18.33 50.49 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 117.494 -1.241 . . . . 4.1200000000000001 113.537 -178.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -45.24 -60.97 1.84 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.848 1.204 . . . . 1.6899999999999999 113.787 -170.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -111.42 92.09 3.91 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 127.408 2.283 . . . . 2.9300000000000002 106.116 -177.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 46.14 -168.21 0.05 OUTLIER Glycine 0 CA--C 1.527 0.821 0 C-N-CA 125.697 1.618 . . . . 1.5900000000000001 112.693 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 48.7 mtm-85 27.65 91.79 0.01 OUTLIER 'General case' 0 C--O 1.24 0.574 0 C-N-CA 126.456 1.902 . . . . 6.1600000000000001 112.525 166.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -79.6 53.28 1.55 Allowed 'General case' 0 C--O 1.232 0.142 0 C-N-CA 128.483 2.713 . . . . 4.4800000000000004 108.662 -172.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -175.51 -60.79 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 106.945 -1.502 . . . . 4.0199999999999996 106.945 -156.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.2 p -84.52 134.12 34.44 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-O 122.34 1.066 . . . . 2.1499999999999999 112.141 170.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 71' ' ' LEU . 1.5 mm? -95.55 124.59 39.65 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.857 1.263 . . . . 2.4700000000000002 108.506 176.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.6 t -82.61 173.83 11.59 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.355 1.462 . . . . 2.3300000000000001 109.058 173.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 32.9 m -70.21 -42.86 79.07 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 O-C-N 122.014 -0.429 . . . . 2.9300000000000002 110.82 -175.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -67.45 -49.05 65.37 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 118.272 -0.871 . . . . 1.8200000000000001 109.643 176.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -39.77 -50.64 2.37 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.119 1.367 . . . . 2.2200000000000002 110.307 168.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -57.67 -59.11 5.69 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.861 -0.609 . . . . 2.6699999999999999 110.95 175.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -52.09 -42.17 63.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.522 -0.308 . . . . 3.4900000000000002 111.18 -176.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -51.89 -42.37 62.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 123.256 0.622 . . . . 3.1699999999999999 111.459 177.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -63.08 -50.14 71.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 119.303 0.956 . . . . 2.9500000000000002 108.788 -176.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.2 m -72.48 -32.24 41.08 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.168 0 CA-C-N 115.804 -0.635 . . . . 1.3400000000000001 110.3 -172.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 92.7 m -75.42 -38.71 59.67 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.169 0.987 . . . . 1.4099999999999999 110.735 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -79.86 -55.67 4.81 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.285 0.634 . . . . 2.1800000000000002 110.239 -173.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -92.47 -126.74 0.09 Allowed 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.446 -0.946 . . . . 4.3300000000000001 108.446 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.447 HD22 ' H ' ' A' ' 46' ' ' LEU . 2.9 mm? 29.5 63.46 0.82 Allowed Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 127.578 2.351 . . . . 2.5 114.499 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -71.58 -44.59 1.0 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.602 2.202 . . . . 1.74 112.298 -179.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -146.05 61.36 1.25 Allowed 'General case' 0 C--N 1.341 0.233 0 CA-C-N 118.907 0.776 . . . . 3.3700000000000001 109.956 -172.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.497 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 3.8 tp -144.33 -113.67 0.1 Allowed 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 107.726 -1.213 . . . . 1.3600000000000001 107.726 -176.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 76.9 mt -59.0 162.12 4.49 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.776 0.716 . . . . 2.2200000000000002 109.186 162.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.38 -159.13 0.56 Allowed 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.889 0.875 . . . . 6.4199999999999999 109.211 -166.018 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 55.07 37.15 28.45 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.828 1.251 . . . . 3.77 108.866 -175.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.43 -24.42 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 C-N-CA 126.124 1.77 . . . . 3.1200000000000001 112.505 -167.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.93 -53.72 40.79 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 110.298 -1.121 . . . . 1.77 110.298 171.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 34.0 t -84.17 46.63 1.22 Allowed 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.554 0.742 . . . . 2.29 110.098 -174.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -53.68 -32.54 52.12 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.07 0.948 . . . . 1.4399999999999999 110.116 -176.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -38.04 -47.72 1.13 Allowed 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 127.321 2.248 . . . . 3.71 113.158 175.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -64.21 -46.24 84.72 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.861 -0.524 . . . . 4.0199999999999996 109.992 -175.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.29 -52.66 63.78 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.037 -1.097 . . . . 3.4700000000000002 108.037 175.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -46.52 -56.72 5.57 Favored 'General case' 0 C--O 1.225 -0.196 0 C-N-CA 123.406 0.683 . . . . 1.8300000000000001 111.061 177.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -66.19 -37.57 85.92 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.103 0.411 . . . . 3.3500000000000001 111.329 -176.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.7 t -58.64 -45.17 89.86 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.982 -0.449 . . . . 1.97 110.602 173.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 19.2 mt -70.2 -58.93 3.23 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.726 0.81 . . . . 1.5800000000000001 110.417 -176.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -78.61 75.64 5.12 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 124.074 0.949 . . . . 1.8799999999999999 109.057 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.5 m -51.32 -28.16 7.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 123.417 0.687 . . . . 2.3100000000000001 112.184 176.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -70.08 -33.6 72.1 Favored 'General case' 0 CA--C 1.529 0.156 0 O-C-N 121.989 -0.444 . . . . 3.1099999999999999 110.91 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 53.15 53.67 11.54 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.739 1.215 . . . . 4.04 109.29 -161.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -102.35 -13.18 17.42 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.429 1.891 . . . . 1.8600000000000001 111.525 176.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.9 m 66.17 17.57 10.77 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.073 1.349 . . . . 1.96 112.837 -177.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -111.56 112.12 23.62 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.751 -1.574 . . . . 3.1200000000000001 106.751 158.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 33' ' ' LEU . 2.6 mm? -82.97 93.7 7.6 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 104.256 -2.498 . . . . 1.1699999999999999 104.256 166.227 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.14 161.96 25.81 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.346 -0.983 . . . . 3.1800000000000002 108.346 176.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.63 -60.54 0.95 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.57 1.148 . . . . 5.5899999999999999 112.955 -169.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -69.15 -22.3 63.95 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.666 0.786 . . . . 1.9199999999999999 111.68 -175.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -72.69 -56.67 4.95 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 118.448 0.567 . . . . 2.3999999999999999 109.597 173.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -52.72 -48.77 66.44 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.301 -0.629 . . . . 2.7000000000000002 109.301 178.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.669 ' HZ2' HG23 ' B' ' 80' ' ' ILE . 58.8 t-105 -46.66 -35.87 6.45 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.693 -1.139 . . . . 5.1799999999999997 111.257 -179.02 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 77.9 mtt-85 -41.47 -45.86 3.31 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 120.182 1.356 . . . . 4.6200000000000001 111.568 176.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 7.9 tp -49.94 -40.8 44.76 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 122.764 0.426 . . . . 0.93000000000000005 110.408 -177.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.487 HG21 ' HZ3' ' A' ' 77' ' ' TRP . 25.7 mt -74.79 -26.14 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 N-CA-C 109.09 -0.707 . . . . 1.3200000000000001 109.09 -174.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.434 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -56.37 -43.69 89.89 Favored Glycine 0 CA--C 1.501 -0.786 0 N-CA-C 109.83 -1.308 . . . . 1.1699999999999999 109.83 164.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.411 ' OE2' ' NZ ' ' A' ' 85' ' ' LYS . 24.8 mm-40 -80.6 -30.77 36.83 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 117.687 -1.149 . . . . 3.1099999999999999 110.546 -178.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.497 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 8.6 mp -54.38 -59.86 4.12 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 122.189 2.268 . . . . 2.4199999999999999 108.391 167.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.58 -53.66 51.65 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.978 0.894 . . . . 1.3500000000000001 110.6 -178.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 89' ' ' LYS . 4.6 ttpp -63.36 -40.71 98.02 Favored 'General case' 0 C--O 1.211 -0.954 0 CA-C-O 116.683 -1.627 . . . . 1.6799999999999999 110.746 -178.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -51.09 -51.15 56.19 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 122.233 2.288 . . . . 3.23 108.834 178.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.8 mt -52.57 -47.39 48.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 N-CA-C 111.417 0.154 . . . . 2.0099999999999998 111.417 171.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . 2.144 41.6 mtt85 -38.98 -58.38 1.12 Allowed 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 115.462 1.653 . . . . 7.5999999999999996 115.462 161.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 75.3 tttt . . . . . 0 N--CA 1.467 0.412 0 C-N-CA 127.374 2.27 . . . . 4.2300000000000004 113.737 -127.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 CA--C 1.538 0.482 0 CA-C-O 118.595 -0.717 . . . . 5.04 109.398 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.427 HG22 ' CD ' ' B' ' 10' ' ' GLU . 13.4 t -82.49 -165.45 1.04 Allowed 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 119.306 0.957 . . . . 1.72 111.016 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -72.62 -60.76 2.08 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 123.633 0.773 . . . . 2.1299999999999999 111.41 -167.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 10.6 mt -56.68 -37.74 71.27 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 120.492 -1.38 . . . . 1.05 110.617 177.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . 0.427 ' CD ' HG22 ' B' ' 7' ' ' THR . 89.1 mt-10 -59.5 -43.48 93.34 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.757 0.823 . . . . 2.9399999999999999 111.848 174.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.01 -46.06 86.2 Favored 'General case' 0 C--N 1.339 0.146 0 O-C-N 120.79 -1.194 . . . . 5.1100000000000003 108.917 177.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -59.03 -46.29 88.58 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.742 -0.663 . . . . 1.72 110.816 -176.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.2 pp -66.98 -40.49 85.74 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 O-C-N 121.529 -0.732 . . . . 0.79000000000000004 110.997 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.51 -55.14 37.07 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.179 0.899 . . . . 3.2000000000000002 110.541 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.8 t -52.84 -36.56 58.99 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.103 0.865 . . . . 1.1499999999999999 111.593 -173.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 24.3 m -78.01 -38.29 24.1 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 O-C-N 121.237 -0.914 . . . . 0.78000000000000003 111.746 175.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 26.0 t -56.5 -51.0 70.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 119.395 0.998 . . . . 0.81999999999999995 110.466 173.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 15.3 t -61.36 -40.09 93.02 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.421 1.009 . . . . 1.0700000000000001 110.85 178.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 68.1 m -57.23 -54.63 44.65 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.421 -0.799 . . . . 0.87 110.278 173.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -45.53 -53.3 9.16 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 123.814 0.846 . . . . 4.0099999999999998 109.654 172.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -58.73 -52.33 66.14 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.194 1.398 . . . . 2.5499999999999998 110.721 -174.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 4.6 t -66.41 -26.57 67.3 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.995 -0.526 . . . . 2.6299999999999999 111.684 -177.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -80.15 -36.95 34.43 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 120.033 1.288 . . . . 2.7599999999999998 111.422 168.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.32 -32.17 72.89 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 120.833 -1.167 . . . . 1.1799999999999999 109.927 -173.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -19.54 65.27 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 117.421 -1.276 . . . . 4.3200000000000003 113.44 178.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.455 ' HB3' ' HG3' ' B' ' 37' ' ' GLU . 0.8 OUTLIER -51.1 -64.7 0.73 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 115.168 1.544 . . . . 1.6899999999999999 115.168 -158.909 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -91.27 -77.37 0.42 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 119.757 -0.777 . . . . 2.8300000000000001 112.581 -169.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.99 156.92 23.15 Favored Glycine 0 C--N 1.338 0.652 0 C-N-CA 127.77 2.605 . . . . 2.04 110.368 158.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 48.3 101.32 0.01 OUTLIER 'General case' 0 C--O 1.244 0.81 0 N-CA-C 115.772 1.767 . . . . 3.71 115.772 142.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 7.1 pttt -67.73 55.44 0.06 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 128.113 2.565 . . . . 3.5499999999999998 112.121 172.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -155.86 -49.05 0.08 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 126.465 1.906 . . . . 3.5099999999999998 107.156 -157.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 49.0 p -99.75 149.22 23.56 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 125.524 1.53 . . . . 2.2200000000000002 111.203 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -93.08 117.68 30.34 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 107.168 -1.419 . . . . 2.2599999999999998 107.168 139.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 4.6 t -83.2 -170.65 3.15 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 126.054 1.741 . . . . 2.52 108.648 161.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.454 ' C ' ' H ' ' B' ' 37' ' ' GLU . 0.1 OUTLIER -64.83 -103.83 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.362 0 C-N-CA 130.252 3.421 . . . . 3.1600000000000001 102.475 -166.798 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -75.5 55.96 0.85 Allowed 'General case' 0 CA--C 1.551 0.995 0 O-C-N 118.918 -2.364 . . . . 2.7599999999999998 111.45 -178.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.455 ' HG3' ' HB3' ' B' ' 26' ' ' GLN . 2.3 tt0 -116.43 -56.89 2.25 Favored 'General case' 0 N--CA 1.448 -0.561 1 C-N-CA 132.68 4.392 . . . . 2.0 103.716 158.404 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.58 -48.58 66.13 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.757 0.823 . . . . 2.4500000000000002 109.221 173.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -51.18 -42.53 60.91 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 120.635 -0.426 . . . . 3.7200000000000002 111.118 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -59.26 -37.87 78.68 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 118.111 0.414 . . . . 2.9100000000000001 111.778 177.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 tt -68.76 -48.96 62.38 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.939 0.79 . . . . 1.98 109.639 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 2.4 m -66.57 -39.5 84.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 120.877 0.37 . . . . 0.71999999999999997 110.039 -175.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 97.0 m -63.43 -56.5 15.71 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.455 0.702 . . . . 0.89000000000000001 110.727 174.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -80.36 -57.4 3.62 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.749 0.419 . . . . 1.78 111.617 -164.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -79.46 -46.78 16.82 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 111.826 0.306 . . . . 3.1000000000000001 111.826 -164.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' B' ' 46' ' ' LEU . 4.5 mm? -59.25 -37.55 53.48 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 113.505 0.928 . . . . 2.21 113.505 -166.102 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -60.11 -33.82 94.89 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 121.706 -2.206 . . . . 1.99 110.083 -62.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -84.64 -46.41 11.53 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.254 1.021 . . . . 3.52 112.871 -164.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.412 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 3.5 tp -42.02 -59.15 1.83 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.085 1.354 . . . . 1.23 111.428 -176.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 29.7 mt -79.74 66.09 5.1 Favored 'General case' 0 C--N 1.34 0.165 0 CA-C-O 122.111 0.958 . . . . 1.76 110.867 172.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -30.32 137.05 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 125.647 1.579 . . . . 5.6900000000000004 112.257 152.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 27.1 t0 56.2 71.25 0.57 Allowed 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.924 1.689 . . . . 3.52 110.121 -167.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 24.8 m -72.4 -1.37 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-N 112.262 -2.245 . . . . 1.5700000000000001 111.462 159.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -80.7 -56.65 3.07 Favored Glycine 0 C--N 1.342 0.898 0 N-CA-C 109.389 -1.485 . . . . 2.3500000000000001 109.389 -174.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.29 52.04 0.73 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 122.362 1.077 . . . . 2.3999999999999999 110.618 179.348 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -61.3 -40.18 93.22 Favored 'General case' 0 N--CA 1.439 -0.992 0 O-C-N 120.891 -1.13 . . . . 1.3799999999999999 108.933 179.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -54.09 -53.17 56.88 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.398 1.079 . . . . 3.48 111.547 175.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -50.13 -60.16 3.22 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.862 1.265 . . . . 2.4100000000000001 109.226 176.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.42 -57.31 13.51 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.427 -0.583 . . . . 4.2800000000000002 109.427 -175.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -43.52 -54.89 4.57 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.912 1.685 . . . . 2.0600000000000001 110.733 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 16.1 mtpp -56.61 -47.13 80.32 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.767 0.427 . . . . 3.6099999999999999 111.454 175.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.2 t -60.71 -31.9 71.16 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 118.979 -0.534 . . . . 1.6399999999999999 112.253 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 7.0 mp -75.54 -53.73 8.15 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.06 0.845 . . . . 2.0099999999999998 110.061 174.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -53.65 -9.29 0.2 Allowed 'General case' 0 C--O 1.222 -0.374 0 N-CA-C 117.462 2.393 . . . . 2.1899999999999999 117.462 -167.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.6 m -35.54 -23.04 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 129.649 3.18 . . . . 1.9199999999999999 119.119 -127.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -51.38 -32.36 25.78 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.429 1.468 . . . . 3.4399999999999999 111.544 159.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 64.01 55.05 1.61 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.579 0.751 . . . . 2.6899999999999999 109.155 177.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 51.7 p30 -91.83 -17.67 24.96 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.519 1.128 . . . . 2.1699999999999999 110.562 173.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 79.95 13.11 1.01 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.455 1.502 . . . . 2.2000000000000002 112.544 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -124.33 101.81 7.37 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 106.857 -1.534 . . . . 3.0 106.857 167.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.13 106.6 7.82 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 106.684 -1.598 . . . . 1.46 106.684 175.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 48.9 tttt -83.78 178.84 7.76 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.506 1.522 . . . . 3.5699999999999998 110.652 -162.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -83.53 80.19 9.19 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.994 1.318 . . . . 4.8099999999999996 110.553 177.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . 0.363 28.4 t-20 123.9 -164.79 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 113.37 -3.205 . . . . 4.8399999999999999 103.915 -110.082 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -31.86 -37.7 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 124.519 3.327 . . . . 2.3900000000000001 116.798 -148.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -40.53 -53.97 2.59 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 121.112 1.778 . . . . 3.8799999999999999 111.503 166.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.47 ' CH2' ' CD1' ' A' ' 77' ' ' TRP . 58.6 t90 -40.1 -32.03 0.15 Allowed 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 126.768 2.027 . . . . 3.73 114.838 173.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -46.54 -45.22 18.51 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 121.114 1.779 . . . . 6.7999999999999998 110.276 170.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.7 tp -44.82 -49.74 10.61 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 124.725 1.21 . . . . 1.0700000000000001 111.497 177.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . 0.669 HG23 ' HZ2' ' A' ' 77' ' ' TRP 0.322 8.7 tt -75.35 -21.84 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 N-CA-C 106.569 -1.641 . . . . 2.6000000000000001 106.569 -166.789 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.56 ' HA2' ' CE2' ' A' ' 77' ' ' TRP . . . -59.03 -50.62 65.88 Favored Glycine 0 CA--C 1.491 -1.408 0 C-N-CA 125.003 1.287 . . . . 1.49 110.46 167.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -67.62 -47.39 69.75 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 106.871 -1.529 . . . . 2.1899999999999999 106.871 -176.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.412 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 10.6 mp -44.0 -61.06 1.58 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 120.678 1.581 . . . . 2.02 111.803 171.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.31 -44.42 84.12 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.84 0.856 . . . . 1.2 111.561 -177.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -65.3 -54.04 35.03 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.977 1.311 . . . . 1.51 110.227 -177.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -57.01 -38.91 73.79 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.582 1.553 . . . . 2.46 110.931 -173.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 2.0 tt -51.38 -36.46 17.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 118.814 0.733 . . . . 1.0800000000000001 111.082 175.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.45 -49.82 10.17 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.736 0.815 . . . . 5.7800000000000002 109.754 174.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 67.1 mttt . . . . . 0 C--O 1.223 -0.296 0 C-N-CA 126.264 1.826 . . . . 5.9000000000000004 111.927 -160.168 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.2 mp0 . . . . . 0 N--CA 1.448 -0.557 0 CA-C-O 119.449 -0.31 . . . . 4.2400000000000002 110.26 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.52 104.81 1.64 Allowed 'Trans proline' 0 N--CA 1.45 -1.032 0 C-N-CA 122.313 2.009 . . . . 2.52 109.564 -179.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 64.5 mt -59.28 152.11 21.7 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 108.951 -0.759 . . . . 1.3300000000000001 108.951 170.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.3 t -70.17 171.76 9.19 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 120.436 -0.505 . . . . 1.76 110.188 -178.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -63.77 -55.58 22.06 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 121.109 -0.995 . . . . 2.8900000000000001 110.914 -172.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.1 mp -57.13 -41.33 78.86 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 118.833 -1.147 . . . . 1.6399999999999999 110.148 -176.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -57.59 -51.15 70.68 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 127.835 2.454 . . . . 2.0099999999999998 111.284 175.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -52.87 63.83 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 108.665 -0.865 . . . . 5.1200000000000001 108.665 177.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.9 m -61.09 -46.93 88.65 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 111.805 0.298 . . . . 2.0299999999999998 111.805 -175.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.42 ' CD1' HG13 ' B' ' 87' ' ' ILE . 2.3 pp -64.1 -41.72 93.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 O-C-N 120.822 -1.174 . . . . 0.76000000000000001 109.923 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -59.47 -49.25 78.51 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.402 1.001 . . . . 3.5800000000000001 110.494 177.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.2 -40.52 74.15 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.597 0.713 . . . . 1.3500000000000001 111.032 -175.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.4 m -75.45 -36.33 35.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 O-C-N 120.696 -1.252 . . . . 0.62 111.413 175.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 45.7 t -58.56 -46.56 89.93 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 CA-C-N 119.684 1.129 . . . . 0.76000000000000001 110.064 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -63.43 -44.07 95.61 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.54 -0.743 . . . . 1.04 110.47 177.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 76.6 m -54.75 -48.32 72.74 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-N 119.01 0.823 . . . . 0.77000000000000002 110.262 177.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -54.92 -61.19 2.47 Favored 'General case' 0 C--O 1.226 -0.148 0 N-CA-C 109.818 -0.438 . . . . 3.3599999999999999 109.818 172.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -60.88 -48.76 80.32 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.261 0.624 . . . . 3.2000000000000002 110.996 -163.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -62.64 -25.4 68.1 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 119.333 -0.365 . . . . 2.5499999999999998 111.154 179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -82.7 -58.97 2.67 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 123.407 0.683 . . . . 2.8900000000000001 111.114 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -45.12 -24.28 0.23 Allowed 'General case' 0 C--O 1.238 0.472 1 C-N-CA 132.647 4.379 . . . . 0.92000000000000004 115.55 178.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.53 -23.62 51.38 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 123.918 0.761 . . . . 3.8700000000000001 112.082 169.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -38.49 -66.76 0.24 Allowed 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 127.231 2.213 . . . . 1.6599999999999999 113.435 -163.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -99.99 34.25 2.36 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 108.755 -0.831 . . . . 3.1099999999999999 108.755 -174.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 65.0 -168.04 29.72 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-O 122.374 0.985 . . . . 1.8799999999999999 110.707 -164.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? 53.66 72.96 0.4 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.194 -1.039 . . . . 9.8699999999999992 108.194 -178.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.2 pttt -61.81 -34.9 76.74 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 123.491 0.717 . . . . 4.4500000000000002 111.876 -170.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -83.93 14.1 4.37 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 118.494 -0.765 . . . . 3.54 111.669 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.3 p -125.69 145.45 50.17 Favored 'General case' 0 C--N 1.348 0.542 0 C-N-CA 124.279 1.032 . . . . 2.7200000000000002 111.601 175.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mt -102.75 123.41 46.37 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 108.769 -0.826 . . . . 2.5699999999999998 108.769 149.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.33 177.74 8.37 Favored 'General case' 0 C--O 1.225 -0.231 0 O-C-N 121.223 -0.923 . . . . 2.4900000000000002 110.15 167.574 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 93.2 t -46.44 -59.31 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 C-N-CA 123.754 0.822 . . . . 2.2400000000000002 111.167 178.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -58.19 -59.17 5.71 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 118.757 -0.639 . . . . 2.23 109.687 -177.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -39.19 -47.94 1.69 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.777 1.231 . . . . 2.23 111.998 171.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . 0.4 ' CE2' ' HG ' ' A' ' 71' ' ' LEU . 0.2 OUTLIER -58.86 -58.06 10.28 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.707 0.803 . . . . 3.4700000000000002 110.492 177.813 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.409 ' O ' HG22 ' A' ' 42' ' ' VAL . 21.6 ttmt -61.03 -38.66 86.92 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.874 -0.33 . . . . 2.96 110.691 -174.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -51.86 -35.05 43.51 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 118.687 -0.673 . . . . 2.5800000000000001 111.367 173.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.82 -43.33 75.77 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 119.978 1.263 . . . . 2.1899999999999999 108.352 -176.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . 0.409 HG22 ' O ' ' A' ' 39' ' ' LYS . 13.8 m -65.57 -42.97 94.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 N-CA-C 109.542 -0.54 . . . . 1.5900000000000001 109.542 -175.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.0 m -57.7 -49.34 76.86 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.807 0.843 . . . . 2.02 111.261 170.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -56.46 12.66 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.769 1.228 . . . . 4.3399999999999999 111.933 -171.046 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -152.48 70.85 0.92 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 119.02 0.827 . . . . 3.7400000000000002 111.278 -175.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.414 ' N ' ' CD ' ' A' ' 47' ' ' PRO . 2.7 tp -156.5 31.41 0.04 OUTLIER Pre-proline 0 CA--C 1.542 0.668 0 N-CA-C 114.855 1.428 . . . . 1.79 114.855 174.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.414 ' CD ' ' N ' ' A' ' 46' ' ' LEU . 39.0 Cg_endo -63.03 -64.99 0.06 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 121.916 1.744 . . . . 2.1800000000000002 113.586 -172.074 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -87.04 41.63 0.98 Allowed 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.096 -1.003 . . . . 3.7799999999999998 111.611 -160.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.492 HD23 HD22 ' A' ' 83' ' ' LEU . 1.5 tp -141.95 -82.5 0.2 Allowed 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.172 0.989 . . . . 1.3100000000000001 110.844 -172.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 32.0 mt -87.96 75.39 8.8 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 107.736 -1.209 . . . . 1.95 107.736 -178.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . 0.407 ' NZ ' ' OE1' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -43.13 143.61 0.77 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.568 -1.196 . . . . 6.9800000000000004 110.33 160.437 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.1 t0 65.31 81.5 0.2 Allowed 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.537 1.535 . . . . 4.4000000000000004 110.042 -159.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -88.57 3.7 5.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-N 113.539 -1.664 . . . . 2.3900000000000001 110.681 163.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -94.77 -57.78 1.22 Allowed Glycine 0 C--N 1.342 0.897 0 N-CA-C 109.777 -1.329 . . . . 1.8600000000000001 109.777 -170.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.5 t -90.9 30.19 1.24 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.096 1.359 . . . . 2.5600000000000001 110.007 173.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -40.59 -38.25 0.84 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 126.244 1.818 . . . . 1.8300000000000001 110.963 166.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -42.44 -41.92 3.08 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.328 2.251 . . . . 4.5099999999999998 111.157 175.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -56.42 -54.65 43.09 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.548 1.139 . . . . 2.79 111.089 173.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.433 ' HE3' ' H ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -58.1 -53.79 54.24 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 106.735 -1.58 . . . . 3.1800000000000002 106.735 -179.291 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -45.62 -52.12 11.14 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.081 0.953 . . . . 1.8200000000000001 111.147 178.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -64.52 -29.86 70.89 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.611 -0.68 . . . . 3.8700000000000001 112.493 178.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.8 t -67.83 -48.14 67.05 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.373 0.533 . . . . 1.79 110.438 173.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.1 mp -57.97 -48.45 79.95 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.729 -0.607 . . . . 1.97 110.167 177.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -71.8 81.65 0.88 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.515 -0.311 . . . . 2.7200000000000002 110.272 -172.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.1 m -47.8 -36.57 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 124.032 0.933 . . . . 1.78 113.499 -174.119 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.0 p-10 -98.52 -0.12 43.95 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.295 0.85 . . . . 2.3100000000000001 113.295 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 44.2 58.6 3.64 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 126.985 2.114 . . . . 4.2999999999999998 112.517 178.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 45.4 p30 -100.14 -3.48 31.66 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.888 1.275 . . . . 1.6899999999999999 112.317 178.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 28.1 m 65.17 21.92 12.18 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.977 1.311 . . . . 1.8300000000000001 113.144 -174.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -129.43 100.6 5.62 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 105.329 -2.1 . . . . 4.0899999999999999 105.329 171.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . 0.4 ' HG ' ' CE2' ' A' ' 38' ' ' PHE . 0.2 OUTLIER -81.62 88.16 6.24 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 103.151 -2.907 . . . . 1.0900000000000001 103.151 176.142 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -54.2 155.59 3.61 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.746 -1.205 . . . . 4.25 107.746 176.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -37.18 -55.77 0.96 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.239 1.016 . . . . 5.0800000000000001 112.815 -173.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -76.31 -18.27 59.03 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.191 0.812 . . . . 4.04 113.191 -175.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -73.79 -60.05 2.43 Favored 'General case' 0 CA--C 1.529 0.161 0 O-C-N 121.364 -0.835 . . . . 2.0699999999999998 108.905 166.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -43.09 -47.79 6.11 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 124.387 1.075 . . . . 3.5 110.435 176.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.626 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 39.8 t90 -39.77 -41.14 1.06 Allowed 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 124.641 1.176 . . . . 4.4199999999999999 112.613 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -46.45 -38.33 8.98 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 117.976 -1.012 . . . . 5.5700000000000003 112.557 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.0 tp -53.2 -48.11 68.35 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 120.082 1.31 . . . . 0.80000000000000004 110.346 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 53.0 mt -59.14 -30.02 42.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 N-CA-C 108.161 -1.051 . . . . 1.6399999999999999 108.161 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.569 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -67.13 -50.81 43.09 Favored Glycine 0 CA--C 1.491 -1.444 0 C-N-CA 125.922 1.725 . . . . 1.26 111.399 177.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -67.9 -23.84 65.15 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 107.651 -1.24 . . . . 2.21 107.651 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.492 HD22 HD23 ' A' ' 49' ' ' LEU . 13.4 mt -68.01 -54.11 20.88 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 120.636 1.562 . . . . 1.9399999999999999 111.647 166.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.95 -28.4 62.15 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.906 0.883 . . . . 1.1000000000000001 111.527 -178.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -79.87 -52.67 7.59 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.727 1.611 . . . . 1.72 107.459 173.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . 0.407 ' OE1' ' NZ ' ' A' ' 51' ' ' LYS 2.099 11.0 pt-20 -31.79 -61.05 0.24 Allowed 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 129.414 3.085 . . . . 2.4900000000000002 113.42 171.916 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 8.3 tt -56.27 -32.33 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 CA-C-N 115.748 -0.66 . . . . 1.26 112.277 -172.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.33 -57.15 2.88 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.737 0.815 . . . . 4.6500000000000004 109.506 176.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 56.8 tttp . . . . . 0 CA--C 1.53 0.188 0 C-N-CA 128.866 2.866 . . . . 2.7400000000000002 113.065 -179.818 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.447 -0.592 0 CA-C-O 120.035 -0.031 . . . . 3.2400000000000002 110.99 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.555 HG22 ' HG3' ' B' ' 10' ' ' GLU . 4.7 t -74.17 -168.35 0.63 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.107 1.363 . . . . 1.8600000000000001 111.286 174.452 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.516 ' HA ' ' HG2' ' B' ' 11' ' ' GLU . 62.0 tt0 -67.5 -59.99 2.93 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 122.176 0.989 . . . . 2.4399999999999999 111.989 -173.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -53.47 -40.73 65.54 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 120.552 -1.342 . . . . 1.04 110.676 176.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . 0.555 ' HG3' HG22 ' B' ' 7' ' ' THR . 42.1 mt-10 -57.81 -49.83 75.31 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.365 0.666 . . . . 2.8799999999999999 112.208 173.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . 0.516 ' HG2' ' HA ' ' B' ' 8' ' ' GLU . 13.6 pt-20 -61.44 -38.0 85.56 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 120.463 -1.398 . . . . 3.98 110.552 177.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 9.4 t -59.73 -49.29 78.33 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.066 0.546 . . . . 1.76 110.981 177.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.268 2.4 pp -62.49 -35.2 68.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 O-C-N 121.035 -1.041 . . . . 0.88 111.069 173.121 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -54.79 -59.93 4.06 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.077 -0.963 . . . . 2.8100000000000001 111.063 174.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 12.8 t -50.65 -43.33 57.15 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.758 1.163 . . . . 1.3600000000000001 112.052 -171.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.3 m -69.74 -43.81 79.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 O-C-N 120.967 -1.083 . . . . 0.89000000000000001 110.887 177.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 41.1 t -55.06 -53.4 34.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-O 118.669 -0.682 . . . . 1.02 110.465 175.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 9.3 t -58.86 -45.97 88.87 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.334 0.97 . . . . 1.0900000000000001 110.801 178.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 94.6 m -52.95 -55.29 24.48 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.71 0.686 . . . . 0.97999999999999998 110.266 177.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -54.54 -44.04 72.5 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.751 -0.593 . . . . 7.0999999999999996 111.482 174.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -64.95 -26.9 68.5 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.621 1.168 . . . . 2.3599999999999999 112.299 -177.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 67.2 p -69.88 -61.29 1.84 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.366 0.985 . . . . 2.3700000000000001 108.644 167.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -54.45 -29.55 49.94 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 113.105 0.78 . . . . 2.96 113.105 -177.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -51.0 -33.02 23.03 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 126.209 1.804 . . . . 1.22 111.017 176.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -37.95 76.03 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 117.337 -1.316 . . . . 5.3600000000000003 110.825 178.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.556 ' CB ' ' HG2' ' B' ' 37' ' ' GLU . 1.5 tp60 -39.69 -65.82 0.35 Allowed 'General case' 0 C--O 1.24 0.582 0 O-C-N 124.962 1.414 . . . . 2.5899999999999999 111.974 -143.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -95.24 -73.47 0.58 Allowed 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 125.531 1.769 . . . . 3.7200000000000002 113.473 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.11 123.43 7.48 Favored Glycine 0 C--N 1.338 0.67 0 CA-C-O 115.584 -2.787 . . . . 2.3399999999999999 112.811 178.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 53.2 ttt85 52.44 102.83 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 121.752 2.776 . . . . 4.8899999999999997 115.08 149.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.61 50.32 0.18 Allowed 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 116.231 1.937 . . . . 6.1500000000000004 116.231 -172.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -137.08 -54.09 0.7 Allowed 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 126.243 1.817 . . . . 3.3300000000000001 107.618 177.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 56.4 p -73.38 145.84 45.59 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.834 1.253 . . . . 2.1600000000000001 110.568 175.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.04 -173.3 4.65 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 108.496 -0.927 . . . . 2.04 108.496 157.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . 0.273 3.9 t -157.4 -167.98 2.46 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 122.771 1.272 . . . . 2.4199999999999999 113.581 -158.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 15.9 t -68.17 -131.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.651 1 N-CA-C 98.204 -4.739 . . . . 3.2999999999999998 98.204 151.319 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 15.2 t30 -75.26 56.1 0.8 Allowed 'General case' 0 CA--C 1.557 1.217 0 O-C-N 118.062 -2.899 . . . . 2.8700000000000001 112.323 -160.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.556 ' HG2' ' CB ' ' B' ' 26' ' ' GLN . 58.0 mt-10 -102.85 -50.81 3.43 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 128.971 2.908 . . . . 1.77 107.688 139.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -56.07 -52.16 65.27 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.223 -1.028 . . . . 2.8599999999999999 108.223 174.023 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . 0.433 ' HA ' HG22 ' B' ' 42' ' ' VAL 0.266 53.5 tttm -54.28 -45.7 72.54 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 118.602 -1.239 . . . . 3.9500000000000002 110.24 -175.113 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -57.93 -39.62 78.48 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 119.116 -0.468 . . . . 2.8300000000000001 112.219 176.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 4.7 tt -66.87 -46.01 76.33 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 119.626 1.103 . . . . 1.6799999999999999 109.699 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . 0.433 HG22 ' HA ' ' B' ' 39' ' ' LYS . 27.4 m -69.94 -44.27 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-O 121.551 0.691 . . . . 0.66000000000000003 109.219 -173.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 86.8 m -66.0 -49.98 65.88 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.262 1.025 . . . . 1.22 109.855 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -80.52 -62.46 1.67 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.256 0.222 . . . . 1.98 111.173 -171.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -83.9 -44.12 14.59 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 122.897 0.479 . . . . 2.7000000000000002 112.14 -167.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.8 tp -82.71 -18.79 0.26 Allowed Pre-proline 0 CA--C 1.548 0.869 0 N-CA-C 118.768 2.877 . . . . 1.78 118.768 -167.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -46.2 -44.6 19.53 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 124.091 3.194 . . . . 2.4700000000000002 117.158 -133.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -62.47 -44.26 96.82 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.182 0.808 . . . . 2.2000000000000002 113.182 -172.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.5 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 12.0 tp -57.34 -77.04 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.604 1.162 . . . . 1.1799999999999999 112.6 -163.654 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 5.8 mt -67.06 -40.75 87.17 Favored 'General case' 0 C--N 1.339 0.144 0 O-C-N 121.728 -0.608 . . . . 3.9700000000000002 110.336 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 12.1 tptp 62.82 171.28 0.14 Allowed 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.194 0.998 . . . . 7.5999999999999996 111.611 -174.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 12.9 t0 46.66 62.41 2.34 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 123.812 1.768 . . . . 3.7000000000000002 108.623 -160.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 26.9 m -84.19 28.17 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 112.446 -2.161 . . . . 2.2200000000000002 109.933 162.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -104.61 -63.75 0.66 Allowed Glycine 0 C--N 1.341 0.821 0 N-CA-C 107.654 -2.178 . . . . 2.5699999999999998 107.654 172.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.75 54.4 1.82 Allowed 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.851 1.261 . . . . 3.3399999999999999 110.315 -174.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -61.26 -35.68 77.94 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 125.134 1.373 . . . . 1.1799999999999999 110.224 -172.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -29.26 -57.88 0.15 Allowed 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 126.367 1.867 . . . . 4.0 114.125 171.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -49.09 -60.29 2.91 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.053 0.941 . . . . 2.3199999999999998 109.528 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 2.9 mtmt -61.1 -49.04 78.91 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.893 -1.049 . . . . 4.5300000000000002 109.672 -176.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -51.8 -51.96 52.61 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.953 0.797 . . . . 2.1400000000000001 110.83 178.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -64.94 -34.73 79.11 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 122.729 0.412 . . . . 3.8300000000000001 110.978 -178.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 5.3 t -67.72 -37.17 81.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.387 0.675 . . . . 1.6399999999999999 111.774 174.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 79.5 mt -69.13 -58.81 3.57 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.019 0.928 . . . . 1.4399999999999999 109.482 177.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . 0.417 ' O ' ' N ' ' B' ' 66' ' ' ASN 0.314 2.1 t70 -55.8 -9.51 0.57 Allowed 'General case' 0 C--O 1.221 -0.407 0 N-CA-C 117.461 2.393 . . . . 2.8399999999999999 117.461 -165.638 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 28.1 m -34.54 -24.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 129.172 2.989 . . . . 1.4399999999999999 118.717 -127.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . 0.417 ' N ' ' O ' ' B' ' 64' ' ' ASP . 0.3 OUTLIER -53.2 -34.56 57.54 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.816 1.189 . . . . 3.6499999999999999 111.232 160.784 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 66.07 56.12 0.86 Allowed 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.751 1.621 . . . . 4.0999999999999996 111.727 171.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -89.96 -33.05 16.53 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 114.651 -1.159 . . . . 3.5499999999999998 109.374 158.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 4.1 m 101.3 -4.27 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 128.154 2.581 . . . . 2.3999999999999999 114.005 175.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -101.22 132.54 46.67 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 106.401 -1.703 . . . . 5.2800000000000002 106.401 164.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -99.79 118.5 36.39 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 106.61 -1.626 . . . . 1.1499999999999999 106.61 -167.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 6.9 tptm -79.74 176.37 9.78 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.841 0.856 . . . . 3.1200000000000001 109.104 -171.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -80.4 76.1 7.23 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 107.911 -1.144 . . . . 4.4199999999999999 107.911 -174.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 97.91 53.98 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.304 1 C-N-CA 133.589 4.756 . . . . 2.1499999999999999 108.922 -164.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -87.89 -61.84 1.63 Allowed 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 121.092 -1.005 . . . . 1.73 108.6 107.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -45.11 -43.64 9.84 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.651 1.18 . . . . 6.0099999999999998 114.076 -162.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.626 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 16.9 t-105 -39.94 -36.62 0.48 Allowed 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.416 1.487 . . . . 4.7699999999999996 112.495 177.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 10.4 mtt180 -38.36 -51.06 1.52 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.434 1.016 . . . . 4.6299999999999999 111.601 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 2.7 tp -53.36 -38.77 63.6 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 123.099 0.25 . . . . 1.1299999999999999 110.627 -175.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 70.7 mt -63.42 -25.47 38.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-O 121.729 0.776 . . . . 1.55 109.604 -174.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.552 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -74.48 -40.88 38.24 Favored Glycine 0 CA--C 1.49 -1.531 0 N-CA-C 109.674 -1.37 . . . . 1.3300000000000001 109.674 179.076 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.94 -52.93 53.67 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 105.559 -2.015 . . . . 2.3399999999999999 105.559 178.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.5 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 9.5 mp -42.22 -61.56 1.14 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.646 1.112 . . . . 2.1000000000000001 111.709 172.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.44 -44.38 92.95 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.771 0.796 . . . . 1.1599999999999999 111.805 -175.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 28.8 ttmt -62.69 -55.0 30.87 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.246 1.419 . . . . 1.6200000000000001 110.426 -179.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -57.62 -44.62 85.65 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.056 0.942 . . . . 2.3999999999999999 109.834 -170.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . 0.42 HG13 ' CD1' ' A' ' 13' ' ' ILE . 0.2 OUTLIER -39.89 -48.34 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 125.433 1.493 . . . . 1.5700000000000001 112.67 166.149 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.54 -34.05 31.38 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.234 1.014 . . . . 3.9300000000000002 110.606 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 43.4 mttm . . . . . 0 C--O 1.223 -0.305 0 C-N-CA 126.353 1.861 . . . . 5.8899999999999997 110.731 -163.554 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 . . . . . 0 N--CA 1.443 -0.822 0 CA-C-O 118.939 -0.553 . . . . 6.2199999999999998 109.967 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.97 96.85 0.79 Allowed 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 122.575 2.183 . . . . 2.75 110.308 179.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 93.4 mt -57.83 157.52 7.44 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.574 0.75 . . . . 1.71 111.033 173.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 10' ' ' GLU . 4.4 t -75.24 159.79 31.13 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 108.806 -0.813 . . . . 2.4900000000000002 108.806 176.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 68.2 tt0 -51.1 -45.95 61.68 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 123.481 0.712 . . . . 4.2800000000000002 110.803 -177.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.4 mt -64.74 -55.97 16.56 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.396 -0.811 . . . . 1.5900000000000001 111.028 -177.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.407 ' H ' HG23 ' A' ' 7' ' ' THR . 97.9 mt-10 -49.24 -54.29 17.44 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.155 1.382 . . . . 2.1899999999999999 110.678 176.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -50.26 -59.89 3.51 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 124.377 1.071 . . . . 3.8999999999999999 109.609 174.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.1 p -56.61 -43.75 80.49 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.558 -0.714 . . . . 1.5600000000000001 111.296 -174.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.308 2.7 pp -66.81 -42.94 89.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-O 118.743 -0.646 . . . . 0.68999999999999995 110.44 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -61.04 -49.95 75.3 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 119.435 -0.906 . . . . 3.4100000000000001 109.912 175.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 m -46.02 -51.38 13.69 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.005 1.722 . . . . 1.7 112.64 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 30.1 m -71.64 -40.33 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 O-C-N 120.335 -1.478 . . . . 0.73999999999999999 110.163 178.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 36.2 t -55.07 -43.03 68.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 123.024 0.53 . . . . 0.72999999999999998 110.586 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.7 t -61.99 -52.61 63.3 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.276 0.944 . . . . 0.92000000000000004 110.716 178.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.9 m -57.69 -50.71 72.29 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.584 1.084 . . . . 1.1200000000000001 110.529 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -45.21 -55.59 5.66 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 124.965 1.306 . . . . 2.9900000000000002 110.517 171.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -58.16 -51.93 67.69 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.953 0.901 . . . . 3.9500000000000002 110.58 -177.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 12.4 p -56.69 -38.74 72.69 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 119.41 -0.329 . . . . 2.3100000000000001 111.306 -179.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -65.32 -52.88 51.01 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 121.386 0.612 . . . . 2.52 110.983 171.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.2 -19.88 65.64 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.143 1.377 . . . . 0.85999999999999999 112.062 -170.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.31 -33.32 75.57 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 117.977 -1.011 . . . . 6.0199999999999996 110.148 173.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.421 ' HB3' ' HG3' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -38.99 -77.17 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.86 0.864 . . . . 2.52 112.411 -173.11 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . 0.421 ' HG3' ' HB3' ' A' ' 26' ' ' GLN . 71.9 mt-10 -100.96 173.38 6.51 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 127.203 2.201 . . . . 2.4900000000000002 106.663 -174.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -33.42 141.29 0.08 OUTLIER Glycine 0 CA--C 1.538 1.49 0 C-N-CA 125.978 1.752 . . . . 1.49 115.214 -173.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? 62.2 105.32 0.03 OUTLIER 'General case' 0 C--O 1.237 0.438 0 C-N-CA 125.22 1.408 . . . . 4.6500000000000004 111.753 -177.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -73.34 50.6 0.31 Allowed 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.281 0.845 . . . . 3.6000000000000001 113.281 176.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.7 p-10 -172.31 -32.6 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 127.429 2.292 . . . . 3.4700000000000002 109.346 171.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.7 m -78.11 130.08 35.96 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.755 -0.831 . . . . 2.2999999999999998 108.755 170.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -83.54 154.12 24.0 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 106.449 -1.686 . . . . 2.0699999999999998 106.449 162.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.4 m -122.46 170.88 9.53 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 107.204 -1.406 . . . . 2.98 107.204 161.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.1 p -48.48 -52.1 9.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 N-CA-C 112.804 0.668 . . . . 2.0899999999999999 112.804 -165.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -62.82 -57.74 9.83 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.555 -0.736 . . . . 2.5299999999999998 109.798 -178.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -38.47 -51.1 1.57 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.08 1.352 . . . . 1.6599999999999999 111.413 174.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.77 -49.02 78.03 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 114.966 -1.016 . . . . 3.1499999999999999 109.716 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -59.95 -39.57 86.03 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 118.671 -0.68 . . . . 4.0099999999999998 110.33 -176.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -53.66 -44.05 69.33 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 118.259 0.481 . . . . 3.6800000000000002 110.753 171.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.12 -49.61 73.75 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 108.523 -0.917 . . . . 3.21 108.523 -173.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.5 m -68.95 -52.21 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 N-CA-C 108.852 -0.796 . . . . 1.24 108.852 -175.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.9 m -52.79 -51.56 60.25 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.5 1.12 . . . . 1.6899999999999999 111.199 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -72.43 -50.89 23.05 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 122.543 0.337 . . . . 3.5899999999999999 110.268 -175.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -94.69 -26.63 16.23 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.094 0.776 . . . . 4.1200000000000001 113.094 -161.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.8 mp -107.96 93.42 10.76 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 119.167 0.894 . . . . 2.2599999999999998 110.11 -175.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -72.07 -44.34 0.91 Allowed 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.24 1.96 . . . . 2.3599999999999999 111.453 -177.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.2 t-160 -150.63 44.33 0.84 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.161 0.505 . . . . 3.8399999999999999 110.692 -174.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 19.8 tp -95.48 -80.98 0.41 Allowed 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.01 -1.478 . . . . 1.95 107.01 167.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.3 mt -75.73 84.24 2.72 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.279 -0.637 . . . . 2.2999999999999998 109.279 172.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.01 143.48 1.12 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.664 -0.698 . . . . 5.7300000000000004 110.718 163.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 67.43 39.11 3.0 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 125.774 1.63 . . . . 4.1900000000000004 110.475 177.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -49.83 -25.59 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 125.96 1.704 . . . . 3.1499999999999999 113.991 -177.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.53 -44.08 21.85 Favored Glycine 0 CA--C 1.532 1.143 0 N-CA-C 111.183 -0.767 . . . . 1.9099999999999999 111.183 170.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 47.1 t -74.66 45.79 0.26 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.113 1.765 . . . . 2.8500000000000001 111.038 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -66.04 -49.92 66.0 Favored 'General case' 0 N--CA 1.445 -0.725 0 O-C-N 120.846 -1.159 . . . . 1.5700000000000001 108.347 174.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.12 -38.15 56.49 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.797 1.639 . . . . 4.1100000000000003 111.904 -167.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -55.41 -53.69 53.03 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.755 -0.591 . . . . 3.2599999999999998 110.925 170.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.45 -46.06 89.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.974 -0.75 . . . . 2.75 108.974 175.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . 0.432 ' HA ' HD12 ' A' ' 63' ' ' LEU . 18.7 tmm? -44.91 -52.72 8.38 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 123.875 0.87 . . . . 1.8799999999999999 109.158 179.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -68.82 -39.89 79.79 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.843 -0.617 . . . . 4.6600000000000001 111.423 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.1 t -58.73 -30.04 67.17 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.895 0.702 . . . . 2.5899999999999999 112.895 175.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.542 HD23 ' HB2' ' A' ' 78' ' ' ARG . 0.1 OUTLIER -88.43 -45.26 10.11 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.536 -0.727 . . . . 1.96 109.431 175.717 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -75.2 61.25 1.13 Allowed 'General case' 0 C--N 1.342 0.256 0 C-N-CA 124.775 1.23 . . . . 1.6399999999999999 111.012 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 25.7 m -58.67 -34.11 50.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.934 0.894 . . . . 1.79 112.281 -174.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -82.74 -8.4 59.59 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.347 0.499 . . . . 2.4900000000000002 112.347 177.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . 0.266 2.9 tp60 50.93 66.55 1.14 Allowed 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.878 2.071 . . . . 4.4100000000000001 113.407 178.25 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.8 p30 -113.17 -4.98 13.69 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.685 1.194 . . . . 2.4500000000000002 111.774 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.4 m 62.53 15.38 7.84 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.304 1.041 . . . . 1.98 113.454 -171.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -112.11 109.6 19.42 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.602 1.561 . . . . 3.4700000000000002 107.066 165.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -88.35 74.86 8.58 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 105.472 -2.047 . . . . 1.3600000000000001 105.472 170.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.68 159.91 33.57 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.008 0.433 . . . . 3.3199999999999998 110.886 177.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 15.5 p90 -37.59 -55.96 1.07 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.888 1.675 . . . . 5.4100000000000001 114.057 -162.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.11 -40.27 90.59 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.85 0.75 . . . . 2.3100000000000001 111.721 -177.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -76.46 -44.0 37.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 120.087 1.312 . . . . 2.1200000000000001 109.686 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -44.55 -50.16 9.73 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 118.551 0.614 . . . . 3.3500000000000001 109.961 167.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.634 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 1.2 t-105 -46.51 -32.23 3.23 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 116.938 -1.506 . . . . 4.0300000000000002 112.418 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.542 ' HB2' HD23 ' A' ' 63' ' ' LEU . 0.5 OUTLIER -38.69 -49.08 1.55 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 120.694 1.588 . . . . 4.6799999999999997 109.939 172.621 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.8 tp -48.42 -46.04 37.0 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.834 0.854 . . . . 0.81999999999999995 110.251 -176.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 91.3 mt -62.99 -31.77 53.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 109.12 -0.696 . . . . 1.74 109.12 -171.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.556 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -67.99 -45.71 71.19 Favored Glycine 0 CA--C 1.488 -1.624 0 N-CA-C 109.656 -1.378 . . . . 1.23 109.656 178.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -69.33 -49.03 59.51 Favored 'General case' 0 N--CA 1.422 -1.873 0 N-CA-C 105.825 -1.917 . . . . 2.3900000000000001 105.825 -173.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 9.5 mt -41.26 -59.1 1.62 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 120.881 1.673 . . . . 2.4500000000000002 111.631 166.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.36 -30.74 63.05 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.513 0.725 . . . . 1.29 111.716 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 -57.23 4.93 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 123.228 0.611 . . . . 1.8 110.439 171.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -50.25 -48.05 54.86 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 128.689 2.796 . . . . 2.2200000000000002 108.968 -174.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.8 tt -61.6 -21.22 24.97 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 113.849 1.055 . . . . 1.96 113.849 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 49.8 ttt85 -96.8 -60.37 1.61 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.303 1.441 . . . . 5.3099999999999996 109.129 178.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 40.5 pttt . . . . . 0 CA--C 1.547 0.842 0 C-N-CA 124.432 1.093 . . . . 3.9199999999999999 113.799 -179.381 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 42.3 mt . . . . . 0 CA--C 1.541 0.615 0 N-CA-C 109.097 -0.705 . . . . 3.7400000000000002 109.097 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 11.6 t -75.57 178.62 5.87 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 119.123 0.874 . . . . 2.3399999999999999 109.94 -177.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -61.59 -63.09 1.38 Allowed 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.526 0.679 . . . . 3.4100000000000001 110.508 -172.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 mp -56.48 -44.13 80.33 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 121.447 -0.783 . . . . 2.0800000000000001 109.783 -175.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.41 -46.03 69.59 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.541 1.936 . . . . 3.8199999999999998 112.244 173.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.65 -51.44 69.37 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.468 -0.77 . . . . 4.7300000000000004 109.225 176.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 91.7 p -65.98 -41.01 91.7 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.074 -0.512 . . . . 2.0699999999999998 110.721 -171.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.279 2.4 pp -64.16 -39.46 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 CA-C-O 118.264 -0.874 . . . . 1.26 109.299 174.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.0 -45.92 91.48 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 117.564 -1.655 . . . . 4.8799999999999999 112.469 173.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . 0.266 1.1 t -56.43 -35.27 67.65 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 120.313 1.415 . . . . 1.4199999999999999 110.98 -174.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 20.7 m -77.0 -34.12 21.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 O-C-N 120.684 -1.26 . . . . 1.1599999999999999 112.34 171.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 60.2 t -53.82 -51.22 46.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 120.722 1.601 . . . . 1.27 110.496 169.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.3 t -65.03 -43.19 93.23 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.819 0.736 . . . . 1.21 110.348 -177.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 72.0 m -55.94 -53.47 56.42 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.512 0.596 . . . . 1.1499999999999999 110.28 174.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -47.28 -55.34 8.88 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.975 0.91 . . . . 4.21 109.951 172.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -56.41 -52.89 62.95 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.764 1.626 . . . . 2.5499999999999998 110.819 -173.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.8 t -63.99 -25.2 68.02 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 122.134 -0.354 . . . . 2.5600000000000001 111.42 -175.332 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -80.95 -44.1 18.74 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 119.159 0.89 . . . . 2.9199999999999999 110.921 168.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.52 -32.59 70.44 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.712 1.205 . . . . 1.6399999999999999 110.572 -172.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.72 -20.05 63.08 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 117.315 -1.326 . . . . 4.4299999999999997 113.366 177.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.98 -67.16 0.32 Allowed 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 115.462 1.653 . . . . 2.2799999999999998 115.462 -155.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -91.92 -77.03 0.44 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 119.394 -0.922 . . . . 2.77 113.062 -168.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.18 169.05 31.62 Favored Glycine 0 C--N 1.336 0.575 0 C-N-CA 127.555 2.502 . . . . 2.52 110.604 160.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 48.29 98.54 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.949 1.092 . . . . 4.6299999999999999 113.949 137.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 18.0 pttm -77.9 51.18 0.93 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.318 1.847 . . . . 4.46 112.804 -174.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 19.5 p30 -172.36 -51.17 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.102 1.761 . . . . 3.5600000000000001 108.387 -163.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 53.7 p -74.23 150.06 40.5 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.045 0.538 . . . . 1.79 110.306 170.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 mp -123.71 119.73 30.63 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 123.17 0.588 . . . . 2.8799999999999999 110.044 161.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 50.1 m -90.35 175.63 7.03 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.869 -0.789 . . . . 2.5600000000000001 108.869 170.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 11.0 p -84.03 51.77 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 O-C-N 121.004 -1.06 . . . . 2.6600000000000001 110.709 -175.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -159.93 55.1 0.36 Allowed 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 106.084 -1.821 . . . . 3.0800000000000001 106.084 159.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -178.49 -56.12 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 127.9 2.48 . . . . 1.9399999999999999 104.546 -166.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -60.1 -59.38 5.51 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.604 -0.887 . . . . 3.4500000000000002 108.604 165.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 54.3 tttt -58.18 -35.83 72.17 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 119.903 -0.719 . . . . 2.4700000000000002 111.365 -174.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -49.56 -42.8 45.15 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 119.302 -0.38 . . . . 4.2699999999999996 111.9 172.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 tp -66.42 -49.15 67.73 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.773 -0.825 . . . . 1.9199999999999999 108.773 -172.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . 0.424 ' HA ' HD23 ' B' ' 46' ' ' LEU . 9.4 m -69.09 -38.16 77.79 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.163 0 CA-C-N 116.083 -0.508 . . . . 0.72999999999999998 110.016 -174.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 94.1 m -61.1 -54.86 39.41 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.124 -0.489 . . . . 1.26 110.134 173.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -82.01 -60.35 2.26 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.686 0.794 . . . . 2.0299999999999998 112.884 -167.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -81.23 -38.95 26.12 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 114.276 1.213 . . . . 2.8900000000000001 114.276 -160.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' B' ' 42' ' ' VAL . 1.4 mm? -48.93 -44.3 70.23 Favored Pre-proline 0 CA--C 1.532 0.271 0 N-CA-C 114.922 1.453 . . . . 2.1200000000000001 114.922 -155.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -77.51 -36.13 1.35 Allowed 'Trans proline' 0 N--CA 1.448 -1.177 0 N-CA-C 108.92 -1.223 . . . . 2.4700000000000002 108.92 -44.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -88.79 -35.74 16.47 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 125.231 1.412 . . . . 2.6200000000000001 110.373 -173.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.544 HD23 ' HB2' ' B' ' 83' ' ' LEU . 15.9 tp -42.14 -63.53 0.73 Allowed 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 114.043 1.127 . . . . 1.1899999999999999 114.043 -172.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 35.4 mt -83.39 162.57 21.0 Favored 'General case' 0 C--N 1.338 0.107 0 CA-C-O 121.459 0.647 . . . . 2.04 109.4 175.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' B' ' 86' ' ' GLU . 0.0 OUTLIER -142.44 154.03 44.21 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 124.762 1.225 . . . . 5.5899999999999999 108.002 178.315 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 30.2 t0 66.68 82.11 0.19 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 126.486 1.914 . . . . 3.75 109.461 -164.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 34.7 m -93.93 11.5 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 CA-C-N 113.735 -1.575 . . . . 1.9299999999999999 109.485 162.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.57 -71.17 1.3 Allowed Glycine 0 C--N 1.339 0.738 0 N-CA-C 106.703 -2.559 . . . . 2.5099999999999998 106.703 174.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.33 55.11 2.16 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 123.13 1.443 . . . . 3.0600000000000001 109.652 -179.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.66 -34.33 74.15 Favored 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 124.235 1.014 . . . . 1.1799999999999999 108.774 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -44.69 -46.28 10.23 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.4 1.48 . . . . 4.2400000000000002 112.075 171.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -55.49 -48.54 74.42 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.635 0.652 . . . . 2.6699999999999999 110.215 177.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -59.15 -51.67 69.0 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 107.36 -1.348 . . . . 3.3799999999999999 107.36 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 9.9 tmm? -50.26 -60.57 2.85 Favored 'General case' 0 C--O 1.227 -0.081 0 C-N-CA 124.841 1.256 . . . . 2.8900000000000001 110.233 -174.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt -59.19 -36.85 76.07 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.591 -0.242 . . . . 4.9800000000000004 111.6 -175.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -68.93 -38.2 79.36 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.943 0.897 . . . . 1.7 111.348 178.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 24.0 mt -73.4 -54.26 8.74 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.28 1.032 . . . . 1.53 109.992 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -62.88 -10.2 12.45 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 128.009 2.524 . . . . 2.5299999999999998 116.244 -166.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 21.4 m -33.73 -24.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 119.384 3.105 . . . . 1.6699999999999999 119.384 -134.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -55.17 -27.43 45.66 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 120.894 1.679 . . . . 2.8500000000000001 111.106 165.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 74.35 61.15 0.08 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.557 1.143 . . . . 3.6099999999999999 110.548 164.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 46.8 p30 -117.92 -16.29 9.92 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.053 1.741 . . . . 1.9099999999999999 112.587 -177.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 1.3 t 69.57 21.33 6.74 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.715 1.143 . . . . 2.5800000000000001 112.209 -173.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -122.14 99.7 6.57 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 106.124 -1.806 . . . . 3.1200000000000001 106.124 158.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.41 98.09 1.74 Allowed 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.99 -1.856 . . . . 1.21 105.99 172.089 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -84.65 174.99 9.52 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 118.412 0.551 . . . . 4.6200000000000001 110.484 -179.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -92.45 58.8 3.26 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.306 0.642 . . . . 5.6200000000000001 111.768 -173.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -158.28 51.02 0.41 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 108.008 -1.108 . . . . 2.2999999999999998 108.008 101.248 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -91.04 -62.47 1.44 Allowed 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.043 -1.465 . . . . 2.3199999999999998 107.043 145.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -52.17 -46.98 65.71 Favored 'General case' 0 CA--C 1.512 -0.509 0 C-N-CA 124.595 1.158 . . . . 4.46 111.163 -167.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.634 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 56.2 t90 -45.08 -37.54 4.32 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 114.437 -1.256 . . . . 3.8999999999999999 111.724 -175.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -39.69 -45.19 1.65 Allowed 'General case' 0 C--N 1.344 0.33 0 C-N-CA 124.031 0.933 . . . . 4.1500000000000004 112.483 173.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 17.4 tp -49.59 -45.83 48.44 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.017 0.927 . . . . 1.23 111.551 -178.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 70.3 mt -64.53 -26.18 39.66 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.625 0 N-CA-C 108.052 -1.092 . . . . 1.4299999999999999 108.052 -177.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.528 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -70.14 -45.28 56.9 Favored Glycine 0 CA--C 1.503 -0.691 0 C-N-CA 127.066 2.269 . . . . 1.47 112.44 177.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -68.53 -53.41 23.27 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 106.73 -1.581 . . . . 2.0099999999999998 106.73 -177.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.544 ' HB2' HD23 ' B' ' 49' ' ' LEU 0.254 3.8 pp -58.22 -37.19 74.38 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 119.962 -0.695 . . . . 1.76 111.585 174.614 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.78 -57.91 10.95 Favored 'General case' 0 C--N 1.34 0.155 0 O-C-N 121.119 -0.988 . . . . 1.5 111.655 175.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 4.5 ptpt -63.08 -36.71 84.48 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.407 -0.806 . . . . 1.8999999999999999 110.504 -178.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' B' ' 51' ' ' LYS . 2.2 mm-40 -44.22 -39.26 4.29 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 124.716 1.206 . . . . 4.9000000000000004 111.908 -173.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 5.2 tt -47.1 -45.32 8.4 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 123.118 0.567 . . . . 1.0700000000000001 111.677 178.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -84.34 -50.63 7.65 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.034 0.534 . . . . 5.1299999999999999 111.957 166.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 27.8 mttp . . . . . 0 N--CA 1.452 -0.356 0 O-C-N 121.263 -0.898 . . . . 5.1600000000000001 111.638 -169.816 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 . . . . . 0 N--CA 1.448 -0.537 0 N-CA-C 110.111 -0.329 . . . . 4.5599999999999996 110.111 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.65 107.65 2.36 Favored 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 122.467 2.111 . . . . 2.4399999999999999 109.511 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 77.8 mt -65.47 159.71 23.78 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.554 0.742 . . . . 1.3100000000000001 110.25 175.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.634 HG22 ' CD ' ' A' ' 10' ' ' GLU . 6.1 t -76.85 170.0 17.29 Favored 'General case' 0 N--CA 1.458 -0.037 0 N-CA-C 109.271 -0.64 . . . . 2.1299999999999999 109.271 -179.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -64.49 -42.85 95.62 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 108.477 -0.934 . . . . 2.8599999999999999 108.477 -171.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.8 mp -63.99 -57.52 9.48 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 118.422 -0.799 . . . . 2.0 111.522 176.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.634 ' CD ' HG22 ' A' ' 7' ' ' THR . 67.4 mt-10 -48.61 -52.6 22.21 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.4 1.48 . . . . 2.7599999999999998 109.943 178.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -51.99 -59.62 4.14 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.794 1.238 . . . . 3.1699999999999999 109.527 175.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.0 p -55.38 -43.35 75.06 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.489 -0.757 . . . . 1.6000000000000001 111.771 -175.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.311 2.7 pp -65.37 -44.23 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 CA-C-O 118.687 -0.673 . . . . 0.63 110.57 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -60.57 -48.79 80.22 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.484 1.038 . . . . 3.8700000000000001 110.104 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 m -45.65 -46.26 14.51 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.836 1.654 . . . . 2.0 112.613 175.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 23.7 m -80.46 -33.55 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 O-C-N 120.817 -1.177 . . . . 0.75 111.712 177.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.5 t -57.7 -39.32 69.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 121.467 -0.77 . . . . 0.77000000000000002 110.434 175.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.1 t -64.81 -43.14 94.11 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.975 0.807 . . . . 0.64000000000000001 111.15 175.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.0 m -55.48 -51.55 66.6 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 120.925 -1.109 . . . . 1.1399999999999999 110.161 173.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -48.23 -60.17 2.86 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 109.698 -0.482 . . . . 3.8500000000000001 109.698 173.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -54.16 -53.31 55.2 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.636 0.774 . . . . 3.8900000000000001 111.225 -173.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 22.0 p -57.08 -60.39 3.66 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 122.551 0.341 . . . . 2.3799999999999999 110.451 -178.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -56.15 -40.58 74.06 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-O 121.178 0.513 . . . . 2.6699999999999999 111.231 178.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.2 -26.92 68.35 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 121.093 -1.005 . . . . 0.84999999999999998 110.735 -174.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 52.6 ttp180 -79.62 -19.21 49.78 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 117.724 -1.131 . . . . 6.6399999999999997 112.448 -177.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -41.16 -67.34 0.26 Allowed 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.505 1.048 . . . . 1.9399999999999999 113.623 -173.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -98.43 79.81 2.55 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 104.138 -2.541 . . . . 2.5600000000000001 104.138 178.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 38.86 -155.51 0.02 OUTLIER Glycine 0 CA--C 1.525 0.709 0 C-N-CA 127.01 2.243 . . . . 2.7799999999999998 112.586 -176.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 74.9 mtp85 31.66 87.37 0.01 OUTLIER 'General case' 0 C--O 1.24 0.558 0 C-N-CA 126.681 1.992 . . . . 4.8700000000000001 110.716 165.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . 0.55 ' HD3' ' H ' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -82.21 43.87 0.83 Allowed 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 127.517 2.327 . . . . 4.96 109.025 -168.603 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -155.51 -52.84 0.09 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 105.521 -2.029 . . . . 4.0599999999999996 105.521 -142.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 16.5 p -106.72 136.78 45.93 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 125.732 1.613 . . . . 1.97 109.917 169.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -83.82 130.31 34.93 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 105.98 -1.859 . . . . 1.9099999999999999 105.98 157.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 21.2 t -81.32 177.39 9.02 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.332 1.453 . . . . 2.4700000000000002 107.62 169.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 76.5 t -62.2 -52.1 64.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 121.728 -0.607 . . . . 2.6400000000000001 110.03 -174.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -60.67 -55.74 29.58 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 118.701 -0.666 . . . . 2.1600000000000001 109.62 177.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -39.0 -54.24 1.69 Allowed 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 126.028 1.731 . . . . 1.99 111.968 173.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -57.0 -54.18 49.63 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.434 0.693 . . . . 2.8999999999999999 109.291 177.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 48.4 tttt -56.81 -39.19 73.71 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.258 0.466 . . . . 2.5699999999999998 112.258 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -49.9 -33.07 16.16 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 119.41 1.005 . . . . 3.0 111.882 177.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -63.38 -46.13 87.88 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 108.256 -1.016 . . . . 2.21 108.256 -178.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.4 m -75.77 -38.9 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-N 115.771 -0.65 . . . . 1.3200000000000001 109.913 -174.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 50.0 m -61.45 -44.47 97.05 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.875 0.87 . . . . 1.8300000000000001 111.378 174.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -76.44 -57.88 3.61 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.88 -0.415 . . . . 2.9700000000000002 109.88 -170.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -100.81 -124.65 0.17 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.074 -0.713 . . . . 3.52 109.074 -175.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.4 mp 24.22 64.21 0.41 Allowed Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 127.625 2.37 . . . . 1.99 113.762 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -78.59 -49.49 0.08 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.221 1.947 . . . . 1.77 111.331 -171.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -112.48 -28.68 7.77 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.277 1.431 . . . . 3.3300000000000001 111.335 -173.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.684 HD13 ' HG2' ' B' ' 10' ' ' GLU . 6.5 tp -65.03 -79.52 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.061 1.344 . . . . 1.23 110.997 -171.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.1 mt -78.46 165.34 23.88 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 108.345 -0.983 . . . . 2.7400000000000002 108.345 165.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.74 161.1 9.09 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 105.816 -1.92 . . . . 6.5099999999999998 105.816 -166.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 46.7 t0 60.11 78.27 0.28 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 123.057 1.408 . . . . 5.0099999999999998 108.82 -163.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.1 m -85.3 12.42 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 113.552 -1.658 . . . . 2.6600000000000001 110.089 166.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.97 -66.48 1.66 Allowed Glycine 0 C--N 1.34 0.779 0 N-CA-C 106.444 -2.662 . . . . 2.02 106.444 167.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.3 t -78.23 61.0 2.62 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 122.291 1.043 . . . . 2.5899999999999999 110.841 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -79.77 -39.68 30.42 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 125.471 1.508 . . . . 1.3600000000000001 108.513 169.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -40.7 -53.2 2.84 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.853 1.661 . . . . 4.8799999999999999 112.167 171.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -48.81 -56.61 8.18 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.193 1.397 . . . . 3.02 111.094 174.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.56 -51.94 65.4 Favored 'General case' 0 C--O 1.225 -0.235 0 N-CA-C 108.406 -0.961 . . . . 3.0299999999999998 108.406 177.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -47.75 -52.24 19.3 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 123.941 0.896 . . . . 1.6699999999999999 110.12 -176.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -62.95 -39.4 94.51 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 118.08 0.4 . . . . 2.9300000000000002 111.685 178.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.4 t -60.13 -37.06 78.92 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.934 -0.479 . . . . 1.77 111.567 175.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.6 mp -77.42 -55.56 5.29 Favored 'General case' 0 CA--C 1.528 0.103 0 O-C-N 121.141 -0.975 . . . . 1.9399999999999999 110.93 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -76.45 69.72 2.94 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.076 0.95 . . . . 1.78 110.035 -174.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 20.5 m -49.36 -33.09 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 124.534 1.134 . . . . 1.72 112.827 -176.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -96.44 0.78 50.91 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.196 0.813 . . . . 2.75 113.196 -176.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 44.93 65.49 1.08 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.885 1.674 . . . . 5.1100000000000003 112.541 176.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 30.6 p30 -107.48 -8.34 16.28 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.614 1.166 . . . . 2.0899999999999999 111.089 171.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 44.0 m 61.08 23.82 13.97 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.523 1.129 . . . . 1.5700000000000001 112.438 -171.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -120.39 108.94 14.74 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 106.691 -1.596 . . . . 3.25 106.691 163.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -80.53 89.16 5.64 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 103.686 -2.709 . . . . 1.24 103.686 177.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.8 ttpm? -68.49 161.17 28.35 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.734 1.214 . . . . 3.9100000000000001 108.945 -174.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -37.7 -62.04 0.57 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.403 1.081 . . . . 5.3700000000000001 113.279 -168.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -70.25 -33.33 71.49 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 111.701 0.26 . . . . 1.9199999999999999 111.701 -176.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -61.84 -60.01 4.29 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 108.826 -0.805 . . . . 1.99 108.826 177.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -48.34 -52.92 19.41 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 124.048 0.939 . . . . 2.6200000000000001 109.505 174.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.554 ' CE2' ' CZ2' ' B' ' 77' ' ' TRP . 12.8 t-105 -51.01 -29.38 12.34 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 117.498 -1.239 . . . . 4.8899999999999997 111.435 -178.195 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 36.6 ttt180 -43.75 -43.81 6.27 Favored 'General case' 0 C--N 1.351 0.659 0 CA-C-N 120.471 1.487 . . . . 5.6299999999999999 110.712 171.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.5 tp -44.53 -45.54 9.38 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 122.851 0.46 . . . . 1.0 110.854 178.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . 0.404 ' N ' HD12 ' A' ' 80' ' ' ILE . 1.5 mp -69.51 -32.74 54.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 108.961 -0.755 . . . . 1.9299999999999999 108.961 -175.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.431 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -58.74 -44.84 95.55 Favored Glycine 0 CA--C 1.506 -0.469 0 N-CA-C 110.175 -1.17 . . . . 1.51 110.175 169.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -76.53 -33.61 58.57 Favored 'General case' 0 N--CA 1.438 -1.029 0 N-CA-C 108.653 -0.869 . . . . 2.3500000000000001 108.653 -169.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.414 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 9.1 mp -52.77 -54.71 30.07 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.042 0.837 . . . . 2.25 109.786 161.078 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.36 -26.88 66.94 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.889 0.475 . . . . 1.8500000000000001 111.9 -178.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.409 ' HB2' ' HE3' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -68.63 -61.1 1.97 Allowed 'General case' 0 C--O 1.217 -0.628 0 O-C-N 121.579 -0.701 . . . . 2.29 109.628 162.894 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -53.14 -43.61 67.13 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.634 1.574 . . . . 3.5099999999999998 112.062 -164.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . 0.428 HD12 ' OE2' ' B' ' 10' ' ' GLU . 11.7 tt -53.29 -37.12 27.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-O 121.816 0.817 . . . . 1.6699999999999999 111.366 173.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.08 -63.51 1.27 Allowed 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 126.288 1.835 . . . . 5.5099999999999998 110.167 -171.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 35.6 tttp . . . . . 0 N--CA 1.449 -0.522 0 C-N-CA 126.609 1.964 . . . . 4.3799999999999999 113.585 -162.447 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 13.1 mt . . . . . 0 CA--C 1.544 0.733 0 CA-C-O 118.396 -0.812 . . . . 3.5099999999999998 112.714 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 4.7 t -110.68 -80.83 0.58 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.619 1.34 . . . . 2.5099999999999998 114.619 -161.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -162.58 -72.23 0.05 OUTLIER 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.935 0.894 . . . . 3.25 108.658 -173.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.5 mt -56.41 -50.03 72.79 Favored 'General case' 0 C--N 1.338 0.102 0 N-CA-C 109.215 -0.661 . . . . 1.1799999999999999 109.215 171.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . 0.684 ' HG2' HD13 ' A' ' 49' ' ' LEU . 3.3 tm-20 -43.66 -62.6 1.04 Allowed 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 124.269 1.028 . . . . 4.7199999999999998 111.092 167.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -48.42 -42.61 32.65 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.262 0.553 . . . . 4.0 109.768 -177.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 14.7 m -62.84 -36.92 84.83 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.154 0.981 . . . . 1.54 112.617 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.272 1.9 pp -75.7 -37.39 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 118.913 0.779 . . . . 1.02 111.029 171.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . 0.4 ' HG2' HD11 ' A' ' 87' ' ' ILE . 4.9 tm-20 -57.71 -59.09 5.74 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 118.895 0.77 . . . . 2.3799999999999999 109.602 177.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.4 t -47.32 -44.84 23.9 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.005 0.821 . . . . 1.22 112.097 -174.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.1 m -73.03 -43.83 57.84 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 O-C-N 120.987 -1.071 . . . . 0.82999999999999996 110.843 178.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 37.1 t -53.69 -51.28 45.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 O-C-N 121.405 -0.809 . . . . 1.1699999999999999 110.617 175.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 13.7 t -60.05 -48.91 79.74 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 117.457 -1.258 . . . . 1.48 110.355 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 99.0 m -46.14 -57.67 4.3 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 120.634 1.561 . . . . 1.3100000000000001 109.671 175.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 10.5 m-30 -55.63 -61.28 2.46 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.343 0.497 . . . . 6.7999999999999998 112.343 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -69.49 -33.95 73.62 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 119.165 0.893 . . . . 4.4400000000000004 112.025 -169.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 64.6 p -61.44 -55.53 30.31 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 108.449 -0.945 . . . . 3.5699999999999998 108.449 170.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -55.44 -38.11 68.59 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.046 0.839 . . . . 2.98 112.038 -177.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.32 -19.7 9.44 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 127.417 2.287 . . . . 1.5 112.323 176.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -17.54 10.17 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.609 1.163 . . . . 3.4399999999999999 112.444 170.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.497 ' CB ' ' HG3' ' B' ' 37' ' ' GLU . 0.0 OUTLIER -47.68 -65.62 0.54 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 115.082 1.512 . . . . 1.9399999999999999 115.082 -173.925 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . 0.342 17.4 mt-10 -82.42 -17.65 44.63 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 118.621 2.823 . . . . 3.2200000000000002 118.621 -161.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.21 -107.16 0.58 Allowed Glycine 0 C--N 1.338 0.655 1 C-N-CA 133.601 5.381 . . . . 3.4900000000000002 114.093 -4.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.26 86.6 0.13 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 107.525 -1.287 . . . . 4.6100000000000003 107.525 -175.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 14.6 pttm -81.95 14.47 2.74 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 115.558 1.688 . . . . 3.77 115.558 -157.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 21.5 p-10 -120.11 -49.19 2.3 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 124.131 0.972 . . . . 3.0899999999999999 109.158 171.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 85.1 p -68.63 131.38 45.11 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 123.404 0.682 . . . . 1.9399999999999999 110.458 -179.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.6 mp -94.04 112.34 24.16 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 106.675 -1.602 . . . . 3.0800000000000001 106.675 164.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 42.0 m -81.69 -174.36 4.96 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 128.183 2.593 . . . . 3.3300000000000001 107.775 178.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 75.5 t -68.15 -95.5 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.432 0 N-CA-C 103.575 -2.75 . . . . 3.0299999999999998 103.575 -171.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -72.44 70.12 0.87 Allowed 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 120.659 1.572 . . . . 2.7799999999999998 108.724 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.497 ' HG3' ' CB ' ' B' ' 26' ' ' GLN . 25.8 tt0 -159.0 -56.0 0.06 Allowed 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 131.54 3.936 . . . . 2.5299999999999998 104.282 178.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . 0.405 ' CE2' ' CE2' ' B' ' 76' ' ' TYR . 0.8 OUTLIER -60.19 -51.74 68.31 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.478 -0.934 . . . . 2.3700000000000001 108.478 166.996 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 50.2 tttt -59.42 -32.64 70.37 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 119.285 -0.966 . . . . 2.6499999999999999 111.894 -169.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -55.3 -34.46 64.15 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.705 -0.622 . . . . 3.3100000000000001 112.424 174.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.4 tt -69.73 -45.17 68.76 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.111 0.869 . . . . 1.8899999999999999 109.262 -176.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . 0.428 HG11 HD23 ' B' ' 56' ' ' LEU . 30.4 m -68.12 -36.9 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 N-CA-C 109.447 -0.575 . . . . 0.97999999999999998 109.447 -175.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 99.4 m -62.51 -60.51 3.43 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 122.639 0.376 . . . . 1.1299999999999999 111.268 169.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -82.47 -59.11 2.64 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.759 0.824 . . . . 2.4100000000000001 112.938 -164.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -81.67 -32.75 31.64 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.022 0.929 . . . . 3.2999999999999998 112.34 -165.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . 0.416 HD11 HD21 ' B' ' 83' ' ' LEU . 13.6 tp -82.82 -14.61 0.21 Allowed Pre-proline 0 CA--C 1.545 0.753 0 N-CA-C 118.816 2.895 . . . . 1.51 118.816 -164.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -40.14 -62.95 0.32 Allowed 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 125.277 3.985 . . . . 2.29 117.857 -132.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 12.4 t-160 -88.8 54.0 2.88 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 119.975 1.261 . . . . 3.6099999999999999 110.534 -156.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 14.2 tp -145.57 -107.24 0.1 Allowed 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 123.727 0.811 . . . . 1.8400000000000001 109.981 -166.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 2.4 mp -69.42 92.95 0.63 Allowed 'General case' 0 CA--C 1.531 0.242 0 O-C-N 120.913 -1.117 . . . . 2.1299999999999999 110.483 178.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.01 149.47 0.04 OUTLIER 'General case' 0 C--O 1.237 0.42 0 C-N-CA 125.443 1.497 . . . . 6.0 113.476 174.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 19.4 t0 54.8 41.65 31.75 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 123.205 1.479 . . . . 5.0 107.335 176.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 17.0 m 35.8 45.93 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 C-N-CA 127.739 2.416 . . . . 4.1799999999999997 113.093 -170.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 68.33 8.2 54.47 Favored Glycine 0 CA--C 1.526 0.735 0 C-N-CA 125.414 1.483 . . . . 7.1100000000000003 114.865 177.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . 0.274 0.5 OUTLIER 49.35 66.07 1.22 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 123.493 1.616 . . . . 4.2300000000000004 110.044 -175.525 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . 0.428 HD23 HG11 ' B' ' 42' ' ' VAL . 0.2 OUTLIER -49.32 -26.49 3.14 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.11 1.764 . . . . 2.2599999999999998 114.123 -178.295 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -50.03 -74.33 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.983 0.913 . . . . 4.1500000000000004 112.35 166.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -50.28 -45.35 54.34 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 119.211 0.914 . . . . 2.5800000000000001 109.585 173.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.23 -39.21 85.86 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 118.834 -0.603 . . . . 2.9300000000000002 111.644 -172.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 5.0 ttt -55.3 -45.15 76.28 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 119.4 1.0 . . . . 2.1000000000000001 108.744 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.48 -43.13 98.18 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.112 -0.993 . . . . 4.7300000000000004 111.121 175.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 2.6 m -58.72 -41.67 86.9 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.859 0.754 . . . . 1.73 112.853 176.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 33.3 mt -82.68 -60.13 2.28 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.886 1.674 . . . . 1.3799999999999999 111.457 -172.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.282 4.3 t0 -64.85 -7.21 10.35 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.662 2.385 . . . . 2.48 116.506 -157.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.1 m -36.61 -25.36 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 130.985 3.714 . . . . 2.1600000000000001 117.841 -154.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 35.8 p30 -65.8 -20.69 66.35 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 120.088 1.313 . . . . 3.5099999999999998 112.332 175.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 112.57 -43.72 0.0 OUTLIER 'General case' 0 C--N 1.344 0.354 0 C-N-CA 129.331 3.052 . . . . 4.9299999999999997 111.169 164.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -46.56 117.82 1.76 Allowed 'General case' 0 C--O 1.232 0.183 0 C-N-CA 123.763 0.825 . . . . 3.8700000000000001 109.441 173.085 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 7.8 t -70.04 63.74 0.22 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.515 1.926 . . . . 2.4900000000000002 110.637 -176.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -161.26 118.9 2.32 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 127.769 2.427 . . . . 3.2599999999999998 105.251 -171.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -87.96 110.77 20.82 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.082 -1.081 . . . . 1.6599999999999999 108.082 174.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -82.33 158.76 23.28 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 107.377 -1.342 . . . . 6.6399999999999997 107.377 170.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -86.04 56.89 4.18 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.171 -0.956 . . . . 4.1100000000000003 111.566 169.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . 0.407 ' HB2' ' CD ' ' A' ' 85' ' ' LYS . 1.7 t-20 -152.82 49.3 0.73 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 119.987 -0.685 . . . . 2.52 109.868 111.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -93.28 -61.94 1.47 Allowed 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 127.437 2.295 . . . . 2.5299999999999998 107.678 134.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.405 ' CE2' ' CE2' ' B' ' 38' ' ' PHE . 16.2 t80 -46.23 -40.79 11.97 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 127.584 2.354 . . . . 3.9300000000000002 111.99 -174.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.554 ' CZ2' ' CE2' ' A' ' 77' ' ' TRP . 41.7 t90 -50.91 -35.41 32.93 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 112.668 0.618 . . . . 4.0599999999999996 112.668 -175.348 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -45.18 -33.79 2.44 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 122.893 0.477 . . . . 4.4100000000000001 111.943 174.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 17.7 tp -60.86 -48.12 83.26 Favored 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 124.645 1.178 . . . . 1.1799999999999999 108.89 -175.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . 0.296 5.2 pt -71.78 -18.01 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.376 0 C-N-CA 117.6 -1.64 . . . . 2.96 108.477 -175.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.554 ' HA2' ' CE2' ' A' ' 77' ' ' TRP . . . -67.7 -47.49 61.27 Favored Glycine 0 N--CA 1.443 -0.857 0 C-N-CA 125.108 1.337 . . . . 1.6000000000000001 110.241 172.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -56.66 -63.13 1.3 Allowed 'General case' 0 N--CA 1.44 -0.956 0 CA-C-O 117.089 -1.434 . . . . 3.2200000000000002 107.756 168.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.416 HD21 HD11 ' B' ' 46' ' ' LEU . 8.6 mp -41.76 -56.24 2.74 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 121.0 1.727 . . . . 2.0600000000000001 113.286 -177.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.87 -28.01 63.78 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 125.159 1.383 . . . . 1.24 112.198 -176.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.77 -60.84 2.22 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 118.145 -0.931 . . . . 1.9199999999999999 109.941 164.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -59.3 -24.35 63.22 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.807 0.843 . . . . 2.29 112.465 -158.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 11.4 tt -45.85 -53.09 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 CA-C-N 118.569 0.622 . . . . 1.8799999999999999 111.249 164.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 49.5 ttt85 -85.21 -61.47 1.76 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.407 1.883 . . . . 5.3300000000000001 113.957 171.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 49.8 tttp . . . . . 0 CA--C 1.538 0.484 0 C-N-CA 124.316 1.046 . . . . 4.71 111.749 -166.803 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 N--CA 1.446 -0.64 0 CA-C-O 119.527 -0.273 . . . . 4.9100000000000001 110.777 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.64 110.52 2.91 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 122.888 2.392 . . . . 2.5899999999999999 110.452 -177.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.2 mt -70.58 159.72 33.82 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.141 0.976 . . . . 1.45 109.614 173.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.6 t -72.89 165.74 24.35 Favored 'General case' 0 N--CA 1.464 0.264 0 O-C-N 121.545 -0.722 . . . . 1.72 109.457 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -57.19 -47.12 82.06 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 118.991 0.814 . . . . 4.0700000000000003 109.657 -177.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mp -57.45 -58.39 8.48 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 117.755 -1.117 . . . . 1.71 111.222 178.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -49.25 -56.03 10.72 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.097 1.359 . . . . 2.5600000000000001 110.419 177.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.1 tp10 -52.55 -52.37 55.23 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.922 1.689 . . . . 3.23 110.379 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.2 p -67.05 -45.2 78.14 Favored 'General case' 0 C--O 1.234 0.245 0 O-C-N 121.762 -0.587 . . . . 1.5800000000000001 111.261 -176.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.296 2.9 pp -62.88 -36.55 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 O-C-N 121.421 -0.8 . . . . 0.71999999999999997 109.432 177.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -60.11 -57.83 11.12 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 118.863 0.756 . . . . 2.8399999999999999 109.94 171.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -54.37 -36.33 63.77 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.42 1.009 . . . . 1.47 111.989 -171.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.3 m -73.92 -47.4 43.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 O-C-N 121.467 -0.77 . . . . 0.93000000000000005 110.833 172.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.8 t -50.59 -50.21 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-N 119.309 0.959 . . . . 0.53000000000000003 111.622 177.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.4 t -60.03 -44.28 94.73 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.941 0.791 . . . . 1.1799999999999999 110.479 176.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 63.7 m -52.67 -51.89 58.26 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.641 1.109 . . . . 1.1399999999999999 109.215 174.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -56.6 -55.67 31.03 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 122.995 0.518 . . . . 6.8899999999999997 110.732 178.559 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -68.06 -44.49 76.25 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 125.298 1.439 . . . . 2.8900000000000001 110.646 -166.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 66.4 p -56.17 -57.82 10.56 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.389 -0.967 . . . . 3.4900000000000002 108.389 170.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -52.7 -40.91 63.41 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 122.662 0.385 . . . . 2.9100000000000001 111.959 -178.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.89 -16.83 32.37 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 128.323 2.649 . . . . 1.3100000000000001 112.802 -178.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.5 -28.94 67.49 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 118.24 -0.886 . . . . 3.7999999999999998 111.625 169.012 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -41.92 -62.89 0.82 Allowed 'General case' 0 C--N 1.344 0.348 0 C-N-CA 124.289 1.035 . . . . 1.95 113.055 -167.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 63.5 mt-10 -124.11 177.49 5.79 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 126.193 1.797 . . . . 2.8900000000000001 107.502 -177.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -15.2 125.28 0.01 OUTLIER Glycine 0 CA--C 1.533 1.176 0 C-N-CA 127.852 2.644 . . . . 1.4099999999999999 115.187 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? 64.1 105.53 0.03 OUTLIER 'General case' 0 C--O 1.237 0.43 0 C-N-CA 124.482 1.113 . . . . 4.2000000000000002 112.214 177.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -67.15 60.02 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.856 0.862 . . . . 4.0499999999999998 111.18 166.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -164.37 -64.83 0.04 OUTLIER 'General case' 0 N--CA 1.458 -0.066 0 C-N-CA 125.593 1.557 . . . . 3.71 107.322 -177.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 p -85.52 159.72 19.84 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 125.157 1.383 . . . . 1.8200000000000001 110.836 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -100.12 175.66 5.67 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 107.761 -1.2 . . . . 2.2799999999999998 107.761 172.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.9 t -144.33 179.78 7.03 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 126.781 2.033 . . . . 2.1200000000000001 106.277 177.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 67.7 t -47.81 -64.02 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 123.533 0.733 . . . . 2.1699999999999999 111.467 -175.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -66.57 -50.76 62.05 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 119.163 -0.446 . . . . 1.99 110.267 -176.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -39.01 -50.67 1.8 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.169 0.988 . . . . 2.1899999999999999 113.139 170.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -65.27 -51.63 59.52 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.953 0.901 . . . . 2.7799999999999998 109.169 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 41.6 tttm -56.98 -42.25 79.87 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 120.64 -0.424 . . . . 3.5 110.171 -175.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -50.3 -42.2 52.13 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.49 0.716 . . . . 3.2400000000000002 111.604 174.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 tp -61.47 -48.15 82.43 Favored 'General case' 0 CA--C 1.527 0.076 0 O-C-N 120.663 -1.273 . . . . 2.8599999999999999 109.357 -175.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.5 m -72.75 -45.71 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 CA-C-O 121.681 0.753 . . . . 1.0700000000000001 109.43 -172.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 84.2 m -64.71 -45.37 86.85 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.211 1.004 . . . . 1.1699999999999999 110.035 -177.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -81.18 -60.33 2.32 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.109 0.964 . . . . 2.8300000000000001 110.734 -174.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -111.97 57.11 0.64 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.853 0.861 . . . . 4.6399999999999997 112.478 -175.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 tp -159.1 81.17 2.65 Favored Pre-proline 0 CA--C 1.542 0.647 0 O-C-N 121.057 -1.027 . . . . 1.8400000000000001 109.428 167.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -75.35 -44.41 0.31 Allowed 'Trans proline' 0 N--CA 1.452 -0.943 0 C-N-CA 123.302 2.668 . . . . 2.1400000000000001 112.048 -167.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 35.8 t-80 -109.79 -74.88 0.64 Allowed 'General case' 0 C--N 1.343 0.319 0 CA-C-N 118.499 0.591 . . . . 3.1899999999999999 110.523 176.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.547 HD23 HD22 ' A' ' 83' ' ' LEU . 7.2 tp 8.45 -91.78 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.969 2.508 . . . . 1.47 116.972 -166.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.4 mt -79.67 -27.66 40.79 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.382 1.073 . . . . 3.0600000000000001 111.707 -178.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 42.5 mmtt 53.33 -166.42 0.07 Allowed 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 125.092 1.357 . . . . 8.5399999999999991 110.073 -156.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.413 ' OD2' ' NZ ' ' A' ' 59' ' ' LYS . 15.4 t0 58.7 52.08 7.11 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-O 125.021 2.343 . . . . 3.8500000000000001 109.705 172.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.57 -1.17 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 CA-C-N 111.529 -2.578 . . . . 3.2599999999999998 110.318 163.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.87 -66.37 1.45 Allowed Glycine 0 C--N 1.342 0.888 0 C-N-CA 125.527 1.536 . . . . 1.71 110.747 171.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 t -78.1 68.22 4.09 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.486 1.143 . . . . 1.99 108.964 -176.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -81.29 -36.08 30.26 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 125.118 1.367 . . . . 1.3100000000000001 110.98 -172.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -53.96 -44.04 70.39 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.693 -0.629 . . . . 3.9700000000000002 112.014 -175.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -57.53 -42.64 83.3 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.36 -0.838 . . . . 3.8500000000000001 111.912 174.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.413 ' NZ ' ' OD2' ' A' ' 52' ' ' ASP . 0.2 OUTLIER -61.82 -49.41 76.4 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.217 -0.927 . . . . 3.4100000000000001 109.043 172.383 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 10.3 ttt -49.66 -45.83 49.07 Favored 'General case' 0 C--O 1.22 -0.453 0 N-CA-C 110.055 -0.35 . . . . 2.2599999999999998 110.055 178.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -62.68 -37.69 87.42 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.251 0.62 . . . . 3.3100000000000001 111.224 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.8 t -58.15 -40.69 82.01 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 118.667 0.667 . . . . 2.9100000000000001 110.358 170.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.7 mt -73.94 -78.84 0.09 Allowed 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.671 -0.643 . . . . 2.5899999999999999 111.003 178.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -77.77 67.87 3.73 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.803 2.041 . . . . 2.1400000000000001 110.006 -174.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 15.5 m -57.26 -19.65 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 113.349 0.87 . . . . 3.1499999999999999 113.349 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -92.54 -9.69 40.33 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.898 1.279 . . . . 2.8199999999999998 113.259 176.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 48.81 56.6 7.44 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.644 1.111 . . . . 3.2799999999999998 111.624 -176.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 56.8 p-10 -95.36 -9.87 31.68 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.004 0.522 . . . . 2.25 110.265 170.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.2 m 63.61 20.73 12.39 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.595 1.158 . . . . 1.99 111.912 -173.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.63 111.49 16.28 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 105.346 -2.094 . . . . 3.25 105.346 171.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -84.84 93.64 8.55 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.025 -1.842 . . . . 1.4299999999999999 106.025 173.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.22 155.6 4.79 Favored 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 123.565 0.746 . . . . 4.2300000000000004 109.225 174.087 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -46.27 -55.54 7.05 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 119.099 0.863 . . . . 4.9800000000000004 112.916 -172.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -60.09 -42.34 94.44 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.126 0.965 . . . . 1.77 111.472 176.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -59.89 -42.52 93.98 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.025 1.73 . . . . 2.04 110.066 -176.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -66.73 -52.59 42.64 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 124.956 1.302 . . . . 2.6699999999999999 109.63 172.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.506 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 1.7 t-105 -42.99 -42.95 3.97 Favored 'General case' 0 C--N 1.344 0.365 0 O-C-N 123.735 0.647 . . . . 4.7599999999999998 109.819 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 44.0 mtt180 -37.0 -50.3 0.88 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.302 1.041 . . . . 4.4800000000000004 111.447 -174.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.2 tp -45.36 -48.92 13.32 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 123.611 0.764 . . . . 0.73999999999999999 110.941 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.0 mp -69.02 -34.2 62.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 C-N-CA 124.91 1.284 . . . . 1.8700000000000001 109.055 -173.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.425 ' HA2' ' CD1' ' B' ' 77' ' ' TRP . . . -63.55 -43.97 97.27 Favored Glycine 0 N--CA 1.442 -0.902 0 N-CA-C 110.733 -0.947 . . . . 1.3100000000000001 110.733 172.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -59.89 -49.32 78.16 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 118.796 -0.621 . . . . 3.02 109.692 173.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.547 HD22 HD23 ' A' ' 49' ' ' LEU . 29.3 mt -49.25 -48.42 45.75 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.789 1.177 . . . . 2.4700000000000002 112.448 -179.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.18 -25.92 35.69 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.416 0.686 . . . . 1.22 112.217 177.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -81.25 -58.26 3.13 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.292 1.837 . . . . 2.3500000000000001 109.848 168.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -49.71 -38.89 35.09 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.662 1.585 . . . . 2.54 113.048 -172.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.6 tt -49.42 -37.03 10.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 112.223 0.453 . . . . 1.21 112.223 176.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -98.43 -44.85 6.35 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.961 1.304 . . . . 5.9500000000000002 110.451 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 35.8 tttp . . . . . 0 CA--C 1.535 0.376 0 C-N-CA 126.114 1.766 . . . . 2.8599999999999999 109.792 178.278 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 38.9 mt . . . . . 0 CA--C 1.544 0.717 0 N-CA-C 111.717 0.265 . . . . 2.5299999999999998 111.717 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.5 HG23 ' N ' ' B' ' 8' ' ' GLU . 6.5 t -90.9 -66.6 0.91 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.39 2.276 . . . . 2.6000000000000001 115.07 -173.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.5 ' N ' HG23 ' B' ' 7' ' ' THR . 37.5 tt0 -169.9 -75.66 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.92 0.888 . . . . 2.1800000000000002 108.69 -162.348 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mt -56.83 -45.44 82.35 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 120.828 -1.17 . . . . 1.1299999999999999 109.774 165.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . 0.484 ' HB2' ' H ' ' B' ' 7' ' ' THR . 72.1 mt-10 -50.77 -48.78 59.25 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.932 0.893 . . . . 3.1299999999999999 110.768 170.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -58.18 -45.74 87.0 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.085 -1.009 . . . . 3.6400000000000001 110.791 176.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -60.24 -47.68 84.96 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 124.255 1.022 . . . . 1.7 110.752 -177.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.285 2.9 pp -61.68 -33.21 56.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 120.322 -0.551 . . . . 0.94999999999999996 110.319 174.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.7 -58.97 5.96 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 118.687 0.676 . . . . 2.6400000000000001 111.404 172.351 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 t -51.02 -40.1 57.39 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.386 0.994 . . . . 1.1799999999999999 111.559 -168.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.16 -43.58 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 O-C-N 121.366 -0.834 . . . . 0.93999999999999995 111.802 174.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 37.9 t -54.31 -58.37 3.91 Favored 'Isoleucine or valine' 0 C--N 1.341 0.21 0 CA-C-N 118.572 0.624 . . . . 1.1000000000000001 110.334 174.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 13.8 t -56.23 -47.22 78.88 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 118.667 -0.682 . . . . 1.1699999999999999 110.562 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 98.3 m -58.49 -44.34 89.36 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 119.651 1.114 . . . . 1.3 111.82 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -66.06 -43.82 86.32 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 117.952 -1.499 . . . . 4.1699999999999999 110.131 175.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -57.81 -46.49 84.59 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.119 0.968 . . . . 2.8999999999999999 111.824 -174.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 31.4 p -62.28 -25.43 67.85 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.392 -0.817 . . . . 2.2400000000000002 111.654 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -80.52 -46.17 16.26 Favored 'General case' 0 C--O 1.224 -0.254 0 O-C-N 121.978 -0.451 . . . . 3.4100000000000001 110.491 170.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.03 -25.41 58.57 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 127.787 2.435 . . . . 0.93999999999999995 111.938 -178.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -45.09 -37.37 4.22 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.783 1.233 . . . . 4.4199999999999999 111.021 171.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.463 ' HB2' ' HG2' ' B' ' 37' ' ' GLU . 0.5 OUTLIER -60.93 -70.02 0.2 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 116.708 2.114 . . . . 2.6800000000000002 116.708 -142.032 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -92.53 -74.3 0.52 Allowed 'General case' 0 C--N 1.34 0.185 0 C-N-CA 119.089 -1.044 . . . . 3.5899999999999999 113.463 -166.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.38 152.86 22.95 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 126.384 1.945 . . . . 1.77 109.17 164.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 29.9 ttt180 43.37 100.64 0.0 OUTLIER 'General case' 0 C--O 1.241 0.63 0 C-N-CA 125.158 1.383 . . . . 4.0499999999999998 113.992 146.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 59.9 pttt -61.06 -22.32 64.49 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 114.538 1.31 . . . . 3.4100000000000001 114.538 -168.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -77.59 -25.52 50.0 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.488 0.551 . . . . 4.0899999999999999 112.488 177.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 96.4 p -83.84 141.78 31.09 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 117.88 -1.057 . . . . 2.7000000000000002 110.836 -172.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -93.31 115.34 27.92 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 106.124 -1.806 . . . . 2.0899999999999999 106.124 149.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 9.1 t -99.92 177.67 5.04 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.047 0.539 . . . . 2.1600000000000001 109.671 161.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 11.5 p -85.76 50.81 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 O-C-N 120.724 -1.235 . . . . 2.5499999999999998 111.423 -173.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -159.75 53.28 0.36 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 107.38 -1.341 . . . . 2.54 107.38 147.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.463 ' HG2' ' HB2' ' B' ' 26' ' ' GLN . 73.8 mt-10 -160.48 -55.39 0.05 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 130.08 3.352 . . . . 1.6299999999999999 103.444 -174.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.3 -50.58 73.43 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.401 -1.272 . . . . 2.21 109.643 169.006 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -62.65 -47.59 83.04 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 120.215 -0.594 . . . . 2.8100000000000001 109.546 -171.235 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -39.91 -48.35 2.32 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.233 0.613 . . . . 4.2599999999999998 112.078 167.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.8 tp -58.63 -49.27 78.13 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.906 -0.775 . . . . 1.95 108.906 -172.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . 0.472 ' HA ' HD23 ' B' ' 46' ' ' LEU . 4.6 m -74.25 -54.56 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-N 115.703 -0.68 . . . . 0.64000000000000001 109.933 -173.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 63.5 m -53.03 -46.12 68.3 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.599 1.16 . . . . 0.96999999999999997 110.878 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -80.84 -62.39 1.68 Allowed 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 122.989 0.516 . . . . 1.9099999999999999 111.156 -173.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -84.28 -42.28 16.0 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 115.633 1.716 . . . . 3.4700000000000002 115.633 -163.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' B' ' 42' ' ' VAL . 0.6 OUTLIER -44.31 -46.2 23.15 Favored Pre-proline 0 N--CA 1.474 0.736 0 N-CA-C 115.576 1.695 . . . . 1.97 115.576 -155.282 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -77.74 -29.45 4.48 Favored 'Trans proline' 0 N--CA 1.449 -1.13 0 CA-C-N 120.827 1.331 . . . . 2.3100000000000001 109.477 -42.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 19.6 t60 -89.02 -49.69 6.62 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 125.224 1.41 . . . . 2.4900000000000002 110.844 -168.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.473 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 6.3 tp -34.24 -60.27 0.41 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.853 2.061 . . . . 1.2 113.852 -171.042 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 54.9 mt -96.16 111.82 23.74 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 108.239 -1.023 . . . . 1.46 108.239 172.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -64.49 154.46 35.82 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 120.237 -0.585 . . . . 5.5199999999999996 109.582 165.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 17.0 t0 61.17 82.94 0.16 Allowed 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.425 1.49 . . . . 4.5999999999999996 109.684 -168.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 29.5 m -96.78 21.94 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.786 0 CA-C-N 113.542 -1.663 . . . . 2.8999999999999999 109.601 166.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -110.79 -65.93 0.53 Allowed Glycine 0 C--N 1.343 0.954 0 N-CA-C 109.605 -1.398 . . . . 3.6699999999999999 109.605 -174.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -81.67 46.3 0.96 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.131 0.972 . . . . 4.4900000000000002 109.803 -179.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -55.09 -42.28 72.67 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.189 0.996 . . . . 2.0499999999999998 109.519 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -25.78 -51.26 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.348 1.859 . . . . 4.3700000000000001 113.69 164.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -52.88 -56.51 15.32 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.986 0.812 . . . . 3.2799999999999998 111.448 174.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -53.79 51.65 Favored 'General case' 0 C--O 1.224 -0.262 0 N-CA-C 108.236 -1.024 . . . . 4.6100000000000003 108.236 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -50.67 -53.21 32.98 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 125.386 1.474 . . . . 3.0600000000000001 111.015 -178.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -61.07 -30.8 70.55 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.366 0.666 . . . . 3.9399999999999999 111.235 -178.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.2 t -71.82 -55.22 7.98 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 109.831 -0.433 . . . . 2.6299999999999999 109.831 173.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 33.6 mt -51.9 -44.13 63.64 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.599 1.56 . . . . 1.51 111.446 -179.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.271 22.9 t0 -50.23 -8.7 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 118.105 2.631 . . . . 1.8799999999999999 118.105 -173.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 23.3 m -32.92 -20.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.755 1 C-N-CA 132.074 4.15 . . . . 2.2400000000000002 119.14 -133.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -50.02 -39.81 42.66 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 119.792 1.178 . . . . 2.46 109.544 156.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 62.3 63.43 1.05 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.633 1.573 . . . . 3.02 109.021 -171.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -116.93 -8.57 11.27 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.333 2.253 . . . . 2.7000000000000002 112.754 -175.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 2.1 t 92.19 -7.42 0.2 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.068 2.147 . . . . 3.5299999999999998 113.239 178.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -129.65 119.56 23.75 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 119.207 0.912 . . . . 4.4199999999999999 110.736 -175.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.59 105.72 14.74 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 107.634 -1.247 . . . . 1.3999999999999999 107.634 176.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -84.0 175.06 9.81 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.852 1.661 . . . . 3.5499999999999998 110.971 -175.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -81.61 56.7 3.08 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.668 0.787 . . . . 4.4699999999999998 110.643 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -168.83 45.89 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.855 0.836 . . . . 2.6699999999999999 110.178 110.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -90.73 -61.36 1.69 Allowed 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 127.006 2.122 . . . . 2.21 107.779 153.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -50.87 -38.17 47.79 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 114.648 -1.16 . . . . 3.9199999999999999 111.224 -170.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.464 ' C ' ' CD1' ' B' ' 77' ' ' TRP . 5.1 t90 -38.86 -48.17 1.51 Allowed 'General case' 0 CA--C 1.541 0.604 0 O-C-N 124.562 1.164 . . . . 4.6200000000000001 109.906 177.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 14.1 mmt-85 -42.02 -39.12 1.82 Allowed 'General case' 0 C--O 1.223 -0.311 0 CA-C-O 118.317 -0.849 . . . . 6.3899999999999997 112.959 -176.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.45 ' O ' HD13 ' B' ' 83' ' ' LEU . 6.5 tp -55.5 -47.68 75.81 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.091 1.314 . . . . 0.84999999999999998 111.732 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 1.4 mt -69.93 -34.88 62.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 O-C-N 120.92 -1.113 . . . . 1.75 108.701 178.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -41.32 -52.31 4.32 Favored Glycine 0 C--N 1.345 1.029 0 C-N-CA 126.075 1.798 . . . . 1.76 110.216 168.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -76.67 -60.31 2.4 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 112.031 -2.085 . . . . 2.71 108.842 -175.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.473 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 6.5 mp -37.44 -58.46 0.85 Allowed 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 120.767 1.621 . . . . 2.1299999999999999 112.688 -172.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.91 -28.62 69.65 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.347 1.059 . . . . 1.6100000000000001 112.67 -176.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -80.32 -51.79 8.47 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.668 0.787 . . . . 1.8 110.092 172.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -51.48 -44.47 62.48 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.292 1.037 . . . . 3.52 112.028 -176.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 8.9 tt -52.92 -38.59 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 118.926 0.785 . . . . 1.2 111.722 175.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.75 -30.75 26.42 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.827 1.651 . . . . 3.54 113.892 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 53.2 tttp . . . . . 0 CA--C 1.536 0.43 0 C-N-CA 125.785 1.634 . . . . 4.79 111.936 -163.469 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 . . . . . 0 N--CA 1.442 -0.869 0 CA-C-O 118.316 -0.849 . . . . 5.3899999999999997 109.117 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -70.04 140.77 42.43 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 121.96 1.773 . . . . 2.2599999999999998 108.769 175.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.0 mt -99.3 176.03 5.67 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.394 -0.965 . . . . 1.3899999999999999 108.394 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.412 HG22 ' CG ' ' A' ' 10' ' ' GLU . 2.5 t -70.47 162.74 28.19 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 120.952 -1.092 . . . . 1.78 109.749 178.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -56.44 -50.19 72.4 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.649 0.738 . . . . 2.02 110.474 -170.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.6 mt -60.74 -46.55 90.0 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 117.251 -1.357 . . . . 1.49 111.945 176.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.412 ' CG ' HG22 ' A' ' 7' ' ' THR . 71.0 mt-10 -49.65 -55.13 14.83 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 120.656 1.571 . . . . 2.2400000000000002 112.171 172.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -50.55 -52.53 38.0 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.663 0.744 . . . . 4.04 109.299 176.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.4 t -57.6 -50.86 71.75 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.285 -0.87 . . . . 1.6399999999999999 111.441 -176.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.451 HG21 HD12 ' B' ' 83' ' ' LEU . 2.2 pp -66.37 -39.05 83.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 CA-C-O 118.169 -0.92 . . . . 0.69999999999999996 111.07 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -58.89 -55.61 32.85 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 119.619 1.1 . . . . 2.98 109.93 178.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 15.0 t -54.13 -38.84 65.9 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.625 0.648 . . . . 1.29 112.456 -174.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 m -75.03 -40.54 45.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 O-C-N 120.714 -1.241 . . . . 0.64000000000000001 111.148 175.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.2 t -57.83 -49.54 80.65 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 CA-C-N 119.196 0.907 . . . . 0.56999999999999995 110.461 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.2 t -60.12 -44.94 94.5 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.828 0.74 . . . . 0.76000000000000001 110.538 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 62.0 m -58.02 -56.47 21.56 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.759 -0.588 . . . . 0.78000000000000003 110.192 177.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -43.63 -56.3 3.81 Favored 'General case' 0 N--CA 1.458 -0.065 0 C-N-CA 125.009 1.324 . . . . 3.1800000000000002 110.299 172.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -58.1 -52.86 63.77 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.076 0.95 . . . . 2.8100000000000001 110.261 -174.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.5 t -65.15 -33.22 75.51 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.195 -0.602 . . . . 2.1699999999999999 111.538 -177.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -61.47 -50.94 70.72 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.842 0.746 . . . . 2.6899999999999999 110.473 168.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.01 -19.68 63.11 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.712 1.605 . . . . 0.87 112.26 -175.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.68 -18.96 58.24 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.557 1.543 . . . . 3.8199999999999998 112.054 176.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.71 -69.39 0.13 Allowed 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.953 0.797 . . . . 2.6800000000000002 112.171 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -111.26 171.25 7.59 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 125.73 1.612 . . . . 2.6099999999999999 107.082 -172.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -20.75 131.57 0.01 OUTLIER Glycine 0 CA--C 1.53 1.019 0 C-N-CA 127.338 2.399 . . . . 1.5800000000000001 114.333 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.3 mmm-85 64.92 103.25 0.04 OUTLIER 'General case' 0 C--O 1.237 0.438 0 C-N-CA 124.699 1.2 . . . . 6.6600000000000001 111.502 178.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.9 pttm -73.21 56.2 0.46 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.85 0.86 . . . . 3.5899999999999999 111.439 173.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -163.38 -54.62 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.309 1.443 . . . . 3.6400000000000001 108.229 -176.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 97.8 p -83.91 150.29 25.79 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-O 121.213 0.53 . . . . 1.8 111.295 175.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -96.51 126.27 41.58 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 107.611 -1.255 . . . . 1.8200000000000001 107.611 168.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 t -83.37 177.42 8.5 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 109.554 -0.536 . . . . 2.3199999999999998 109.554 164.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.7 p -61.42 -49.62 83.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 O-C-N 121.963 -0.46 . . . . 2.0800000000000001 111.517 -171.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -63.49 -54.2 40.05 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 108.333 -0.988 . . . . 2.3199999999999998 108.333 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -36.97 -51.83 0.93 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 125.238 1.415 . . . . 1.9299999999999999 111.53 172.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -61.87 -53.97 48.54 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.511 -0.768 . . . . 2.3399999999999999 110.791 177.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.6 ttmm -56.32 -41.8 76.61 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.944 -0.472 . . . . 2.5099999999999998 110.219 -176.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -55.41 -36.31 66.31 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 122.768 0.427 . . . . 3.2999999999999998 111.145 178.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.1 tt -68.17 -48.26 65.8 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 119.403 1.001 . . . . 2.5 109.737 -178.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.1 m -67.15 -39.94 84.18 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 N-CA-C 109.507 -0.553 . . . . 0.92000000000000004 109.507 -176.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 95.0 m -63.37 -52.94 59.62 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 124.011 0.924 . . . . 1.1599999999999999 110.69 176.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -78.34 -54.78 5.82 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.505 0.722 . . . . 2.04 111.257 -167.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -120.32 43.11 2.8 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.498 0.719 . . . . 3.5699999999999998 111.045 -163.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 tp -153.18 61.07 3.48 Favored Pre-proline 0 CA--C 1.542 0.671 0 O-C-N 121.885 -0.509 . . . . 1.5700000000000001 111.013 177.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -66.72 -43.82 6.77 Favored 'Trans proline' 0 N--CA 1.453 -0.858 0 C-N-CA 124.169 3.246 . . . . 2.02 115.385 -165.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -132.27 26.98 4.49 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 120.008 1.276 . . . . 3.46 112.281 -166.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.419 HD23 HD22 ' A' ' 83' ' ' LEU . 11.5 tp -99.93 -75.99 0.56 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 122.566 0.347 . . . . 1.5800000000000001 110.796 -168.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.0 mp -91.74 -175.94 4.31 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.639 1.175 . . . . 3.0 108.604 166.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -134.74 -160.76 1.08 Allowed 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 106.93 -1.507 . . . . 5.7300000000000004 106.93 159.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 69.15 26.94 5.38 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.639 1.575 . . . . 3.7799999999999998 111.291 171.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -68.38 -8.97 10.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.939 1.295 . . . . 2.02 112.962 -174.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.65 -64.28 4.24 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 108.792 -1.723 . . . . 1.78 108.792 166.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.89 53.65 0.12 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 129.191 2.996 . . . . 2.52 111.646 178.384 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -74.31 -26.36 60.12 Favored 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 124.985 1.314 . . . . 1.3600000000000001 109.33 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -54.14 -46.36 72.22 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.663 1.185 . . . . 4.2300000000000004 111.224 176.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -50.12 -54.85 17.78 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.788 0.804 . . . . 2.8700000000000001 109.7 174.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.02 -47.93 83.44 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.412 -0.813 . . . . 4.9100000000000001 109.966 -177.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 7.4 tmm? -51.12 -58.42 6.16 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.965 1.306 . . . . 2.04 109.455 176.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.9 mttt -52.83 -44.18 66.51 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.422 1.089 . . . . 3.3399999999999999 110.983 178.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.1 m -65.68 -38.99 90.8 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.173 0.589 . . . . 2.21 111.839 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 34.8 mt -77.9 -47.09 19.53 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.501 1.12 . . . . 1.72 111.708 -175.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -72.47 91.46 1.38 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 123.455 0.702 . . . . 2.3399999999999999 110.194 -170.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.2 m -55.38 -37.55 45.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 C-N-CA 122.796 0.438 . . . . 2.3900000000000001 112.143 -167.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -97.26 -0.88 45.9 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.762 0.653 . . . . 2.1899999999999999 112.762 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 46.21 48.74 13.02 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.489 1.515 . . . . 4.5300000000000002 111.806 -178.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.4 p30 -90.84 -12.62 35.76 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.207 1.003 . . . . 1.78 110.685 168.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 35.4 p 70.47 7.05 6.07 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 127.52 2.328 . . . . 1.97 114.074 -176.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -95.06 112.82 24.48 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 104.741 -2.318 . . . . 2.9300000000000002 104.741 160.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -80.74 96.67 7.01 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 103.766 -2.679 . . . . 1.01 103.766 171.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.15 158.32 2.27 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.481 -0.933 . . . . 3.8999999999999999 108.481 171.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.1 p90 -38.94 -52.41 1.78 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.879 1.271 . . . . 6.0099999999999998 111.915 -179.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -70.36 -35.17 73.39 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.181 0.592 . . . . 1.6299999999999999 112.494 -179.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -65.13 -51.73 59.52 Favored 'General case' 0 C--O 1.227 -0.129 0 O-C-N 121.643 -0.661 . . . . 2.1499999999999999 109.257 176.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -56.1 -49.86 72.68 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.788 0.435 . . . . 2.9900000000000002 110.058 178.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 0.7 OUTLIER -40.02 -44.0 1.66 Allowed 'General case' 0 CA--C 1.535 0.402 0 O-C-N 124.164 0.915 . . . . 4.2400000000000002 110.691 179.169 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -42.58 -40.49 2.7 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 114.176 1.176 . . . . 3.7400000000000002 114.176 178.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 60.4 tp -46.19 -51.23 14.59 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 119.252 0.933 . . . . 0.91000000000000003 111.107 175.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 78.1 mt -57.38 -28.94 31.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 124.656 1.182 . . . . 1.4299999999999999 107.824 -175.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.524 ' HA3' ' CE2' ' B' ' 77' ' ' TRP . . . -76.99 -48.89 8.03 Favored Glycine 0 N--CA 1.44 -1.071 0 N-CA-C 109.607 -1.397 . . . . 1.1499999999999999 109.607 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -48.61 -52.61 22.16 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-O 117.752 -1.118 . . . . 4.1399999999999997 108.291 169.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.419 HD22 HD23 ' A' ' 49' ' ' LEU . 11.6 mt -49.48 -52.78 26.98 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 120.077 1.308 . . . . 2.4700000000000002 111.712 178.599 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.4 -21.32 24.3 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.9 0.88 . . . . 1.22 112.386 176.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.62 -61.5 1.95 Allowed 'General case' 0 C--O 1.221 -0.437 0 CA-C-O 117.434 -1.27 . . . . 2.27 112.956 162.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -54.91 -33.83 62.5 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 125.834 1.654 . . . . 2.9300000000000002 112.119 -166.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.7 tp -38.39 -44.3 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 124.808 1.243 . . . . 1.3400000000000001 111.465 167.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 51.4 mtt85 -104.67 -58.47 1.88 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 127.044 2.138 . . . . 7.6200000000000001 110.665 178.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 3.3 ttpm? . . . . . 0 CA--C 1.543 0.695 0 C-N-CA 125.717 1.607 . . . . 3.4900000000000002 112.784 -175.075 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.0 mt . . . . . 0 CA--C 1.53 0.205 0 N-CA-C 108.68 -0.859 . . . . 2.6499999999999999 108.68 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.456 HG23 ' N ' ' B' ' 8' ' ' GLU . 6.4 t -69.15 -65.59 0.69 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.062 0.764 . . . . 2.5299999999999998 113.062 -174.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.456 ' N ' HG23 ' B' ' 7' ' ' THR . 43.9 tt0 -168.82 -75.97 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 108.78 -0.822 . . . . 1.96 108.78 -162.318 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 mt -57.3 -45.29 84.32 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 120.98 -1.075 . . . . 1.01 109.366 167.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -56.06 -39.11 71.54 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.867 1.267 . . . . 3.46 110.52 174.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -50.89 28.05 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 108.852 -0.795 . . . . 4.46 108.852 -176.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 5.4 p -61.3 -35.48 77.45 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.445 -0.798 . . . . 1.51 110.747 -172.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . 0.493 ' O ' HG23 ' B' ' 17' ' ' VAL 0.332 2.9 pp -62.38 -42.41 95.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-O 118.395 -0.812 . . . . 1.0700000000000001 111.311 173.901 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -67.2 -42.94 83.29 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-N 120.763 1.62 . . . . 3.75 110.419 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 16.9 m -43.77 -47.68 8.01 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 119.261 0.937 . . . . 2.4100000000000001 112.304 175.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 35.2 m -74.02 -37.16 46.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 O-C-N 120.777 -1.202 . . . . 1.0 111.431 177.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . 0.493 HG23 ' O ' ' B' ' 13' ' ' ILE . 95.6 t -54.85 -49.68 67.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 119.308 0.958 . . . . 1.22 110.242 173.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -64.24 -39.26 93.59 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.494 -0.754 . . . . 1.24 110.656 179.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 34.6 m -58.9 -38.72 79.54 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.78 0.718 . . . . 1.5700000000000001 111.076 174.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . 0.45 ' CE1' ' HB2' ' B' ' 24' ' ' ALA . 0.0 OUTLIER -60.28 -52.57 64.7 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.183 -0.948 . . . . 4.3899999999999997 109.165 169.325 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -55.01 -41.04 70.79 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.499 0.72 . . . . 3.0299999999999998 112.672 -172.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 16.6 p -57.93 -30.26 65.8 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 118.722 -0.656 . . . . 2.9500000000000002 112.197 177.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -82.07 -34.62 29.3 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 119.376 0.989 . . . . 2.8300000000000001 112.514 167.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . 0.45 ' HB2' ' CE1' ' B' ' 20' ' ' PHE . . . -51.05 -44.6 61.13 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 124.167 0.987 . . . . 1.1499999999999999 109.949 -174.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -51.49 -38.55 54.5 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 124.545 1.153 . . . . 3.3399999999999999 112.96 178.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.47 -69.17 0.14 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 116.89 2.181 . . . . 1.79 116.89 -136.574 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -93.15 -76.91 0.46 Allowed 'General case' 0 C--N 1.341 0.204 0 CA-C-O 122.216 1.008 . . . . 3.73 113.652 -173.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.06 153.53 22.37 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 127.593 2.521 . . . . 2.21 109.767 167.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.6 ttt85 45.06 101.63 0.0 OUTLIER 'General case' 0 C--O 1.245 0.824 0 C-N-CA 125.706 1.602 . . . . 4.0899999999999999 114.028 153.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 58.7 pttt -73.09 59.6 0.53 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.712 1.205 . . . . 3.9700000000000002 112.113 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -160.98 -61.19 0.06 Allowed 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.173 1.389 . . . . 3.71 108.501 -168.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 55.2 p -97.44 158.71 15.33 Favored 'General case' 0 C--O 1.245 0.842 0 C-N-CA 123.418 0.687 . . . . 1.96 109.648 -173.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 62.6 mt -107.91 157.06 18.51 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 124.491 1.12 . . . . 2.5800000000000001 109.187 164.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 7.9 t -152.26 178.62 9.31 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 106.684 -1.599 . . . . 3.6800000000000002 106.684 167.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 3.2 t -83.85 56.84 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 118.743 0.701 . . . . 2.7999999999999998 112.008 -161.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -156.5 56.4 0.56 Allowed 'General case' 0 C--O 1.225 -0.211 0 N-CA-C 106.782 -1.562 . . . . 2.25 106.782 141.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -173.87 -52.09 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 125.842 1.657 . . . . 1.74 106.703 -166.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -61.6 -53.06 61.34 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.461 -0.79 . . . . 2.1699999999999999 108.968 168.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 38.4 tttt -57.93 -37.06 73.42 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.57 -0.286 . . . . 2.7999999999999998 111.08 -174.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -47.35 -36.86 10.09 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.806 0.669 . . . . 3.4900000000000002 112.806 173.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 6.6 tt -66.45 -51.28 58.56 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 107.799 -1.185 . . . . 2.48 107.799 -175.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 14.3 m -67.4 -46.14 84.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 109.802 -0.444 . . . . 0.71999999999999997 109.802 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 99.0 m -55.73 -50.73 69.57 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 123.93 0.892 . . . . 0.85999999999999999 111.517 176.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -76.1 -61.62 1.88 Allowed 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 118.302 0.501 . . . . 3.2799999999999998 111.111 -174.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 40.4 mm-40 -81.36 -46.44 14.66 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 112.833 0.679 . . . . 3.4199999999999999 112.833 -157.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -57.77 -36.71 48.17 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 122.874 0.469 . . . . 2.0899999999999999 111.893 -162.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -45.1 -57.25 2.19 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 119.767 -3.014 . . . . 1.7 108.871 -83.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -55.13 -42.74 73.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 125.251 1.42 . . . . 2.2599999999999998 112.55 -175.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 35.7 tp -52.09 -47.4 65.24 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 120.951 0.405 . . . . 0.95999999999999996 110.69 -169.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 92.6 mt -114.96 69.58 0.72 Allowed 'General case' 0 C--O 1.228 -0.067 0 C-N-CA 125.341 1.456 . . . . 1.6399999999999999 109.067 163.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.94 8.59 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 115.752 1.76 . . . . 4.9699999999999998 115.752 178.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -105.05 89.82 3.25 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 104.733 -2.321 . . . . 3.3300000000000001 104.733 163.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 19.7 m -93.52 14.81 2.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 114.991 -1.004 . . . . 1.6599999999999999 108.944 166.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -83.36 -73.49 1.24 Allowed Glycine 0 N--CA 1.443 -0.892 0 N-CA-C 107.345 -2.302 . . . . 2.3199999999999998 107.345 176.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 55.6 m -80.06 54.33 1.9 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.516 1.127 . . . . 2.6400000000000001 112.076 -169.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.09 -40.89 87.01 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 124.811 1.245 . . . . 1.1599999999999999 109.143 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -29.43 -66.52 0.09 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 127.164 2.186 . . . . 4.25 114.208 165.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -47.66 -53.11 15.87 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.854 0.835 . . . . 2.8599999999999999 110.007 177.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -38.28 78.19 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-O 118.427 -0.796 . . . . 4.3499999999999996 111.12 178.714 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.7 ttp -60.59 -45.64 93.22 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 119.881 1.218 . . . . 2.9900000000000002 109.843 178.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -61.71 -42.81 99.44 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 120.56 -0.456 . . . . 4.2599999999999998 110.278 174.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 11.4 m -62.67 -30.47 71.41 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 122.86 0.464 . . . . 1.7 112.029 176.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.566 HD23 ' HB2' ' B' ' 78' ' ' ARG . 8.4 mt -76.45 -59.52 2.73 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.928 1.691 . . . . 1.22 109.627 -178.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . 0.419 ' HA ' ' HG2' ' B' ' 75' ' ' GLU 0.344 2.7 t70 -57.18 -14.42 4.11 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 116.571 2.063 . . . . 2.9199999999999999 116.571 -159.233 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 28.8 m -34.61 -19.92 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 130.635 3.574 . . . . 2.6899999999999999 118.951 -132.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -48.98 -42.78 38.87 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 120.531 1.514 . . . . 3.9100000000000001 110.092 151.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 70.98 55.01 0.23 Allowed 'General case' 0 C--N 1.34 0.189 0 CA-C-O 122.14 0.971 . . . . 4.1799999999999997 109.23 168.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 16.7 p30 -87.15 -133.21 0.07 Allowed 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 104.636 -2.357 . . . . 4.1699999999999999 104.636 158.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 61.8 m -146.14 29.11 1.09 Allowed 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.123 -1.611 . . . . 3.0 110.945 165.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -129.94 110.78 11.95 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 127.49 2.316 . . . . 6.2800000000000002 105.646 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.24 108.39 7.0 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 104.421 -2.437 . . . . 1.27 104.421 177.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.12 175.11 6.9 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.257 1.423 . . . . 3.6600000000000001 108.947 -178.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 18.9 p90 -86.9 53.05 2.69 Favored 'General case' 0 C--O 1.224 -0.281 0 O-C-N 120.434 -1.417 . . . . 5.3499999999999996 113.793 -169.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.57 51.64 0.45 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 105.325 -2.102 . . . . 2.4100000000000001 105.325 127.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . 0.419 ' HG2' ' HA ' ' B' ' 64' ' ' ASP . 0.7 OUTLIER -89.2 -63.94 1.22 Allowed 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.776 -0.824 . . . . 2.8199999999999998 108.776 152.624 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.406 ' CE2' ' CE1' ' B' ' 20' ' ' PHE . 0.0 OUTLIER -53.55 -35.79 61.13 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.684 0.394 . . . . 7.8700000000000001 110.865 -170.32 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 67.3 t-105 -38.62 -51.72 1.64 Allowed 'General case' 0 N--CA 1.439 -1.018 0 O-C-N 124.646 1.216 . . . . 4.5800000000000001 110.744 173.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . 0.566 ' HB2' HD23 ' B' ' 63' ' ' LEU . 11.0 mmm180 -45.99 -48.09 16.64 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.623 -0.673 . . . . 4.2000000000000002 111.429 177.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.419 ' HB2' HD21 ' B' ' 63' ' ' LEU . 6.7 tp -58.03 -41.28 82.86 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.197 0.599 . . . . 0.87 111.104 -179.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 55.9 mt -64.8 -35.46 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.006 0 N-CA-C 105.945 -1.872 . . . . 1.3899999999999999 105.945 -176.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.575 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -66.09 -48.2 67.11 Favored Glycine 0 CA--C 1.494 -1.224 0 N-CA-C 110.209 -1.156 . . . . 1.47 110.209 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -62.44 -61.48 2.42 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-O 117.89 -1.053 . . . . 2.3100000000000001 108.213 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.451 HD12 HG21 ' A' ' 13' ' ' ILE 0.262 3.8 pp -53.98 -36.22 62.68 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.949 1.25 . . . . 1.8200000000000001 112.573 -178.408 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.41 -61.68 2.37 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 119.183 0.901 . . . . 1.71 110.804 170.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 18.3 ttpp -52.92 -41.16 64.16 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.356 1.863 . . . . 1.5600000000000001 111.594 -175.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -51.08 -33.73 27.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 127.47 2.308 . . . . 3.75 111.463 178.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 7.1 tt -52.7 -40.43 34.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 118.607 0.639 . . . . 1.05 110.226 -176.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -84.85 -61.09 1.86 Allowed 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 121.431 0.634 . . . . 6.0999999999999996 110.84 164.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 33.5 mttp . . . . . 0 CA--C 1.53 0.186 0 C-N-CA 124.047 0.939 . . . . 5.7699999999999996 111.486 -168.643 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 . . . . . 0 CA--C 1.538 0.481 0 N-CA-C 108.885 -0.784 . . . . 5.5700000000000003 108.885 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -76.49 158.19 36.38 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.746 2.297 . . . . 2.5600000000000001 110.323 -178.424 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 72.3 mt -128.57 166.72 18.3 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.179 1.391 . . . . 1.72 107.925 179.329 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.506 HG23 ' H ' ' A' ' 10' ' ' GLU . 7.3 t -72.95 174.48 7.75 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 118.588 0.631 . . . . 2.1299999999999999 110.163 -179.747 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -68.18 -43.76 77.42 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 122.535 1.159 . . . . 2.7400000000000002 109.211 -177.25 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.8 mp -61.1 -41.57 96.91 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.361 -0.836 . . . . 2.1600000000000001 109.962 178.571 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.506 ' H ' HG23 ' A' ' 7' ' ' THR . 78.1 mt-10 -62.53 -49.12 76.58 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.475 1.11 . . . . 2.52 111.299 175.241 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.72 -52.83 63.82 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 108.359 -0.978 . . . . 5.3099999999999996 108.359 -179.816 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.4 p -61.68 -40.62 95.6 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.575 -0.284 . . . . 1.4099999999999999 110.913 -170.317 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.28 2.8 pp -67.1 -39.66 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 O-C-N 121.78 -0.575 . . . . 0.60999999999999999 110.209 177.974 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -60.89 -51.65 68.4 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.867 0.758 . . . . 3.6899999999999999 110.018 174.513 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.5 m -44.09 -47.4 8.89 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.697 1.999 . . . . 2.1200000000000001 112.354 175.625 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 30.4 m -76.33 -35.03 26.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 O-C-N 120.348 -1.47 . . . . 0.65000000000000002 111.568 177.695 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.6 t -59.97 -42.79 90.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 119.484 1.038 . . . . 0.72999999999999998 111.148 174.562 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.2 t -61.64 -49.07 78.02 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 120.812 -1.18 . . . . 0.70999999999999996 109.532 175.201 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.1 m -52.51 -43.4 65.07 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 118.473 0.578 . . . . 0.68999999999999995 110.613 176.269 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.482 ' HA ' ' CZ ' ' A' ' 23' ' ' PHE . 41.5 t80 -48.43 -57.08 6.61 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 123.683 0.793 . . . . 3.3700000000000001 110.548 174.767 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -59.56 -41.78 90.93 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 119.724 -0.79 . . . . 3.3900000000000001 111.388 177.468 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.9 m -53.33 -43.86 67.97 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.576 0.584 . . . . 2.6099999999999999 112.576 177.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . 0.482 ' CZ ' ' HA ' ' A' ' 20' ' ' PHE . 22.8 p90 -81.58 -43.49 18.59 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 119.324 0.965 . . . . 6.6200000000000001 113.201 176.158 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.16 -20.73 65.66 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 125.806 1.642 . . . . 1.27 112.16 -169.617 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -17.86 64.45 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 117.571 -1.205 . . . . 4.9199999999999999 113.622 172.571 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -50.99 -58.18 6.71 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.925 1.239 . . . . 2.7599999999999998 112.512 -172.308 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -121.6 171.12 9.06 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.286 1.834 . . . . 2.54 107.285 -179.371 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -1.59 106.57 0.01 OUTLIER Glycine 0 CA--C 1.53 0.995 0 C-N-CA 127.443 2.449 . . . . 1.6499999999999999 114.268 170.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . 0.278 30.5 mtt85 66.11 109.45 0.04 OUTLIER 'General case' 0 C--O 1.239 0.544 0 N-CA-C 114.732 1.382 . . . . 5.1100000000000003 114.732 167.244 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -62.22 59.95 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.936 0.894 . . . . 5.4699999999999998 112.051 163.28 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -165.38 -57.82 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 127.048 2.139 . . . . 3.2599999999999998 106.725 -171.587 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.8 p -84.92 122.75 29.64 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 125.079 1.352 . . . . 2.3700000000000001 109.382 177.137 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -90.83 156.59 17.92 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 107.715 -1.217 . . . . 2.1400000000000001 107.715 160.312 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.7 t -152.42 177.91 10.1 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.912 0.885 . . . . 3.6699999999999999 108.784 172.021 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -39.93 -64.74 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 125.487 1.515 . . . . 2.98 112.955 -168.474 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -60.49 -60.19 4.2 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.195 0.452 . . . . 2.1000000000000001 110.416 -175.767 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -38.77 -52.28 1.71 Allowed 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.601 1.56 . . . . 1.8400000000000001 112.296 175.472 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -63.99 -51.74 62.86 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 114.803 -1.09 . . . . 2.5899999999999999 108.726 -179.416 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.426 ' HE2' ' HB3' ' A' ' 56' ' ' LEU . 32.2 ttmt -52.56 -44.95 66.2 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.898 0.479 . . . . 3.5800000000000001 111.185 178.017 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -54.26 -41.44 68.79 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.626 0.648 . . . . 2.23 111.448 175.416 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . 0.441 HD13 ' CD2' ' A' ' 23' ' ' PHE . 45.4 tp -64.67 -49.73 69.8 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.632 -0.877 . . . . 2.6099999999999999 108.632 -176.445 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.8 m -65.8 -52.88 44.61 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 108.528 -0.915 . . . . 1.0 108.528 -174.661 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 96.5 m -52.18 -53.18 46.34 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.936 1.294 . . . . 1.6799999999999999 111.511 178.669 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -75.62 -53.37 8.69 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.42 0.288 . . . . 2.7000000000000002 110.285 -171.545 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -85.4 -33.66 21.91 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 117.717 -1.135 . . . . 4.6399999999999997 112.446 -169.789 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.0 mt -103.17 98.3 11.63 Favored Pre-proline 0 CA--C 1.538 0.494 0 CA-C-N 120.368 1.44 . . . . 2.8700000000000001 111.633 -171.914 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -71.38 -39.15 3.97 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 121.911 1.741 . . . . 1.8100000000000001 111.918 -178.025 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -141.81 -12.29 0.87 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.477 1.288 . . . . 4.8899999999999997 114.477 -170.8 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.48 HD21 ' HG ' ' A' ' 83' ' ' LEU . 28.0 tp -66.32 -68.79 0.34 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 119.032 0.833 . . . . 1.3300000000000001 110.728 -171.353 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 36.9 mt -93.01 100.39 12.83 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 106.252 -1.759 . . . . 2.3100000000000001 106.252 163.63 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 62.4 mttt -69.12 174.99 4.08 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 120.213 -0.595 . . . . 5.4900000000000002 109.962 165.405 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 25.4 t0 59.49 50.48 7.46 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 124.593 2.14 . . . . 4.1299999999999999 108.963 177.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.7 m -58.47 -35.69 55.57 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 CA-C-N 112.338 -2.21 . . . . 1.99 108.414 161.551 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -40.75 -61.69 1.84 Allowed Glycine 0 C--N 1.342 0.91 0 C-N-CA 125.937 1.732 . . . . 1.54 111.783 174.519 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 52.5 m -103.76 43.49 1.08 Allowed 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.755 0.822 . . . . 2.4399999999999999 111.602 177.397 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.426 ' HB3' ' HE2' ' A' ' 39' ' ' LYS . 0.9 OUTLIER -41.05 -43.74 2.25 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 124.252 1.021 . . . . 1.8200000000000001 109.608 162.611 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -39.41 -41.49 0.96 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 127.88 2.472 . . . . 3.7200000000000002 112.231 179.083 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -62.09 -54.36 42.43 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 121.686 -0.633 . . . . 5.0599999999999996 110.561 175.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.95 -50.33 66.72 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 108.304 -0.999 . . . . 2.8700000000000001 108.304 176.54 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -47.29 -58.16 4.43 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.064 1.745 . . . . 2.29 110.188 -176.766 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.53 -35.16 69.93 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.514 -0.312 . . . . 4.7999999999999998 111.58 -179.49 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.4 t -73.17 -46.81 48.64 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.864 0.866 . . . . 2.3799999999999999 111.468 -178.528 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.5 mp -59.26 -48.37 81.87 Favored 'General case' 0 C--O 1.232 0.173 0 O-C-N 121.843 -0.536 . . . . 2.0699999999999998 109.629 176.584 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -71.21 83.41 0.74 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 120.802 0.334 . . . . 1.8600000000000001 110.786 -171.549 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.3 m -45.97 -41.32 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 C-N-CA 125.761 1.624 . . . . 2.6000000000000001 113.941 -173.547 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -96.19 -9.06 31.41 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.26 1.024 . . . . 2.6400000000000001 111.845 -179.869 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 53.02 35.34 19.2 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.356 1.462 . . . . 3.9199999999999999 111.67 177.206 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 57.6 p30 -65.96 -16.64 64.05 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.277 1.031 . . . . 1.96 110.765 170.903 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m 83.73 11.3 0.43 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.616 2.366 . . . . 2.5499999999999998 112.472 -179.064 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -111.06 132.34 54.32 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 106.884 -1.524 . . . . 3.0499999999999998 106.884 164.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -95.68 102.46 14.26 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 104.563 -2.384 . . . . 1.3799999999999999 104.563 163.042 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -100.12 171.36 7.86 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 118.96 0.8 . . . . 3.4399999999999999 109.88 170.929 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -38.68 -60.33 0.84 Allowed 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.267 1.581 . . . . 4.8600000000000003 115.267 -155.033 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -70.01 -26.95 64.31 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.567 0.621 . . . . 1.8300000000000001 112.09 -174.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -73.14 -57.53 3.96 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 107.746 -1.205 . . . . 2.2599999999999998 107.746 176.24 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -50.88 -42.52 59.15 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 124.18 0.992 . . . . 3.2999999999999998 110.827 177.423 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.433 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 3.1 t90 -40.03 -44.79 1.81 Allowed 'General case' 0 CA--C 1.538 0.509 0 O-C-N 124.131 0.894 . . . . 5.25 109.815 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.4 mtt-85 -43.58 -33.96 1.29 Allowed 'General case' 0 C--O 1.226 -0.169 0 N-CA-C 113.227 0.825 . . . . 4.5700000000000003 113.227 -178.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.3 tp -51.92 -49.62 62.71 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-O 117.616 -1.183 . . . . 0.98999999999999999 111.388 174.767 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.4 mt -71.31 -36.5 61.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 C-N-CA 124.96 1.304 . . . . 2.23 108.826 179.059 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.431 ' HA2' ' CE2' ' B' ' 77' ' ' TRP . . . -39.22 -56.78 2.24 Favored Glycine 0 C--N 1.344 1.02 0 C-N-CA 126.01 1.767 . . . . 1.74 111.214 170.057 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -74.17 -52.86 11.19 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-N 110.723 -2.738 . . . . 2.7200000000000002 109.344 179.386 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.48 ' HG ' HD21 ' A' ' 49' ' ' LEU . 2.6 tp -39.25 -56.12 1.57 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.024 1.729 . . . . 2.9500000000000002 112.517 -172.934 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.65 -33.24 71.28 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.129 0.571 . . . . 1.3400000000000001 112.504 179.003 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.505 ' CE ' ' HB2' ' B' ' 74' ' ' ASN . 0.7 OUTLIER -73.36 -44.86 57.87 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.868 1.267 . . . . 2.0800000000000001 110.451 173.782 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -67.42 -16.16 64.08 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 125.173 1.389 . . . . 3.2799999999999998 113.089 -174.021 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 5.3 tt -58.94 -36.73 63.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 O-C-N 121.435 -0.79 . . . . 1.4399999999999999 111.076 165.73 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.97 -52.68 3.36 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 126.72 2.008 . . . . 4.5 109.678 -170.404 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.9 tttm . . . . . 0 CA--C 1.53 0.211 0 C-N-CA 125.908 1.683 . . . . 3.7599999999999998 106.962 163.541 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . 0.573 HD12 ' HG3' ' B' ' 10' ' ' GLU . 25.6 mt . . . . . 0 CA--C 1.542 0.638 0 CA-C-O 120.305 0.097 . . . . 3.7999999999999998 111.234 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 9.3 t -95.78 163.75 13.04 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 125.173 1.389 . . . . 2.23 110.457 -176.016 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -48.07 -55.73 9.49 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.568 1.147 . . . . 2.1600000000000001 112.471 -171.701 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 11.4 mt -58.53 -38.23 77.32 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.419 -0.355 . . . . 1.03 111.358 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . 0.573 ' HG3' HD12 ' B' ' 6' ' ' LEU . 1.4 tm-20 -59.92 -60.18 4.24 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 119.056 -0.497 . . . . 5.71 110.474 169.169 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -45.23 -42.16 9.11 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 119.752 1.16 . . . . 4.2599999999999998 110.645 -176.75 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 22.3 p -64.01 -31.64 72.89 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.12 1.526 . . . . 1.3999999999999999 115.12 177.082 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 12.6 pt -76.04 -41.28 38.2 Favored 'Isoleucine or valine' 0 C--N 1.344 0.366 0 CA-C-N 121.95 2.159 . . . . 1.4399999999999999 109.955 164.107 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -47.11 -56.11 7.16 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 121.045 1.748 . . . . 2.8799999999999999 109.981 -174.004 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 15.3 t -48.22 -43.37 32.06 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.485 1.136 . . . . 1.29 111.733 178.234 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . 0.464 HG13 ' CE2' ' B' ' 20' ' ' PHE . 0.5 OUTLIER -72.99 -38.31 55.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 C-N-CA 124.271 1.028 . . . . 1.53 110.126 -177.923 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 69.2 t -61.92 -50.61 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 123.831 0.852 . . . . 1.29 109.303 175.455 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.1 t -61.59 -43.67 98.43 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.839 0.745 . . . . 1.46 110.665 178.486 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 98.7 m -47.95 -58.16 4.77 Favored 'General case' 0 C--N 1.346 0.449 0 CA-C-N 118.595 0.634 . . . . 1.4399999999999999 109.482 170.354 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . 0.464 ' CE2' HG13 ' B' ' 16' ' ' VAL . 16.8 m-30 -55.02 -44.64 74.79 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 112.786 0.662 . . . . 6.3099999999999996 112.786 178.514 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -60.26 -53.54 56.4 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 119.716 1.144 . . . . 4.4199999999999999 110.12 -176.815 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 6.7 t -65.87 -40.74 91.92 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 119.52 -0.872 . . . . 3.5 110.08 -179.439 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -62.8 -61.73 2.21 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 121.517 -0.74 . . . . 5.25 111.55 -179.754 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.14 -19.72 65.48 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 125.808 1.643 . . . . 1.0 111.951 -172.409 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.07 -26.86 11.99 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 118.431 -0.795 . . . . 4.1699999999999999 111.167 169.192 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -39.28 -69.05 0.14 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 115.994 1.85 . . . . 1.8600000000000001 115.994 -156.742 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -92.14 -77.7 0.43 Allowed 'General case' 0 C--N 1.341 0.206 0 C-N-CA 118.889 -1.125 . . . . 2.8500000000000001 112.688 -171.289 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.04 161.16 25.39 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 127.929 2.68 . . . . 1.72 110.614 152.959 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.0 ttm180 55.96 102.34 0.01 OUTLIER 'General case' 0 C--O 1.24 0.601 0 N-CA-C 115.116 1.525 . . . . 4.1699999999999999 115.116 135.719 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.47 6.6 5.49 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 115.135 1.531 . . . . 6.5800000000000001 115.135 -174.256 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -123.77 11.44 9.07 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.231 0.923 . . . . 4.0800000000000001 110.961 178.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 29.0 p -142.57 142.4 32.17 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 109.321 -0.622 . . . . 1.5700000000000001 109.321 172.87 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -101.29 154.18 19.0 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.303 -0.999 . . . . 2.2400000000000002 108.303 167.361 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 68.6 m -136.46 168.72 18.93 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 107.003 -1.48 . . . . 2.4100000000000001 107.003 173.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 10.8 p -84.04 53.9 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 121.725 0.774 . . . . 2.7999999999999998 111.202 -172.454 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 38.2 t30 -157.21 51.08 0.47 Allowed 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 105.881 -1.896 . . . . 3.0699999999999998 105.881 150.038 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -168.41 -62.41 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 104.583 -2.377 . . . . 2.0800000000000001 104.583 -166.897 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -48.61 -49.19 38.0 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.689 0.796 . . . . 2.71 111.036 178.32 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 31.3 tttt -57.44 -29.27 64.05 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.081 0.552 . . . . 2.6499999999999999 111.586 -177.992 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -70.17 -25.6 63.52 Favored 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 121.535 -0.728 . . . . 4.5899999999999999 110.587 -174.696 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 14.8 tp -70.16 -43.2 71.34 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 119.015 0.825 . . . . 1.95 109.716 178.016 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 6.0 m -69.89 -41.27 79.57 Favored 'Isoleucine or valine' 0 C--N 1.339 0.147 0 N-CA-C 109.099 -0.704 . . . . 0.64000000000000001 109.099 -178.501 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 87.6 m -67.42 -60.78 2.3 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 116.029 -0.532 . . . . 0.81000000000000005 111.071 -178.782 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -82.82 -62.81 1.5 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.839 0.456 . . . . 2.1099999999999999 111.897 -170.821 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -70.61 -48.2 56.32 Favored 'General case' 0 CA--C 1.528 0.096 0 O-C-N 122.16 -0.338 . . . . 3.8900000000000001 111.782 -169.651 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 tp -71.58 -19.89 0.44 Allowed Pre-proline 0 CA--C 1.536 0.429 0 N-CA-C 114.666 1.358 . . . . 1.8600000000000001 114.666 -161.627 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -34.42 -65.92 0.11 Allowed 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 121.895 1.73 . . . . 2.0099999999999998 114.806 -110.593 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -73.65 -59.6 2.64 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 113.358 0.873 . . . . 2.3799999999999999 113.358 -158.544 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.673 ' HG ' HD23 ' B' ' 50' ' ' LEU . 29.5 tp 0.53 -85.04 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 127.949 2.499 . . . . 1.4299999999999999 115.613 176.238 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.673 HD23 ' HG ' ' B' ' 49' ' ' LEU . 0.4 OUTLIER -125.88 64.52 1.21 Allowed 'General case' 0 CA--C 1.522 -0.122 0 N-CA-C 108.05 -1.092 . . . . 2.6499999999999999 108.05 166.82 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.28 123.31 7.22 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.573 -0.899 . . . . 6.3300000000000001 108.573 166.995 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 60.6 t0 -165.96 51.43 0.09 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 105.999 -1.852 . . . . 5.1299999999999999 105.999 -169.02 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 34.4 m -88.5 -12.25 10.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 113.698 -1.592 . . . . 2.3700000000000001 111.102 -173.679 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -71.42 -77.19 0.53 Allowed Glycine 0 C--N 1.338 0.669 0 N-CA-C 107.416 -2.274 . . . . 2.6800000000000002 107.416 165.654 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.1 43.72 0.37 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.863 1.665 . . . . 3.2200000000000002 112.65 -177.765 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -67.82 -28.48 67.61 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 108.549 -0.908 . . . . 1.1699999999999999 108.549 169.18 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.9 -53.17 61.42 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.097 0.862 . . . . 4.4800000000000004 110.044 173.521 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -47.22 -56.06 7.41 Favored 'General case' 0 C--N 1.342 0.259 0 C-N-CA 124.003 0.921 . . . . 2.48 109.508 173.002 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -56.61 -61.46 2.4 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 120.812 -0.355 . . . . 4.6500000000000004 110.193 -176.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -45.03 -55.25 5.74 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 125.242 1.417 . . . . 1.6100000000000001 110.271 179.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -60.98 -41.1 95.79 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 125.168 1.387 . . . . 3.5 110.528 -177.178 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 50.5 m -64.96 -31.7 73.07 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.017 0.527 . . . . 1.8500000000000001 111.82 175.43 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 mp -74.42 -52.83 10.94 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.809 0.731 . . . . 1.54 111.133 173.357 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.256 19.8 t0 -57.88 -8.62 1.02 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.969 2.907 . . . . 1.6599999999999999 117.635 -164.451 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 8.8 m -33.6 -18.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.472 1 C-N-CA 132.776 4.431 . . . . 1.3999999999999999 119.344 -139.8 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.6 -37.75 58.74 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 120.145 1.339 . . . . 2.7200000000000002 109.616 158.114 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 67.44 68.12 0.38 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 126.744 2.018 . . . . 3.2999999999999998 108.95 -171.87 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 28.4 p30 -128.03 -10.47 5.38 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.373 1.869 . . . . 1.8899999999999999 113.494 -172.652 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 17.9 m 72.14 4.04 4.88 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.311 1.444 . . . . 1.8600000000000001 114.589 -178.578 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . 0.407 ' OE1' ' NZ ' ' B' ' 72' ' ' LYS . 1.8 mt-10 -99.12 103.35 15.25 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 106.321 -1.733 . . . . 3.79 106.321 156.245 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.26 94.43 1.19 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 104.331 -2.47 . . . . 1.1699999999999999 104.331 158.975 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . 0.407 ' NZ ' ' OE1' ' B' ' 70' ' ' GLU . 20.6 ttmm -81.78 172.48 13.31 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.973 0.909 . . . . 3.27 110.429 -170.272 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -87.83 56.06 3.73 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.0 -1.063 . . . . 4.6100000000000003 111.257 177.178 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . 0.505 ' HB2' ' CE ' ' A' ' 85' ' ' LYS . 0.5 OUTLIER -161.35 55.72 0.28 Allowed 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 107.32 -1.363 . . . . 2.5699999999999998 107.32 100.263 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -90.9 -60.97 1.77 Allowed 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 124.741 1.216 . . . . 2.0899999999999999 108.808 139.562 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -56.77 -37.05 70.55 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 124.09 0.956 . . . . 5.7699999999999996 112.177 -161.95 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.566 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 1.6 t-105 -45.46 -39.74 7.52 Favored 'General case' 0 C--O 1.219 -0.512 0 O-C-N 123.565 0.541 . . . . 5.5 109.987 175.727 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -39.62 -48.46 2.1 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 120.965 -1.084 . . . . 4.2800000000000002 112.038 -169.105 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 13.1 tp -49.53 -46.71 48.88 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.421 0.688 . . . . 1.02 111.244 177.445 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 8.5 mm -58.37 -42.25 83.5 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.103 0 C-N-CA 127.284 2.233 . . . . 2.7999999999999998 108.169 -178.824 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -64.5 -51.18 54.5 Favored Glycine 0 N--CA 1.441 -1.019 0 N-CA-C 109.971 -1.252 . . . . 1.5800000000000001 109.971 178.166 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -50.89 -47.47 60.59 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 118.235 -0.888 . . . . 2.1699999999999999 110.712 178.166 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.434 HD23 HD21 ' B' ' 50' ' ' LEU . 22.1 mt -39.14 -54.5 1.75 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.598 1.09 . . . . 1.9399999999999999 113.214 -178.25 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.78 -26.25 68.62 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.917 1.287 . . . . 1.3200000000000001 112.143 -176.55 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -80.72 -53.42 6.53 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.131 0.973 . . . . 1.96 109.526 171.648 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . 0.451 ' CG ' HD22 ' B' ' 50' ' ' LEU . 4.2 mm-40 -57.6 -40.42 79.03 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.993 0.917 . . . . 2.5499999999999998 111.718 -171.113 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 10.8 tt -50.01 -36.68 12.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 118.568 0.622 . . . . 1.03 111.885 174.758 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -49.11 11.23 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.518 0.727 . . . . 5.3600000000000003 109.726 174.774 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 32.2 mttm . . . . . 0 CA--C 1.536 0.442 0 C-N-CA 125.886 1.674 . . . . 5.1399999999999997 112.144 -166.16 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 . . . . . 0 N--CA 1.451 -0.391 0 N-CA-C 109.093 -0.706 . . . . 4.8200000000000003 109.093 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -70.54 146.94 56.72 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 121.859 1.706 . . . . 2.73 108.385 175.373 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 51.9 mt -101.15 173.14 6.6 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.256 -1.016 . . . . 1.4399999999999999 108.256 -176.178 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . 0.605 HG22 ' OE1' ' A' ' 10' ' ' GLU . 8.9 t -71.14 161.47 31.05 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 120.573 -1.329 . . . . 2.5099999999999998 110.001 178.548 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -48.34 -43.77 33.72 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 124.072 0.949 . . . . 2.6099999999999999 111.382 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.424 ' H ' HD12 ' A' ' 9' ' ' LEU . 5.6 mp -63.29 -54.46 36.84 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 109.308 -0.627 . . . . 1.96 109.308 -177.265 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . 0.605 ' OE1' HG22 ' A' ' 7' ' ' THR . 81.6 mt-10 -49.64 -57.71 6.67 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.586 1.554 . . . . 2.7000000000000002 110.898 174.975 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -49.93 -51.13 43.36 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.889 0.876 . . . . 3.5899999999999999 109.94 177.966 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.8 p -64.3 -47.86 77.86 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.543 -0.723 . . . . 1.6100000000000001 112.21 -178.124 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.276 2.6 pp -63.13 -31.57 53.15 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 O-C-N 121.131 -0.981 . . . . 1.1000000000000001 110.283 -179.577 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -65.73 -57.07 8.89 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 120.026 -0.669 . . . . 3.1400000000000001 109.404 169.281 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -48.38 -43.52 33.92 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.983 0.81 . . . . 1.3999999999999999 111.616 -171.764 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.4 m -69.75 -39.39 77.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 121.402 -0.811 . . . . 1.03 111.568 177.413 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.8 t -63.73 -48.17 87.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.729 0.812 . . . . 0.98999999999999999 110.572 177.614 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.7 t -60.89 -44.04 97.66 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 120.981 -1.075 . . . . 0.84999999999999998 110.741 174.398 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 61.1 m -57.34 -45.08 84.68 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.327 0.967 . . . . 0.77000000000000002 110.264 176.433 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -53.33 -60.07 3.76 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.178 0.591 . . . . 3.3700000000000001 110.235 172.4 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -58.76 -48.0 82.74 Favored 'General case' 0 C--O 1.232 0.169 0 O-C-N 121.693 -0.63 . . . . 4.25 112.185 -174.125 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -63.47 -23.11 67.26 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 118.639 -0.696 . . . . 1.9199999999999999 111.243 -178.186 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -80.05 -42.03 24.54 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 118.462 0.574 . . . . 2.9500000000000002 111.185 167.78 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.93 -32.19 65.72 Favored 'General case' 0 C--O 1.238 0.474 0 O-C-N 120.68 -1.263 . . . . 1.28 112.579 -175.539 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.255 0.0 OUTLIER -77.14 -15.17 59.64 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.804 1.641 . . . . 3.8199999999999998 113.971 179.546 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.04 -65.08 0.4 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.457 1.026 . . . . 1.8999999999999999 112.03 177.248 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -141.21 -175.31 4.29 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 125.72 1.608 . . . . 5.46 109.226 -170.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 25.12 92.76 0.01 OUTLIER Glycine 0 C--N 1.341 0.858 0 C-N-CA 127.197 2.332 . . . . 2.3900000000000001 113.179 157.841 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 62.44 102.01 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.55 1.14 . . . . 5.4500000000000002 110.35 178.854 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.9 pttt -79.03 50.99 1.09 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.115 1.366 . . . . 6.4900000000000002 112.074 -166.404 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -172.01 -55.15 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 107.815 -1.18 . . . . 5.5999999999999996 107.815 -156.839 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.7 p -84.74 153.81 22.81 Favored 'General case' 0 C--O 1.244 0.799 0 C-N-CA 124.058 0.943 . . . . 2.4199999999999999 110.886 170.486 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -94.67 119.08 32.74 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.094 -1.076 . . . . 2.0600000000000001 108.094 172.843 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.4 m -82.41 166.28 19.54 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.345 -0.983 . . . . 3.0699999999999998 108.345 171.778 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.0 t -60.99 -57.96 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 O-C-N 121.139 -0.976 . . . . 2.29 111.275 -171.558 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -61.33 -43.25 99.19 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.096 0.474 . . . . 3.3999999999999999 110.888 -179.665 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -50.83 -50.6 56.22 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.668 1.187 . . . . 2.52 110.324 176.188 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -62.94 -44.11 96.97 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.829 -0.544 . . . . 3.6499999999999999 110.933 173.71 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -49.22 -38.81 27.58 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.641 -0.695 . . . . 3.7200000000000002 111.234 -178.292 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -46.06 -48.76 16.9 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 118.807 0.731 . . . . 2.8700000000000001 112.085 172.754 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -59.32 -51.37 70.23 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 108.949 -0.76 . . . . 2.4700000000000002 108.949 -173.167 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.99 -33.66 48.18 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 CA-C-N 115.87 -0.605 . . . . 1.3400000000000001 110.012 -173.769 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 91.1 m -69.33 -32.77 72.09 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.896 0.878 . . . . 1.23 111.124 174.012 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -81.16 -58.84 2.88 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 125.002 1.321 . . . . 2.5699999999999998 109.878 -174.392 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -99.95 -135.26 0.29 Allowed 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 108.898 -0.779 . . . . 3.8500000000000001 108.898 176.322 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . 0.451 HD22 ' H ' ' A' ' 46' ' ' LEU . 2.8 mm? 29.98 51.75 0.46 Allowed Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 127.309 2.244 . . . . 2.0800000000000001 113.949 -170.688 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -66.95 -40.08 12.74 Favored 'Trans proline' 0 N--CA 1.448 -1.201 0 C-N-CA 121.97 1.78 . . . . 1.73 111.175 178.424 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 20.6 t-160 -116.71 -28.05 6.48 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-O 119.216 -0.421 . . . . 4.1299999999999999 111.636 -165.166 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 tp -64.53 -74.75 0.1 Allowed 'General case' 0 C--O 1.232 0.174 0 CA-C-N 119.481 1.037 . . . . 1.3999999999999999 110.832 179.903 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 85.2 mt -119.54 83.63 2.07 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.338 1.455 . . . . 2.3100000000000001 107.362 -174.406 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -178.34 0.31 Allowed 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 114.976 -1.011 . . . . 5.7800000000000002 109.433 167.626 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 80.97 44.2 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 125.192 1.397 . . . . 4.0 110.053 -179.8 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -59.99 -21.5 22.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 C-N-CA 124.833 1.253 . . . . 3.4700000000000002 111.188 175.873 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -56.18 -53.97 38.92 Favored Glycine 0 CA--C 1.528 0.899 0 N-CA-C 110.736 -0.945 . . . . 1.6599999999999999 110.736 169.439 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 56.0 p -80.14 40.71 0.49 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.062 0.931 . . . . 2.8799999999999999 111.726 -172.132 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -57.21 -36.92 71.46 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 120.811 -1.181 . . . . 1.6200000000000001 110.501 -172.373 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.09 -34.95 58.9 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.689 0.996 . . . . 4.5700000000000003 113.689 177.459 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -57.99 -51.97 67.45 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.571 0.701 . . . . 3.1499999999999999 109.219 174.313 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.75 -51.07 70.89 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.574 -1.269 . . . . 3.6800000000000002 107.574 -178.694 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -46.35 -60.88 2.06 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 123.922 0.889 . . . . 1.4399999999999999 109.988 176.93 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -67.32 -28.34 67.91 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.055 0.843 . . . . 4.1699999999999999 112.396 -176.645 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 49.5 m -61.74 -32.04 72.26 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.647 0.658 . . . . 2.2400000000000002 111.804 169.543 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . 0.485 HD23 ' HB3' ' A' ' 78' ' ' ARG . 12.1 mt -91.24 -64.38 1.13 Allowed 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 124.714 1.206 . . . . 1.72 111.305 -175.52 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -74.48 71.61 1.83 Allowed 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.242 1.417 . . . . 2.1499999999999999 109.96 -173.803 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -33.1 8.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 124.934 1.294 . . . . 3.3900000000000001 112.766 -177.507 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -85.14 -10.2 57.0 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.214 1.006 . . . . 2.1299999999999999 113.095 -179.203 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.86 39.85 26.67 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.862 1.265 . . . . 5.0999999999999996 110.693 179.372 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 31.0 p30 -88.62 -14.53 37.27 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.006 0.922 . . . . 2.1600000000000001 109.92 174.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.2 m 69.34 15.75 8.43 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.942 1.297 . . . . 1.5900000000000001 112.974 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -121.66 105.61 10.58 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.609 1.563 . . . . 3.96 107.474 167.24 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.14 109.32 16.34 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 105.976 -1.861 . . . . 1.26 105.976 -175.154 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -85.06 148.54 26.1 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.435 1.094 . . . . 3.46 108.149 177.048 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -39.69 -56.37 1.72 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.012 1.325 . . . . 5.1500000000000004 114.159 -173.44 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -68.06 -29.08 67.96 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.451 -0.781 . . . . 2.0499999999999998 112.173 -178.609 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -66.13 -51.36 58.69 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 107.975 -1.12 . . . . 2.1899999999999999 107.975 173.104 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.98 -44.44 64.02 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.315 1.046 . . . . 6.4000000000000004 110.395 177.948 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.679 ' CZ2' ' CE2' ' B' ' 77' ' ' TRP . 23.5 t90 -40.63 -38.71 0.92 Allowed 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 117.705 -1.14 . . . . 5.0099999999999998 113.061 -171.615 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.485 ' HB3' HD23 ' A' ' 63' ' ' LEU . 15.3 ttt180 -39.24 -49.49 1.9 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.61 1.096 . . . . 6.3899999999999997 111.012 175.805 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 9.6 tp -46.97 -46.47 21.6 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 123.368 0.667 . . . . 0.87 110.27 -177.751 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 53.2 mt -66.31 -33.0 60.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 121.829 0.823 . . . . 1.9399999999999999 109.319 -174.066 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.56 ' HA2' ' CE2' ' B' ' 77' ' ' TRP . . . -63.6 -48.87 73.65 Favored Glycine 0 CA--C 1.492 -1.373 0 C-N-CA 126.888 2.185 . . . . 1.4299999999999999 110.073 176.728 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 4.0 mm-40 -69.89 -53.07 19.67 Favored 'General case' 0 N--CA 1.433 -1.298 0 N-CA-C 106.002 -1.851 . . . . 2.4199999999999999 106.002 -173.976 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mt -40.13 -59.39 1.26 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.913 1.285 . . . . 2.52 111.375 168.835 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.72 -41.35 77.3 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.43 0.692 . . . . 1.1599999999999999 110.943 -179.485 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -58.92 -52.19 66.79 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 121.896 -0.503 . . . . 1.97 110.184 174.091 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -52.42 -46.31 66.3 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.409 1.883 . . . . 2.3100000000000001 110.288 -168.143 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.8 tt -53.77 -29.99 18.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 N-CA-C 112.52 0.563 . . . . 1.48 112.52 178.246 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -88.68 -45.48 9.79 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.109 0.964 . . . . 6.1200000000000001 111.25 174.15 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.3 tttt . . . . . 0 CA--C 1.535 0.404 0 C-N-CA 128.233 2.613 . . . . 3.48 114.299 -165.124 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.3 mt . . . . . 0 CA--C 1.548 0.869 0 CA-C-O 119.153 -0.451 . . . . 3.0600000000000001 109.821 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . 0.485 HG23 ' N ' ' B' ' 8' ' ' GLU . 4.0 t -69.13 -70.56 0.27 Allowed 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 115.221 1.563 . . . . 2.3599999999999999 115.221 -165.766 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . 0.485 ' N ' HG23 ' B' ' 7' ' ' THR . 28.4 tt0 -171.93 -73.45 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.411 1.484 . . . . 2.3900000000000001 108.334 -168.094 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 17.4 mt -56.47 -41.24 76.23 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.574 -1.328 . . . . 1.05 110.064 167.798 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . 0.446 ' CG ' HG22 ' B' ' 7' ' ' THR . 78.4 mt-10 -54.59 -41.8 70.33 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.52 0.728 . . . . 3.5099999999999998 111.319 171.964 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -63.42 -43.54 97.2 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 120.891 -1.131 . . . . 4.3099999999999996 110.43 173.974 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.2 t -59.58 -45.42 91.92 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.305 0.642 . . . . 1.8300000000000001 110.624 -178.259 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.8 pp -66.46 -38.0 80.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 118.151 0.432 . . . . 1.0 110.4 172.869 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -56.09 -60.34 3.63 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-O 117.894 -1.051 . . . . 2.73 109.764 178.929 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.1 t -56.93 -28.82 62.51 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 120.182 1.355 . . . . 1.24 113.455 -170.516 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 27.2 m -81.05 -44.66 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 O-C-N 121.426 -0.797 . . . . 0.89000000000000001 109.626 -178.669 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 85.9 t -54.38 -35.46 30.95 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.407 0 N-CA-C 108.405 -0.961 . . . . 1.1200000000000001 108.405 165.748 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . 2.238 1.5 t -54.59 -63.76 1.05 Allowed 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 126.543 1.937 . . . . 3.29 110.834 -178.72 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 49.8 m -51.32 -59.66 3.98 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 110.805 -2.907 . . . . 1.02 110.166 176.598 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -58.91 -54.55 45.81 Favored 'General case' 0 C--O 1.223 -0.331 0 O-C-N 122.108 -0.37 . . . . 6.8899999999999997 110.815 -178.946 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -57.72 -45.76 85.32 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.895 1.278 . . . . 3.1699999999999999 111.768 -176.52 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 2.7 t -65.72 -52.9 47.54 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.082 -0.71 . . . . 3.0899999999999999 109.082 177.158 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -55.5 -38.95 69.84 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.696 0.76 . . . . 3.54 111.046 -179.031 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.93 -24.2 36.43 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.153 2.181 . . . . 1.1399999999999999 110.6 -179.42 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -19.24 34.67 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 117.844 -1.074 . . . . 4.1799999999999997 111.841 175.783 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.435 ' HB3' ' HG3' ' B' ' 37' ' ' GLU . 0.5 OUTLIER -50.57 -67.52 0.25 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.881 1.067 . . . . 2.1099999999999999 113.881 -160.96 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 68.4 mt-10 -90.14 -44.48 9.75 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 125.931 1.692 . . . . 3.7200000000000002 111.977 -179.091 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.5 -143.48 1.12 Allowed Glycine 0 CA--C 1.536 1.36 0 CA-C-N 115.269 -0.878 . . . . 3.75 113.546 -166.052 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 16.2 mtt-85 50.35 99.45 0.01 OUTLIER 'General case' 0 C--O 1.237 0.404 1 C-N-CA 131.755 4.022 . . . . 3.5800000000000001 112.464 27.349 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 10.4 ptpp? -66.42 -177.72 0.59 Allowed 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 119.092 -1.043 . . . . 3.8500000000000001 109.195 148.946 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 9.1 t70 78.31 -59.83 0.42 Allowed 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 127.593 2.357 . . . . 4.1500000000000004 109.846 179.809 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 25.8 p -88.12 134.66 33.71 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.471 0.653 . . . . 1.8500000000000001 110.201 175.857 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.14 141.89 32.71 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 106.84 -1.541 . . . . 2.2000000000000002 106.84 167.056 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 4.5 t -92.79 -172.32 2.99 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 125.086 1.354 . . . . 2.21 109.998 165.771 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . 0.408 ' C ' ' H ' ' B' ' 37' ' ' GLU . 70.9 t -67.53 -112.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.431 2 N-CA-C 99.47 -4.27 . . . . 3.52 99.47 -179.354 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.75 53.78 0.75 Allowed 'General case' 0 CA--C 1.556 1.202 0 CA-C-N 123.505 2.866 . . . . 2.8999999999999999 112.136 -172.171 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.435 ' HG3' ' HB3' ' B' ' 26' ' ' GLN . 3.3 tt0 -105.4 -58.0 1.96 Allowed 'General case' 0 N--CA 1.448 -0.552 1 C-N-CA 132.292 4.237 . . . . 1.6599999999999999 104.099 150.38 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -57.68 -40.16 78.8 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.716 0.806 . . . . 2.1699999999999999 110.161 -178.767 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.7 ttpm? -58.02 -37.06 73.6 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 119.126 -1.03 . . . . 4.6299999999999999 109.981 179.647 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -73.83 -25.58 60.16 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 116.413 -0.358 . . . . 4.9000000000000004 110.687 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 tt -67.57 -48.76 65.98 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.484 -0.932 . . . . 2.6899999999999999 108.484 172.558 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 2.1 m -65.24 -51.09 69.51 Favored 'Isoleucine or valine' 0 C--N 1.34 0.166 0 N-CA-C 109.344 -0.613 . . . . 1.1200000000000001 109.344 -177.858 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 94.6 m -51.31 -56.6 12.18 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.722 0.809 . . . . 0.89000000000000001 111.576 176.557 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -80.87 -54.37 5.65 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.757 0.28 . . . . 1.77 111.757 -169.612 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 26.5 mm100 -80.11 -40.23 27.92 Favored 'General case' 0 C--O 1.227 -0.131 0 N-CA-C 113.573 0.953 . . . . 3.5699999999999998 113.573 -164.64 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.62 -41.89 92.01 Favored Pre-proline 0 N--CA 1.467 0.393 0 CA-C-N 118.937 0.79 . . . . 2.0800000000000001 112.47 -168.237 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -70.61 -54.4 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.926 0 N-CA-C 107.631 -1.719 . . . . 2.6299999999999999 107.631 -41.91 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 50.7 t60 -66.44 -43.62 85.11 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.786 1.234 . . . . 3.48 112.046 -175.311 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 27.0 tp -33.85 -62.96 0.28 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.123 1.769 . . . . 1.3600000000000001 113.257 -168.635 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . 0.495 ' CD1' HD11 ' B' ' 79' ' ' LEU . 35.2 mt -81.34 97.59 7.77 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 107.76 -1.2 . . . . 1.6899999999999999 107.76 167.152 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -49.44 145.07 5.02 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.081 -0.711 . . . . 6.0499999999999998 109.081 171.065 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 40.7 t0 63.38 60.19 1.17 Allowed 'General case' 0 C--N 1.339 0.134 0 CA-C-O 123.987 1.851 . . . . 4.3099999999999996 109.191 171.29 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 33.7 m -56.07 -21.27 11.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 112.36 -2.2 . . . . 2.0800000000000001 111.245 164.142 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -64.34 -60.52 7.0 Favored Glycine 0 C--N 1.341 0.82 0 C-N-CA 124.455 1.026 . . . . 2.9700000000000002 111.378 178.367 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.2 t -77.21 66.68 3.04 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 122.396 1.094 . . . . 2.71 109.675 -175.846 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.09 -34.88 71.56 Favored 'General case' 0 N--CA 1.44 -0.926 0 C-N-CA 125.274 1.43 . . . . 1.3 109.917 -174.162 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -18.08 -70.35 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 127.128 2.171 . . . . 4.1900000000000004 115.508 167.194 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -38.77 78.67 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.705 1.139 . . . . 3.21 111.635 -175.676 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.98 -60.08 4.35 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.203 -1.036 . . . . 3.5600000000000001 108.203 172.734 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -46.16 -51.43 14.11 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-N 118.962 0.801 . . . . 2.2599999999999998 110.982 -178.36 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -63.0 -42.21 99.79 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.74 -0.6 . . . . 3.5499999999999998 111.954 178.827 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 24.8 t -61.16 -39.67 90.97 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.7 0.682 . . . . 2.2999999999999998 111.828 174.763 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . 0.438 HD23 ' HB2' ' B' ' 78' ' ' ARG . 34.4 mt -80.83 -61.19 2.04 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.478 1.111 . . . . 1.6399999999999999 110.669 -171.822 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -71.11 -10.12 59.22 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 128.888 2.875 . . . . 2.9399999999999999 115.101 -162.636 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -37.72 -19.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 C-N-CA 131.143 3.777 . . . . 3.9900000000000002 117.441 -160.698 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -61.12 -19.42 61.48 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 120.192 1.36 . . . . 2.7599999999999998 111.747 171.845 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 101.16 -25.3 0.02 OUTLIER 'General case' 0 C--N 1.343 0.309 0 C-N-CA 127.605 2.362 . . . . 3.6200000000000001 111.32 166.982 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -61.62 139.32 58.29 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 118.457 -1.297 . . . . 2.9900000000000002 107.546 164.848 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 1.7 p -78.33 12.9 1.71 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 127.929 2.492 . . . . 3.2799999999999998 112.987 -179.576 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -87.63 116.76 25.98 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 104.389 -2.449 . . . . 3.2599999999999998 104.389 162.839 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.05 90.59 0.09 Allowed 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 104.924 -2.25 . . . . 1.8500000000000001 104.924 157.463 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 36.6 tptt -80.02 168.45 19.17 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.331 -0.989 . . . . 4.9400000000000004 108.331 -165.564 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -91.61 61.02 4.17 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.22 -0.659 . . . . 4.6399999999999997 109.22 175.627 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -154.89 50.94 0.6 Allowed 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 119.096 -1.042 . . . . 3.8999999999999999 112.661 87.203 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -86.42 -55.92 3.67 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.691 1.597 . . . . 2.2000000000000002 108.288 153.798 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -50.62 -39.95 51.59 Favored 'General case' 0 C--N 1.344 0.354 0 C-N-CA 123.021 0.528 . . . . 5.9100000000000001 110.427 -174.377 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.679 ' CE2' ' CZ2' ' A' ' 77' ' ' TRP . 27.8 t90 -47.44 -38.49 13.62 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 123.651 0.781 . . . . 4.0 111.206 -179.808 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . 0.438 ' HB2' HD23 ' B' ' 63' ' ' LEU . 54.5 mtp85 -43.05 -38.79 2.45 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.681 1.193 . . . . 4.3099999999999996 111.716 177.079 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . 0.495 HD11 ' CD1' ' B' ' 50' ' ' LEU . 13.7 tp -51.62 -47.45 63.66 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 117.915 0.325 . . . . 0.85999999999999999 111.05 177.686 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 65.3 mt -65.74 -26.04 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 109.133 -0.691 . . . . 1.73 109.133 -176.252 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.574 ' N ' ' CZ2' ' A' ' 77' ' ' TRP . . . -67.15 -51.64 37.43 Favored Glycine 0 CA--C 1.501 -0.829 0 C-N-CA 126.907 2.194 . . . . 1.78 108.112 176.104 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -51.99 -60.95 2.59 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.168 -1.049 . . . . 4.3899999999999997 108.168 169.411 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.4 mt -48.09 -51.96 22.33 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 120.526 1.512 . . . . 2.4900000000000002 113.121 -175.701 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.0 -33.93 62.99 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.26 1.024 . . . . 1.9099999999999999 110.548 178.647 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.89 -56.39 5.8 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 117.284 -1.341 . . . . 1.98 111.423 165.538 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -52.73 -36.15 57.17 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 120.295 1.407 . . . . 2.54 112.894 -164.092 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 3.0 tt -55.61 -38.2 49.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 O-C-N 121.598 -0.689 . . . . 0.98999999999999999 111.446 175.222 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -84.06 -61.66 1.76 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.248 1.419 . . . . 6.5800000000000001 113.463 169.949 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 10.8 pttp . . . . . 0 C--O 1.223 -0.302 0 O-C-N 120.804 -1.185 . . . . 6.5099999999999998 111.83 -169.555 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 . . . . . 0 N--CA 1.444 -0.728 0 N-CA-C 108.82 -0.807 . . . . 4.4400000000000004 108.82 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -67.53 141.98 57.49 Favored 'Trans proline' 0 N--CA 1.45 -1.079 0 N-CA-C 107.522 -1.761 . . . . 2.25 107.522 171.028 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.6 mt -96.84 173.9 7.07 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 107.4 -1.333 . . . . 1.3300000000000001 107.4 179.324 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.9 t -72.47 166.63 22.23 Favored 'General case' 0 CA--C 1.529 0.173 0 O-C-N 120.804 -1.185 . . . . 1.8500000000000001 110.534 -177.824 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -52.8 -57.42 10.23 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.961 0.886 . . . . 2.1899999999999999 111.39 -169.019 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 mt -66.63 -31.2 71.74 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 117.436 -1.269 . . . . 1.6399999999999999 112.08 178.679 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 77.6 mt-10 -55.67 -55.97 25.95 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.84 1.654 . . . . 1.95 110.92 168.482 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -48.56 -51.44 27.7 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 122.028 0.918 . . . . 3.3900000000000001 109.18 174.748 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.2 t -60.01 -53.58 56.15 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.279 -0.873 . . . . 1.8300000000000001 112.42 -173.787 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.356 0.1 OUTLIER -71.29 -33.24 49.8 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 119.404 1.002 . . . . 1.45 110.415 -178.584 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -53.44 -53.3 53.25 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.081 0.855 . . . . 2.6699999999999999 109.693 173.293 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.5 t -59.22 -25.38 63.96 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.953 1.094 . . . . 1.49 113.953 -173.686 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.7 m -81.24 -42.22 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 120.286 1.403 . . . . 0.65000000000000002 110.776 169.498 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.1 t -56.05 -46.05 80.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 123.89 0.876 . . . . 0.73999999999999999 111.018 179.62 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.3 t -60.65 -47.08 87.82 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.174 0.897 . . . . 0.76000000000000001 110.632 177.309 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.3 m -58.26 -47.12 84.59 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.358 -0.839 . . . . 0.82999999999999996 110.073 179.275 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.455 ' CZ ' HD23 ' A' ' 33' ' ' LEU . 7.6 t80 -52.34 -56.98 11.27 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.566 1.146 . . . . 3.0099999999999998 110.696 171.171 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -68.62 -39.56 80.77 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 123.91 0.884 . . . . 2.6600000000000001 110.928 -166.506 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.3 p -57.92 -60.35 3.85 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.621 -0.881 . . . . 2.46 108.621 169.762 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -49.04 -41.39 34.8 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 118.874 0.761 . . . . 3.0 113.044 -179.75 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.68 -25.75 19.57 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 127.037 2.135 . . . . 1.1000000000000001 111.711 -174.774 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -34.1 70.73 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.999 1.32 . . . . 4.1500000000000004 112.367 176.575 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -52.85 -52.03 58.73 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-O 121.642 0.734 . . . . 1.98 112.53 -157.323 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -119.34 165.3 14.48 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 127.839 2.456 . . . . 2.7000000000000002 105.923 176.033 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 9.19 106.98 0.0 OUTLIER Glycine 0 CA--C 1.536 1.372 0 C-N-CA 126.798 2.142 . . . . 1.46 115.768 165.593 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? 66.38 105.41 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.848 1.259 . . . . 5.8799999999999999 113.904 165.552 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.3 pttp -65.29 63.99 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.499 0.72 . . . . 3.5299999999999998 111.245 164.529 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -171.67 -53.59 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 126.9 2.08 . . . . 3.6800000000000002 106.965 -175.987 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 m -84.4 128.0 34.33 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 124.345 1.058 . . . . 2.5800000000000001 109.803 174.283 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.455 HD23 ' CZ ' ' A' ' 20' ' ' PHE . 2.2 mm? -82.56 145.88 29.49 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 107.378 -1.342 . . . . 2.5899999999999999 107.378 172.499 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.3 m -121.02 164.47 16.71 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 125.179 1.392 . . . . 4.2300000000000004 107.815 -169.183 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.7 p -68.94 -36.16 72.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 O-C-N 120.707 -1.245 . . . . 2.6299999999999999 112.193 -167.819 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -69.26 -48.84 60.65 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 107.551 -1.277 . . . . 1.99 107.551 179.648 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -44.74 -54.66 6.04 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.911 0.884 . . . . 1.95 111.021 171.396 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -51.22 -57.03 9.89 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.67 -0.695 . . . . 2.7599999999999998 110.498 177.637 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.536 ' HE3' HD12 ' A' ' 56' ' ' LEU . 17.0 ttmt -59.52 -42.02 91.28 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.249 0.477 . . . . 3.8199999999999998 111.874 179.785 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -56.83 -39.7 74.69 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.277 -0.89 . . . . 2.48 110.452 176.946 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -63.41 -47.33 82.41 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 108.024 -1.102 . . . . 2.0899999999999999 108.024 -174.846 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.53 -54.24 27.76 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 N-CA-C 109.995 -0.372 . . . . 0.88 109.995 -179.103 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 92.3 m -50.0 -48.31 52.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.745 1.218 . . . . 1.1299999999999999 110.877 -179.717 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -76.74 -45.41 29.31 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.35 0.66 . . . . 2.3999999999999999 110.862 -174.643 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -135.01 10.67 3.58 Favored 'General case' 0 C--N 1.343 0.311 0 N-CA-C 116.527 2.047 . . . . 3.5099999999999998 116.527 -161.214 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -120.47 69.89 16.25 Favored Pre-proline 0 N--CA 1.469 0.517 0 CA-C-N 121.133 1.788 . . . . 1.8700000000000001 109.567 164.1 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.28 -39.86 9.39 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 123.242 2.628 . . . . 1.8 111.391 -178.171 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -97.95 -50.38 4.43 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 118.476 0.58 . . . . 3.8300000000000001 109.749 -177.442 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.53 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 0.9 OUTLIER -55.47 -64.56 0.81 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 121.361 0.601 . . . . 1.79 111.673 -167.914 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.402 ' C ' ' H ' ' A' ' 52' ' ' ASP . 84.6 mt -116.99 56.52 0.81 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.861 1.265 . . . . 2.9700000000000002 108.375 -171.326 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.3 31.94 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.262 1.425 . . . . 5.21 112.776 171.394 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . 0.402 ' H ' ' C ' ' A' ' 50' ' ' LEU . 33.5 t70 -110.88 29.45 7.75 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 127.899 2.48 . . . . 4.8700000000000001 108.174 -175.376 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 27.7 m -56.93 -30.02 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 123.588 0.755 . . . . 2.75 111.758 -173.215 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -56.91 -38.29 83.62 Favored Glycine 0 CA--C 1.532 1.154 0 N-CA-C 111.277 -0.729 . . . . 2.3900000000000001 111.277 174.058 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.8 m -110.86 46.69 1.04 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.299 1.839 . . . . 2.0600000000000001 109.054 178.759 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . 0.536 HD12 ' HE3' ' A' ' 39' ' ' LYS . 3.0 tm? -77.39 -50.54 12.53 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.561 1.144 . . . . 1.21 110.127 171.809 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -64.6 -37.15 86.58 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.426 -0.796 . . . . 5.0099999999999998 110.694 -162.999 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.59 -40.74 84.04 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.749 0.82 . . . . 4.0099999999999998 111.664 167.705 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -49.66 77.02 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 107.524 -1.287 . . . . 2.9500000000000002 107.524 173.789 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.57 -52.19 31.76 Favored 'General case' 0 C--O 1.226 -0.18 0 N-CA-C 109.183 -0.673 . . . . 2.3399999999999999 109.183 177.996 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -55.0 -45.37 75.05 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 122.395 0.278 . . . . 3.5099999999999998 110.651 177.178 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.8 t -60.57 -41.76 95.27 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 122.081 -0.387 . . . . 2.4399999999999999 111.776 179.717 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.5 mp -70.43 -53.15 17.59 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 118.515 0.598 . . . . 1.6899999999999999 110.042 177.959 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -73.44 75.5 1.42 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.71 0.804 . . . . 2.0 109.342 179.079 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 25.8 m -50.34 -27.67 4.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 124.211 1.004 . . . . 2.23 112.591 179.322 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -77.42 -30.74 53.6 Favored 'General case' 0 CA--C 1.529 0.16 0 O-C-N 121.933 -0.48 . . . . 2.3199999999999998 111.505 179.106 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 58.39 52.86 6.79 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.868 1.267 . . . . 4.6200000000000001 109.534 -163.382 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.6 p30 -108.98 -13.25 14.76 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.676 1.991 . . . . 2.5699999999999998 112.617 -179.362 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.6 m 74.71 2.99 4.17 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.486 1.914 . . . . 2.27 114.161 -176.136 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -86.0 115.95 23.92 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 105.936 -1.876 . . . . 4.1299999999999999 105.936 152.949 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.27 84.28 7.15 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 102.576 -3.12 . . . . 1.4199999999999999 102.576 154.26 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.36 155.0 15.52 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 107.774 -1.195 . . . . 5.3799999999999999 107.774 177.727 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -39.83 -54.69 2.09 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.009 0.924 . . . . 5.2999999999999998 112.337 -175.685 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -65.08 -31.95 73.41 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.692 0.797 . . . . 3.0 113.041 -179.833 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -70.03 -60.95 1.98 Allowed 'General case' 0 C--O 1.233 0.191 0 N-CA-C 108.377 -0.972 . . . . 2.0099999999999998 108.377 174.712 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -49.64 -44.09 47.32 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 124.864 1.266 . . . . 3.0299999999999998 111.065 -178.588 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.408 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.6 OUTLIER -40.02 -40.79 1.11 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 116.235 -1.841 . . . . 5.0800000000000001 110.125 178.977 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.76 -44.33 3.2 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 121.758 2.072 . . . . 6.4500000000000002 111.85 -178.267 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . 0.478 ' O ' HD13 ' A' ' 83' ' ' LEU . 12.4 tp -53.3 -49.38 67.11 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.502 1.046 . . . . 0.85999999999999999 111.371 179.663 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 60.7 mt -73.65 -37.4 49.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 125.536 1.534 . . . . 1.71 108.1 -174.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -42.98 -58.32 3.76 Favored Glycine 0 N--CA 1.44 -1.036 0 N-CA-C 109.66 -1.376 . . . . 1.5600000000000001 109.66 165.165 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 46.3 mm-40 -79.91 -36.05 37.0 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 127.607 2.363 . . . . 2.4199999999999999 110.153 -160.928 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.53 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 4.9 mp -39.19 -54.93 1.73 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.938 0.895 . . . . 2.4500000000000002 110.252 170.014 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.13 -24.85 66.58 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.341 1.056 . . . . 1.04 113.449 -178.518 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' A' ' 82' ' ' GLU . 16.7 ttpp -82.76 -50.59 8.52 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.731 1.213 . . . . 1.53 110.737 173.14 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -56.4 -40.18 74.23 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 125.666 1.586 . . . . 2.7599999999999998 111.852 -174.542 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 10.3 tt -44.68 -29.07 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 N-CA-C 113.291 0.849 . . . . 1.5 113.291 175.376 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -101.76 -63.01 1.19 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.546 0.739 . . . . 4.4299999999999997 109.785 166.995 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.9 tttt . . . . . 0 CA--C 1.533 0.292 0 N-CA-C 113.892 1.071 . . . . 3.3799999999999999 113.892 -164.356 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 CA--C 1.549 0.922 0 CA-C-O 118.72 -0.657 . . . . 2.6600000000000001 111.519 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 5.2 t -90.54 -174.97 4.29 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.336 1.054 . . . . 2.1899999999999999 113.581 -173.65 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -46.77 -73.9 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.287 2.235 . . . . 3.2200000000000002 112.67 -172.872 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 25.9 mt -55.42 -37.67 67.97 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 121.236 -0.915 . . . . 1.22 111.297 179.359 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -59.76 -36.22 76.22 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 122.779 0.432 . . . . 3.6899999999999999 111.013 173.572 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -66.13 -46.99 75.58 Favored 'General case' 0 C--N 1.344 0.351 0 O-C-N 120.135 -1.603 . . . . 3.9900000000000002 109.155 172.077 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -56.27 -42.8 78.03 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.099 0.559 . . . . 1.3400000000000001 110.287 -175.778 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.263 2.5 pp -70.6 -42.7 78.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 O-C-N 121.622 -0.674 . . . . 0.96999999999999997 111.033 171.721 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -54.71 -42.41 71.47 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.607 1.094 . . . . 4.3399999999999999 112.07 179.127 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.1 t -63.18 -31.6 72.79 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.109 -0.994 . . . . 1.23 112.096 -177.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 m -80.15 -36.76 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 O-C-N 120.899 -1.125 . . . . 0.95999999999999996 109.916 173.866 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 58.8 t -57.77 -45.0 87.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 C-N-CA 122.937 0.495 . . . . 1.1399999999999999 110.343 176.235 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 14.1 t -67.85 -40.42 83.67 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.699 0.682 . . . . 1.27 110.729 177.988 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 51.5 m -55.64 -52.29 64.3 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-N 119.038 0.835 . . . . 1.1299999999999999 108.891 174.076 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -48.41 -55.63 10.31 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.229 1.411 . . . . 4.5199999999999996 111.318 171.887 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -56.33 -56.65 18.48 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.05 0.94 . . . . 3.0899999999999999 109.554 -175.262 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 36.7 p -61.61 -44.79 96.35 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.256 0.622 . . . . 2.3199999999999998 110.705 -177.576 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -57.64 -61.38 2.55 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.533 1.133 . . . . 5.4299999999999997 111.008 177.376 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.8 -19.6 51.65 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.668 1.987 . . . . 1.22 111.678 176.656 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . 2.318 0.0 OUTLIER -46.68 -19.1 0.08 Allowed 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 127.956 2.502 . . . . 5.2400000000000002 113.481 162.368 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -52.07 -64.06 0.94 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 114.101 1.149 . . . . 2.1899999999999999 114.101 -175.838 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -73.68 -31.6 63.52 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 116.512 2.041 . . . . 5.3499999999999996 116.512 -154.63 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.22 -111.35 0.43 Allowed Glycine 0 CA--C 1.53 1.013 1 C-N-CA 132.384 4.802 . . . . 3.98 116.075 9.579 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 49.5 ttt85 53.75 98.49 0.01 OUTLIER 'General case' 0 C--O 1.237 0.4 0 C-N-CA 126.512 1.925 . . . . 4.29 112.25 -175.9 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.32 -39.24 93.51 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 121.061 0.458 . . . . 5.0899999999999999 111.109 177.329 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -75.06 2.33 10.9 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 113.109 0.781 . . . . 3.9300000000000002 113.109 -171.02 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 1.6 m -154.93 144.21 21.15 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 118.956 0.798 . . . . 2.8100000000000001 110.657 -177.309 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . 0.428 HD13 ' CG ' ' B' ' 76' ' ' TYR . 4.8 mp -131.64 141.31 49.59 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.164 0.985 . . . . 2.7799999999999998 108.932 178.645 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 8.2 t -108.67 177.24 4.84 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.662 0.744 . . . . 3.02 109.773 168.628 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 10.3 p -84.44 53.77 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.118 0 CA-C-O 122.283 1.039 . . . . 2.5099999999999998 109.878 177.044 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -155.99 54.33 0.58 Allowed 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 104.825 -2.287 . . . . 3.1499999999999999 104.825 149.387 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -163.56 -60.42 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 102.403 -3.184 . . . . 2.3300000000000001 102.403 175.882 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -41.26 -58.08 1.93 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.53 1.132 . . . . 2.9399999999999999 113.602 -179.129 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 11.9 ttmm -54.78 -30.55 57.1 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.456 0.702 . . . . 2.5699999999999998 112.42 -179.277 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -65.0 -25.5 67.89 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 121.083 -1.011 . . . . 3.04 110.898 -173.707 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.69 -49.54 62.23 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.27 0.941 . . . . 2.6200000000000001 108.92 179.272 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 15.3 m -66.67 -38.16 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 115.337 -0.847 . . . . 0.80000000000000004 109.142 -175.704 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 72.5 m -63.53 -54.37 37.31 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.767 0.827 . . . . 0.96999999999999997 111.323 175.503 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -80.79 -62.33 1.7 Allowed 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 112.199 0.444 . . . . 2.25 112.199 -164.424 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -80.94 -43.72 19.32 Favored 'General case' 0 C--O 1.226 -0.148 0 O-C-N 122.144 -0.348 . . . . 2.48 110.687 -170.677 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 6.6 mp -81.71 -18.89 0.27 Allowed Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 119.171 3.026 . . . . 2.48 119.171 -161.523 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -52.05 89.56 0.03 OUTLIER 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.396 2.731 . . . . 3.1200000000000001 114.104 -145.787 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 154.36 -65.06 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 129.656 3.182 . . . . 3.9500000000000002 106.579 -175.098 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 52.7 tp -49.13 -73.37 0.04 OUTLIER 'General case' 0 C--O 1.235 0.304 0 C-N-CA 123.649 0.78 . . . . 1.0700000000000001 109.445 -164.801 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.3 mt -74.01 131.85 41.78 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.002 -1.851 . . . . 2.02 106.002 147.029 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.49 168.46 12.55 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 104.333 -2.469 . . . . 6.5599999999999996 104.333 167.864 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . 0.408 ' OD2' ' NZ ' ' B' ' 59' ' ' LYS . 8.8 t0 61.3 84.21 0.14 Allowed 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 124.493 1.12 . . . . 3.5600000000000001 108.349 -152.599 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 27.3 m -89.13 4.15 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 CA-C-N 114.061 -1.427 . . . . 1.6299999999999999 109.712 165.649 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.79 -71.48 1.27 Allowed Glycine 0 C--N 1.341 0.854 0 N-CA-C 108.215 -1.954 . . . . 2.3500000000000001 108.215 -173.55 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 1.5 t -77.01 64.17 2.44 Favored 'General case' 0 CA--C 1.528 0.096 0 C-N-CA 125.518 1.527 . . . . 2.6099999999999999 107.671 177.583 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -75.25 -27.74 59.59 Favored 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 126.35 1.86 . . . . 0.98999999999999999 108.845 178.235 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -42.24 -48.84 4.98 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.256 1.822 . . . . 4.3300000000000001 112.143 170.336 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -45.87 -54.4 8.2 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.369 1.468 . . . . 3.2599999999999998 110.723 174.872 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . 0.455 ' H ' ' HE2' ' B' ' 59' ' ' LYS . 1.6 mppt? -67.93 -55.51 12.48 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 107.363 -1.347 . . . . 3.9300000000000002 107.363 -177.912 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -40.87 -56.17 2.29 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 125.207 1.403 . . . . 2.02 110.966 -179.973 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -61.27 -42.04 97.96 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 117.8 0.273 . . . . 2.77 111.404 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 21.4 m -59.44 -32.1 69.9 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.065 0.394 . . . . 1.51 112.065 176.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 mp -76.65 -57.2 3.99 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.463 0.574 . . . . 2.1200000000000001 111.076 172.134 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -59.63 -16.19 24.32 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.348 1.859 . . . . 1.74 113.557 -162.397 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.7 m -32.01 -26.33 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 129.848 3.259 . . . . 1.51 119.007 -132.885 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -54.3 -31.32 53.77 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 120.497 1.499 . . . . 2.5099999999999998 111.314 159.025 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 70.57 68.89 0.2 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.814 1.246 . . . . 2.9500000000000002 111.077 166.44 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 41.5 p30 -121.14 -7.23 9.4 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.845 1.258 . . . . 1.8899999999999999 112.497 -177.816 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 18.8 m 72.13 15.48 5.46 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.239 1.415 . . . . 2.1400000000000001 112.789 -176.567 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -115.76 106.19 13.57 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 127.152 2.181 . . . . 3.9399999999999999 107.386 164.778 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -83.49 90.12 7.17 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 106.505 -1.665 . . . . 0.97999999999999998 106.505 167.004 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 31.3 pttt -84.75 174.2 10.08 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.049 0.94 . . . . 4.2300000000000004 111.37 179.078 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 23.3 p90 -84.67 49.35 1.69 Allowed 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.75 1.019 . . . . 5.5099999999999998 113.75 -168.424 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -172.03 58.36 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.529 1.531 . . . . 2.9500000000000002 108.866 116.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -87.11 -59.13 2.34 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 106.758 -1.571 . . . . 2.0499999999999998 106.758 124.182 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . 0.428 ' CG ' HD13 ' B' ' 33' ' ' LEU . 53.7 t80 -42.27 -50.94 4.92 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 125.51 1.524 . . . . 3.2200000000000002 115.044 -168.333 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.444 ' C ' ' CD1' ' B' ' 77' ' ' TRP . 0.0 OUTLIER -45.88 -35.39 4.5 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-O 117.918 -1.039 . . . . 4.6399999999999997 109.621 -177.835 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 8.0 mmt180 -35.77 -55.26 0.72 Allowed 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 117.66 -1.162 . . . . 3.8900000000000001 111.087 -178.159 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.4 tp -48.31 -46.98 36.94 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 120.276 1.398 . . . . 0.83999999999999997 112.203 -177.369 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 64.3 mt -72.87 -39.75 59.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 C-N-CA 125.154 1.382 . . . . 1.8700000000000001 107.965 -176.965 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -45.93 -53.19 9.08 Favored Glycine 0 N--CA 1.446 -0.638 0 CA-C-O 122.908 1.282 . . . . 2.3300000000000001 110.864 170.254 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -75.3 -47.77 26.28 Favored 'General case' 0 N--CA 1.438 -1.029 0 C-N-CA 126.734 2.014 . . . . 3.4700000000000002 107.199 -166.847 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mp -38.85 -47.15 1.38 Allowed 'General case' 0 C--N 1.34 0.171 0 C-N-CA 125.305 1.442 . . . . 2.0899999999999999 111.138 172.929 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -45.61 -46.16 14.22 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.448 -0.787 . . . . 1.76 111.379 178.548 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.453 0.0 OUTLIER -83.74 -34.72 24.8 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 116.285 1.957 . . . . 2.0099999999999998 116.285 166.033 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -59.45 -18.92 43.59 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 121.215 1.825 . . . . 3.8500000000000001 113.052 -176.593 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 6.9 tp -41.51 -51.54 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 O-C-N 121.894 -0.504 . . . . 1.76 110.732 163.468 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -86.22 -48.69 8.33 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.681 1.593 . . . . 4.4000000000000004 113.441 171.137 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 46.2 tttp . . . . . 0 CA--C 1.537 0.475 0 C-N-CA 124.476 1.11 . . . . 4.3200000000000003 111.991 -163.853 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 . . . . . 0 CA--C 1.539 0.547 0 N-CA-C 108.116 -1.068 . . . . 5.7300000000000004 108.116 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -72.71 88.34 0.91 Allowed 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 122.814 2.343 . . . . 3.3900000000000001 110.066 -175.908 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 87.6 mt -64.3 137.02 57.7 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 107.36 -1.348 . . . . 1.4199999999999999 107.36 170.912 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.9 t -65.47 169.07 6.42 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.403 -0.591 . . . . 1.9399999999999999 109.403 176.72 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.1 tt0 -59.23 -48.28 82.22 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 121.586 0.708 . . . . 3.7000000000000002 109.561 -175.896 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.4 mp -57.98 -45.7 86.32 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 118.245 -0.883 . . . . 1.6399999999999999 110.267 -179.307 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -57.81 -53.33 59.48 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.09 0.956 . . . . 2.1200000000000001 111.34 174.824 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.84 -49.35 75.69 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 108.827 -0.805 . . . . 5.1900000000000004 108.827 -176.1 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 70.7 p -68.81 -44.42 73.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.097 -0.501 . . . . 1.3300000000000001 110.994 -175.141 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.483 HG21 HD12 ' B' ' 83' ' ' LEU 0.257 2.5 pp -63.59 -36.94 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 C-N-CA 118.441 -1.304 . . . . 0.81000000000000005 109.809 176.797 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -59.04 -50.37 74.35 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.462 1.028 . . . . 3.2200000000000002 110.187 173.031 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.73 -38.34 78.16 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.366 0.603 . . . . 1.29 111.921 -175.143 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 10.8 m -78.27 -36.98 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 O-C-N 120.54 -1.35 . . . . 0.77000000000000002 111.012 174.302 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 t -59.01 -41.89 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-N 119.427 1.012 . . . . 0.78000000000000003 110.481 177.359 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.6 t -65.22 -41.88 93.97 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.015 0.825 . . . . 0.92000000000000004 110.466 176.604 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 22.4 m -61.98 -47.83 83.05 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.659 0.663 . . . . 0.92000000000000004 109.907 177.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -48.45 -56.77 7.36 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 124.449 1.1 . . . . 3.1899999999999999 109.883 169.075 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -62.72 -45.44 92.75 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.338 0.655 . . . . 3.9500000000000002 111.737 -171.467 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.24 -25.88 68.06 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 122.269 -0.269 . . . . 2.23 110.775 179.823 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -80.2 -39.64 28.79 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 118.354 0.524 . . . . 2.5699999999999998 112.262 164.798 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.94 -37.67 64.1 Favored 'General case' 0 C--O 1.24 0.553 0 O-C-N 120.122 -1.611 . . . . 1.02 110.497 -174.747 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -21.07 66.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.25 1.42 . . . . 4.8700000000000001 113.302 -179.841 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.0 -66.07 0.45 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 119.849 1.204 . . . . 2.52 111.561 -168.713 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -123.39 151.82 42.19 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 127.148 2.179 . . . . 3.25 109.858 -168.333 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 41.63 62.54 1.89 Allowed Glycine 0 CA--C 1.523 0.589 0 C-N-CA 124.207 0.908 . . . . 2.0299999999999998 112.941 153.772 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . 0.457 10.7 mpt_? 85.54 112.1 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.558 1.318 . . . . 6.2000000000000002 114.558 175.757 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -67.14 49.87 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 128.605 2.762 . . . . 3.8399999999999999 114.522 -177.796 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.86 -54.46 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 108.626 -0.879 . . . . 4.3600000000000003 108.626 -165.294 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -82.71 131.19 35.21 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 127.403 2.281 . . . . 2.1499999999999999 107.72 175.907 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -97.97 129.64 44.86 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.297 0.639 . . . . 2.6000000000000001 109.606 -175.807 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.9 t -82.58 161.86 22.13 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 125.663 1.585 . . . . 2.8399999999999999 109.603 177.64 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.4 p -57.46 -39.71 70.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 116.212 -0.449 . . . . 2.54 109.927 167.919 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -69.91 -57.14 5.39 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-O 117.823 -1.084 . . . . 1.8400000000000001 108.977 -178.186 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 63.9 mt-10 -39.0 -49.61 1.72 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 119.07 0.85 . . . . 1.77 112.12 169.91 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -57.71 -52.15 66.63 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 122.011 -0.43 . . . . 2.6899999999999999 110.723 175.006 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 48.1 tttt -57.23 -38.13 73.3 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.715 -0.616 . . . . 2.5 111.261 -179.959 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -55.43 -34.91 64.86 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.278 0.49 . . . . 2.96 111.376 177.193 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -65.07 -53.78 40.24 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.294 -1.002 . . . . 2.5800000000000001 108.294 -178.096 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.2 m -66.86 -40.91 86.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-N 115.318 -0.856 . . . . 0.97999999999999998 109.71 -173.458 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.3 m -60.9 -53.74 53.59 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.288 1.035 . . . . 1.3200000000000001 110.533 176.001 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -71.11 -48.0 54.79 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 119.188 -0.434 . . . . 2.3700000000000001 111.282 -170.128 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -154.21 85.85 1.15 Allowed 'General case' 0 C--N 1.34 0.166 0 CA-C-N 118.644 0.656 . . . . 4.9699999999999998 111.492 177.776 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 tp -157.62 59.02 1.59 Allowed Pre-proline 0 CA--C 1.543 0.696 0 CA-C-N 117.988 0.358 . . . . 1.8500000000000001 111.602 161.454 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -65.85 -54.61 0.52 Allowed 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 124.103 3.202 . . . . 2.3300000000000001 113.865 -166.394 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -107.66 41.31 1.54 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 119.295 0.952 . . . . 3.9500000000000002 110.066 -169.671 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.475 HD23 HD22 ' A' ' 83' ' ' LEU . 1.1 mp -126.31 -98.78 0.4 Allowed 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 106.727 -1.583 . . . . 1.6100000000000001 106.727 -178.416 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 87.6 mt -90.06 55.99 3.29 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.119 -0.988 . . . . 2.6000000000000001 109.365 -168.183 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 157.57 14.49 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.658 -0.701 . . . . 4.9199999999999999 110.925 -179.528 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 84.25 41.57 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 128.045 2.538 . . . . 4.5599999999999996 110.193 -170.01 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.3 m -72.4 26.29 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 124.389 1.076 . . . . 2.23 113.556 -177.425 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -74.02 -76.85 0.67 Allowed Glycine 0 CA--C 1.522 0.478 0 N-CA-C 105.86 -2.896 . . . . 1.5 105.86 166.475 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 10.7 m -71.19 54.57 0.19 Allowed 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 127.276 2.23 . . . . 2.8399999999999999 112.114 176.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -57.04 -28.54 62.63 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 125.302 1.441 . . . . 1.1499999999999999 109.866 175.554 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -46.6 -33.43 4.16 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 125.121 1.368 . . . . 4.21 112.565 170.032 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -50.19 -60.88 2.53 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.035 -1.098 . . . . 4.04 108.035 172.884 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.7 -38.81 73.69 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.059 -0.973 . . . . 3.7000000000000002 109.47 -172.969 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -49.64 -56.79 8.77 Favored 'General case' 0 CA--C 1.528 0.126 0 N-CA-C 109.389 -0.597 . . . . 1.3899999999999999 109.389 175.04 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -63.42 -36.53 84.05 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 111.549 0.203 . . . . 3.46 111.549 178.945 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.1 m -59.36 -32.53 70.2 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.821 -0.549 . . . . 1.95 112.45 174.063 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 17.7 mt -87.47 -51.67 5.79 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 125.307 1.443 . . . . 1.53 111.679 -175.709 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -75.22 69.42 2.07 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.616 1.167 . . . . 1.52 109.83 -173.695 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 16.4 m -51.36 -42.71 28.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 124.47 1.108 . . . . 1.9199999999999999 113.711 -168.992 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -84.22 -6.62 59.42 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.273 0.488 . . . . 2.0299999999999998 112.245 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . 0.306 0.0 OUTLIER 51.25 59.95 4.23 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.646 1.979 . . . . 4.4699999999999998 113.448 179.365 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.0 p30 -101.6 -9.39 21.0 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.259 1.423 . . . . 1.8300000000000001 111.44 175.91 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . 0.295 15.7 p 80.9 -0.54 1.8 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 127.751 2.42 . . . . 2.6299999999999999 114.234 -174.831 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -110.33 124.68 52.11 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.204 1.002 . . . . 3.0499999999999998 108.345 173.064 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -84.7 97.77 9.84 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 106.071 -1.825 . . . . 0.94999999999999996 106.071 168.084 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.3 pttt -69.65 162.8 26.95 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.542 1.065 . . . . 6.1299999999999999 109.32 173.095 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -38.46 -52.61 1.57 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.695 1.198 . . . . 5.29 113.429 -173.051 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.08 -45.49 85.04 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.858 0.463 . . . . 1.5 111.174 -179.212 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -60.0 -45.43 92.77 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.673 -0.492 . . . . 1.8899999999999999 109.673 178.915 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -66.01 -45.15 82.57 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 118.558 -0.734 . . . . 2.8500000000000001 110.458 177.581 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.53 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -42.8 -47.13 5.44 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-O 117.133 -1.413 . . . . 5.2699999999999996 107.239 173.499 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . 0.581 ' HB3' HH11 ' A' ' 78' ' ' ARG . 13.4 mtp-105 -39.16 -45.76 1.36 Allowed 'General case' 0 C--O 1.213 -0.829 0 CA-C-O 117.368 -1.301 . . . . 3.5800000000000001 111.364 -177.422 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.5 tp -45.12 -56.94 4.25 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 120.226 1.375 . . . . 1.1000000000000001 112.319 174.526 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.7 mp -61.81 -40.69 87.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 C-N-CA 126.949 2.1 . . . . 1.6200000000000001 107.761 179.636 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -44.98 -54.89 6.66 Favored Glycine 0 CA--C 1.528 0.858 0 N-CA-C 109.761 -1.336 . . . . 2.1200000000000001 109.761 170.707 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -74.27 -38.9 63.3 Favored 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 127.266 2.226 . . . . 2.7000000000000002 107.727 -169.193 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.475 HD22 HD23 ' A' ' 49' ' ' LEU . 11.3 mt -52.85 -43.17 65.86 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 119.365 0.984 . . . . 2.21 110.912 178.869 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.49 -25.0 59.09 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.833 0.679 . . . . 1.6499999999999999 112.833 176.829 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -83.78 -57.15 3.33 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.908 1.683 . . . . 1.5600000000000001 111.498 168.716 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -57.33 -26.34 60.79 Favored 'General case' 0 N--CA 1.465 0.306 0 O-C-N 120.826 -1.171 . . . . 3.8599999999999999 112.841 -175.604 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.0 tp -42.5 -33.24 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 C-N-CA 124.626 1.17 . . . . 1.9399999999999999 112.284 168.913 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.1 -5.7 5.53 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.122 0.969 . . . . 6.1500000000000004 112.785 174.39 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 26.8 tttp . . . . . 0 CA--C 1.542 0.644 0 CA-C-N 119.666 1.121 . . . . 3.4100000000000001 113.424 176.233 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.546 0.806 0 CA-C-O 118.886 -0.578 . . . . 2.8999999999999999 110.338 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 3.2 t -86.77 -171.88 3.73 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.334 1.054 . . . . 1.9199999999999999 113.149 -170.397 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -55.16 -67.04 0.31 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.786 1.634 . . . . 2.3300000000000001 112.837 -170.97 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 20.5 mt -53.13 -42.21 65.82 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.265 -0.897 . . . . 1.4199999999999999 111.32 176.234 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -57.45 -42.4 82.42 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 119.454 -0.308 . . . . 3.1699999999999999 110.443 177.415 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.7 -49.58 75.9 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 124.536 1.134 . . . . 4.0300000000000002 110.148 175.066 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 76.0 p -67.33 -25.88 66.22 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 118.895 -0.574 . . . . 1.55 112.151 -174.58 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.287 2.7 pp -80.32 -32.56 13.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 119.219 0.918 . . . . 1.26 111.268 165.844 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -58.46 -53.42 58.47 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 119.553 1.069 . . . . 2.9700000000000002 110.808 175.406 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 8.2 t -48.47 -45.13 36.31 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 119.59 1.086 . . . . 1.1799999999999999 111.557 -174.013 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 33.3 m -69.96 -34.25 59.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 O-C-N 121.113 -0.992 . . . . 0.90000000000000002 111.577 177.917 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 59.1 t -63.14 -52.32 60.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 118.883 0.765 . . . . 0.93999999999999995 110.224 173.353 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 8.9 t -60.72 -43.01 98.37 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.547 1.067 . . . . 1.04 110.557 179.009 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 54.9 m -57.72 -49.23 77.22 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.388 -0.82 . . . . 1.0900000000000001 110.768 174.251 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -48.68 -53.51 18.47 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 121.512 -0.742 . . . . 3.9100000000000001 110.191 170.209 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -59.32 -47.83 83.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.442 1.097 . . . . 2.54 110.969 -173.331 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -61.55 -47.43 85.58 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 119.876 -0.73 . . . . 2.6299999999999999 109.909 178.38 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -59.2 -35.16 73.12 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 120.849 -1.157 . . . . 2.8700000000000001 111.828 173.584 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.11 -34.77 79.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 120.926 -1.109 . . . . 1.02 109.601 -179.875 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -18.53 64.79 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 117.566 -1.207 . . . . 4.0499999999999998 113.159 -177.86 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.4 ' HB3' ' HG3' ' B' ' 37' ' ' GLU . 0.7 OUTLIER -49.17 -66.73 0.35 Allowed 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 114.113 1.153 . . . . 2.1499999999999999 114.113 -155.921 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -92.54 -79.69 0.39 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.361 0.875 . . . . 3.2999999999999998 113.361 -172.762 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.79 170.61 30.89 Favored Glycine 0 C--N 1.34 0.764 0 C-N-CA 128.792 3.091 . . . . 1.8799999999999999 111.611 160.527 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.9 mmt85 46.69 96.85 0.01 OUTLIER 'General case' 0 C--O 1.241 0.621 0 C-N-CA 124.843 1.257 . . . . 3.5600000000000001 113.724 146.781 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -76.69 52.88 0.85 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.937 0.895 . . . . 3.5600000000000001 111.198 173.239 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -147.59 -64.78 0.27 Allowed 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 105.256 -2.128 . . . . 4.0899999999999999 105.256 179.182 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 26.0 p -78.34 139.38 38.82 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.942 -1.026 . . . . 2.04 109.855 -178.533 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.82 128.42 36.16 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 106.883 -1.525 . . . . 2.6099999999999999 106.883 159.156 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 6.5 t -82.46 -170.13 2.79 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.37 1.468 . . . . 2.8599999999999999 108.496 163.707 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 85.1 t -67.03 -98.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 130.183 3.393 . . . . 2.6299999999999999 101.969 -174.113 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -71.7 77.92 0.84 Allowed 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 121.364 1.893 . . . . 2.6800000000000002 108.313 178.546 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.4 ' HG3' ' HB3' ' B' ' 26' ' ' GLN . 1.8 tt0 -163.3 -56.84 0.04 OUTLIER 'General case' 0 N--CA 1.444 -0.755 1 C-N-CA 132.155 4.182 . . . . 1.8 102.752 177.849 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -63.36 -52.78 60.29 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.061 -0.972 . . . . 2.0899999999999999 109.01 170.359 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 9.8 ttmm -55.95 -37.1 68.56 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 119.677 -0.809 . . . . 2.7799999999999998 110.333 -176.217 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -56.2 -38.03 70.44 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.839 0.681 . . . . 2.7599999999999998 112.839 175.528 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -62.97 -51.66 65.99 Favored 'General case' 0 C--O 1.231 0.106 0 N-CA-C 108.083 -1.08 . . . . 2.5499999999999998 108.083 -178.784 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 12.6 m -68.85 -48.66 69.52 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-N 115.861 -0.608 . . . . 0.70999999999999996 109.726 -172.913 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 47.1 m -53.64 -54.95 30.48 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.991 0.916 . . . . 0.92000000000000004 110.931 175.662 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -77.18 -56.4 4.6 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 122.362 -0.211 . . . . 1.8999999999999999 110.745 -168.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -80.91 -50.75 9.37 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.552 0.945 . . . . 3.0499999999999998 113.552 -164.97 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.23 -21.28 0.74 Allowed Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 115.022 1.49 . . . . 2.2200000000000002 115.022 -157.014 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -62.98 -11.56 25.27 Favored 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 121.59 -2.254 . . . . 1.9399999999999999 111.467 -74.407 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -107.39 -37.01 6.34 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 125.512 1.525 . . . . 2.4900000000000002 110.993 -174.884 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . 0.452 ' CD2' HD13 ' B' ' 83' ' ' LEU . 28.5 tp -47.39 -46.3 25.96 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 124.313 1.045 . . . . 1.3999999999999999 111.765 -172.432 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.2 mt -108.27 131.05 55.1 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 105.696 -1.965 . . . . 1.74 105.696 153.641 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -105.37 -175.09 2.69 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 125.609 1.564 . . . . 5.7999999999999998 109.15 -178.403 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.25 3.7 p30 44.5 47.25 8.32 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 125.227 1.411 . . . . 4.6299999999999999 110.917 178.731 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -52.85 -14.84 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 C-N-CA 128.082 2.553 . . . . 2.8399999999999999 113.589 -178.587 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -48.61 -59.58 6.51 Favored Glycine 0 CA--C 1.531 1.063 0 N-CA-C 110.197 -1.161 . . . . 2.3500000000000001 110.197 162.835 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 23.2 t -73.97 39.49 0.11 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 128.212 2.605 . . . . 2.6499999999999999 113.15 -169.244 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -67.77 -31.66 71.7 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 125.786 1.634 . . . . 1.0900000000000001 110.131 -178.393 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -43.75 -52.64 6.45 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.604 1.562 . . . . 4.3300000000000001 112.602 177.795 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -40.43 87.3 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.625 1.102 . . . . 4.1100000000000003 111.17 -176.308 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -62.05 -58.99 5.75 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.866 -0.791 . . . . 4.6600000000000001 108.866 172.12 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -44.48 -50.74 9.29 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 119.112 0.869 . . . . 1.6499999999999999 111.4 -179.118 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 10.9 tptp -55.3 -46.03 76.24 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.284 1.033 . . . . 4.0800000000000001 111.333 177.052 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 20.0 m -71.79 -29.06 64.05 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.54 0.736 . . . . 1.4399999999999999 112.356 179.783 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 65.6 mt -81.3 -57.91 3.28 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.857 1.263 . . . . 1.2 111.212 -175.935 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -57.68 -10.96 1.8 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.797 2.039 . . . . 1.8400000000000001 115.773 -166.047 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 30.2 m -35.9 -25.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 130.618 3.567 . . . . 1.8799999999999999 119.173 -130.92 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 21.6 p-10 -61.71 -24.62 66.91 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 120.846 1.657 . . . . 3.3399999999999999 110.645 169.051 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 65.7 65.07 0.55 Allowed 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.711 2.005 . . . . 4.8499999999999996 112.047 176.067 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 35.7 p30 -109.48 -8.57 15.0 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.664 1.986 . . . . 2.3999999999999999 110.542 176.798 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.5 m 63.66 16.24 9.55 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.304 1.041 . . . . 1.8799999999999999 113.402 -170.384 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -108.62 101.08 10.26 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 105.861 -1.903 . . . . 3.1499999999999999 105.861 158.377 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.82 94.97 0.34 Allowed 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 105.026 -2.213 . . . . 1.54 105.026 166.482 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 46.5 tptt -83.14 162.42 21.3 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.999 0.519 . . . . 5.3600000000000003 111.007 -155.009 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -83.11 64.4 7.65 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 109.044 -0.725 . . . . 4.2199999999999998 109.044 162.413 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -163.97 51.67 0.14 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 115.66 -2.416 . . . . 5.1900000000000004 113.303 82.397 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 -85.85 -53.06 5.34 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 126.855 2.062 . . . . 2.2400000000000002 108.213 153.035 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -40.9 -43.2 2.02 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 127.571 2.348 . . . . 3.5299999999999998 113.077 -169.523 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.512 ' C ' ' CD1' ' B' ' 77' ' ' TRP . 0.0 OUTLIER -39.09 -48.51 1.69 Allowed 'General case' 0 C--N 1.343 0.29 0 O-C-N 124.124 0.89 . . . . 4.54 109.078 178.031 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -38.8 -46.39 1.26 Allowed 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 124.127 0.971 . . . . 4.9199999999999999 112.948 -168.477 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 5.4 tp -57.59 -46.24 84.27 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.943 1.247 . . . . 0.85999999999999999 112.966 178.534 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 15.7 mt -66.04 -41.42 89.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 106.95 -1.5 . . . . 2.02 106.95 177.596 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -43.64 -56.6 4.89 Favored Glycine 0 N--CA 1.44 -1.064 0 N-CA-C 108.739 -1.744 . . . . 1.8 108.739 171.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -69.32 -61.66 1.7 Allowed 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 125.567 1.547 . . . . 2.2000000000000002 108.803 -171.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.483 HD12 HG21 ' A' ' 13' ' ' ILE . 4.5 pp -53.18 -29.92 34.54 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 111.802 0.297 . . . . 1.95 111.802 -171.79 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -51.12 -48.22 61.8 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.988 1.107 . . . . 1.51 113.988 169.148 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.27 0.0 OUTLIER -77.18 -39.8 47.59 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 119.781 1.173 . . . . 1.77 111.743 172.286 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -55.84 -34.01 65.02 Favored 'General case' 0 C--N 1.339 0.117 0 CA-C-O 118.36 -0.829 . . . . 2.9399999999999999 112.715 -166.37 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 10.0 tt -42.65 -45.75 1.16 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 118.749 0.704 . . . . 0.93000000000000005 111.363 173.381 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 63.8 ttt-85 -83.67 -43.78 15.21 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.097 0.959 . . . . 3.8999999999999999 111.684 172.464 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 45.2 tttt . . . . . 0 CA--C 1.536 0.44 0 N-CA-C 114.682 1.364 . . . . 6.1799999999999997 114.682 -144.032 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 . . . . . 0 CA--C 1.541 0.618 0 N-CA-C 109.719 -0.474 . . . . 5.4699999999999998 109.719 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.87 142.33 62.37 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.392 1.395 . . . . 2.23 108.662 171.335 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.7 mt -111.6 -173.86 2.34 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.562 0.745 . . . . 1.4099999999999999 110.086 -169.158 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.2 t -91.09 151.34 21.04 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.331 0.652 . . . . 2.0099999999999998 110.202 -178.542 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -37.2 -54.52 1.02 Allowed 'General case' 0 C--N 1.339 0.134 0 C-N-CA 125.998 1.719 . . . . 2.1299999999999999 113.456 -177.353 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.1 mt -63.7 -47.32 81.65 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 117.739 -1.125 . . . . 1.78 110.392 -175.857 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.21 -61.15 2.14 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.713 1.205 . . . . 4.9699999999999998 110.392 170.044 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -48.7 -51.23 29.7 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.195 0.998 . . . . 3.77 109.318 -178.359 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 81.3 p -62.5 -48.42 79.63 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.626 0.602 . . . . 1.72 112.626 179.783 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' ILE . . . . . 0.456 HG21 HD12 ' B' ' 83' ' ' LEU 0.309 2.7 pp -60.42 -41.66 88.27 Favored 'Isoleucine or valine' 0 C--N 1.344 0.362 0 CA-C-N 119.459 1.027 . . . . 0.95999999999999996 110.537 179.685 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -60.41 -53.05 62.24 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 119.261 -0.976 . . . . 2.8700000000000001 109.234 173.962 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -53.62 -36.78 62.38 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.81 0.67 . . . . 1.3300000000000001 112.81 -174.849 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.3 m -78.52 -45.2 26.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-N 119.311 0.96 . . . . 0.98999999999999999 111.156 172.8 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 45.5 t -57.47 -40.75 76.39 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.333 0 CA-C-O 118.553 -0.737 . . . . 1.02 110.834 -176.891 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.0 t -59.61 -48.05 83.2 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 119.729 1.15 . . . . 0.94999999999999996 110.335 176.027 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.7 m -53.19 -59.23 4.81 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 109.005 -0.739 . . . . 1.01 109.005 175.147 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -59.11 -43.52 91.91 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 112.052 0.39 . . . . 7.8899999999999997 112.052 -176.127 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -61.18 -53.97 50.25 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 125.515 1.526 . . . . 3.6899999999999999 110.409 -178.605 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 40.0 p -57.3 -50.51 72.69 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.074 -0.713 . . . . 2.3500000000000001 109.074 177.07 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.89 -47.04 64.75 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-O 121.637 0.732 . . . . 3.1699999999999999 111.63 176.806 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.65 -17.16 45.71 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 126.55 1.94 . . . . 1.1000000000000001 111.973 -178.041 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -24.12 67.59 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 117.657 -1.163 . . . . 4.9100000000000001 111.351 171.598 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -42.61 -62.45 0.98 Allowed 'General case' 0 C--N 1.346 0.431 0 C-N-CA 124.378 1.071 . . . . 2.1600000000000001 112.082 -174.056 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -122.44 173.17 7.83 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 127.816 2.446 . . . . 2.5899999999999999 107.606 -177.271 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -22.36 133.33 0.01 OUTLIER Glycine 0 CA--C 1.533 1.201 0 C-N-CA 127.458 2.456 . . . . 1.3700000000000001 115.348 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.1 mtt85 64.47 103.49 0.03 OUTLIER 'General case' 0 C--O 1.239 0.503 0 C-N-CA 125.319 1.448 . . . . 5.29 111.907 179.509 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.38 58.25 0.39 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.194 1.398 . . . . 5.04 112.015 173.424 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 57.4 p-10 -170.94 -45.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 126.109 1.764 . . . . 3.2000000000000002 108.61 170.391 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.5 m -84.16 139.87 32.13 Favored 'General case' 0 N--CA 1.444 -0.741 0 C-N-CA 125.152 1.381 . . . . 3.4199999999999999 109.639 -179.379 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -89.8 175.11 7.36 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.44 1.096 . . . . 1.97 108.563 -178.447 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 35.2 m -153.56 170.13 21.55 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 105.845 -1.909 . . . . 2.9900000000000002 105.845 179.365 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.3 p -51.63 -57.75 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 119.873 1.215 . . . . 2.3100000000000001 113.443 -167.001 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -67.03 -47.26 71.97 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.907 -0.405 . . . . 1.7 109.907 -176.419 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -38.62 -51.54 1.64 Allowed 'General case' 0 C--O 1.231 0.12 0 C-N-CA 125.83 1.652 . . . . 1.8300000000000001 110.863 167.839 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.56 -58.05 10.27 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.431 -0.804 . . . . 3.3199999999999998 109.665 176.916 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.9 tttm -53.13 -47.45 68.67 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 118.849 -0.596 . . . . 3.1000000000000001 111.555 -175.106 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -51.36 -41.58 60.72 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.378 0.535 . . . . 2.2799999999999998 110.986 175.795 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 14.9 tp -64.96 -49.92 68.42 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 119.204 0.911 . . . . 2.6899999999999999 109.028 -174.876 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 2.3 m -70.31 -46.52 71.09 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 CA-C-O 121.519 0.676 . . . . 1.05 109.215 -173.696 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.4 m -59.6 -49.29 78.33 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.79 0.836 . . . . 1.6200000000000001 109.941 179.877 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -81.11 -56.13 4.29 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 118.914 -0.565 . . . . 4.1600000000000001 112.13 -171.527 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.01 39.43 2.55 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.223 0.92 . . . . 5.0800000000000001 113.44 -173.753 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 tp -150.19 70.83 9.26 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-N 119.273 0.942 . . . . 1.8799999999999999 110.231 173.062 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.08 -49.38 1.39 Allowed 'Trans proline' 0 N--CA 1.451 -1.017 0 C-N-CA 123.221 2.614 . . . . 1.8500000000000001 113.084 -165.067 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -120.24 -29.41 4.85 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 118.373 0.533 . . . . 3.0499999999999998 112.082 -167.27 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' LEU . . . . . 0.463 HD23 HD22 ' A' ' 83' ' ' LEU . 13.6 tp -45.43 -62.98 1.05 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.241 1.017 . . . . 1.3 113.242 -170.065 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.3 mt -84.87 -64.13 1.21 Allowed 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 108.186 -1.042 . . . . 3.48 108.186 174.132 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.5 tptm 68.59 157.65 0.14 Allowed 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 124.656 1.182 . . . . 6.6399999999999997 111.665 -170.284 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 59.6 t0 50.13 68.69 0.71 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 123.626 1.679 . . . . 4.5599999999999996 109.145 -147.739 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.7 m -82.64 29.91 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 112.999 -1.91 . . . . 2.2000000000000002 109.893 160.484 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -101.85 -58.43 0.8 Allowed Glycine 0 C--N 1.341 0.823 0 N-CA-C 108.278 -1.929 . . . . 1.6499999999999999 108.278 172.834 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.1 t -74.1 57.14 0.63 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.386 1.474 . . . . 2.1899999999999999 110.682 179.851 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -69.33 -42.53 75.19 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 124.035 0.934 . . . . 1.4299999999999999 109.528 -175.889 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -39.46 -50.31 2.12 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 126.065 1.746 . . . . 4.25 112.961 -179.096 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -52.88 -52.47 57.36 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.596 0.712 . . . . 3.0699999999999998 110.291 176.618 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.59 -38.01 83.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.213 0.605 . . . . 3.3999999999999999 109.549 -177.346 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -55.34 -49.84 71.2 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.506 -0.553 . . . . 1.49 109.506 174.095 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -64.52 -39.01 92.98 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 117.933 0.333 . . . . 3.0800000000000001 111.353 177.04 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.8 m -58.06 -41.82 84.16 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.768 -0.583 . . . . 2.2999999999999998 111.072 174.978 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 36.7 mt -70.0 -68.44 0.42 Allowed 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.881 0.872 . . . . 1.98 109.067 178.363 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -77.46 75.83 4.0 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.801 1.24 . . . . 1.79 110.069 -171.775 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.7 m -46.24 -35.96 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 124.718 1.207 . . . . 1.8700000000000001 113.625 -177.824 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -84.95 -14.62 47.02 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.707 1.203 . . . . 1.9299999999999999 112.879 -178.214 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 51.89 46.64 26.25 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.028 1.331 . . . . 4.2699999999999996 110.805 -176.535 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 35.1 p30 -86.38 -18.5 31.68 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.666 0.787 . . . . 1.9299999999999999 109.909 168.168 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.0 t 71.45 16.06 6.05 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.872 1.669 . . . . 2.7799999999999998 112.743 -178.886 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -120.84 104.92 10.23 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 105.76 -1.941 . . . . 3.8300000000000001 105.76 172.397 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -88.07 92.91 9.32 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.221 -1.399 . . . . 1.1899999999999999 107.221 -174.012 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 33.5 tttt -55.13 160.03 2.27 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 108.878 -0.786 . . . . 6.0899999999999999 108.878 172.385 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -39.77 -57.62 1.51 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.422 1.089 . . . . 5.3099999999999996 112.777 -178.75 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -60.46 -38.25 83.58 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.087 0.555 . . . . 1.8600000000000001 112.01 179.08 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -66.77 -50.55 62.34 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.822 -0.436 . . . . 2.1400000000000001 109.822 -178.024 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -58.88 -43.98 91.03 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 119.818 -0.753 . . . . 6.7699999999999996 109.628 175.778 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' TRP . . . . . 0.611 ' CZ2' ' CE2' ' B' ' 77' ' ' TRP . 3.8 t-105 -48.5 -34.04 10.53 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 117.714 -1.136 . . . . 3.8900000000000001 112.019 -177.142 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.7 mtp85 -39.25 -47.49 1.68 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.726 1.148 . . . . 3.8799999999999999 111.549 174.072 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.1 tp -45.66 -47.45 15.0 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.408 0.683 . . . . 1.0800000000000001 111.164 179.208 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.8 mp -64.08 -21.37 28.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-O 120.874 0.368 . . . . 1.8799999999999999 110.265 -169.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' GLY . . . . . 0.541 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -76.67 -44.69 14.88 Favored Glycine 0 CA--C 1.496 -1.106 0 N-CA-C 109.012 -1.635 . . . . 1.5800000000000001 109.012 179.452 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -63.98 -43.23 96.36 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 105.802 -1.925 . . . . 2.6400000000000001 105.802 -179.53 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' LEU . . . . . 0.463 HD22 HD23 ' A' ' 49' ' ' LEU . 5.5 mt -54.62 -60.28 3.56 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 121.447 -0.783 . . . . 2.7799999999999998 111.71 171.094 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.7 -27.74 63.2 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.281 1.032 . . . . 1.28 112.46 -176.908 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -80.53 -48.77 12.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.5 1.52 . . . . 1.95 110.054 177.202 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -55.46 -45.67 76.88 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 126.038 1.735 . . . . 2.3700000000000001 110.694 -179.967 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.0 tt -63.69 0.3 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 N-CA-C 113.271 0.841 . . . . 1.75 113.271 175.661 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.71 -59.54 1.82 Allowed 'General case' 0 C--O 1.236 0.367 0 O-C-N 120.552 -1.343 . . . . 7.7599999999999998 109.821 162.975 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--N 1.342 0.261 0 N-CA-C 114.339 1.237 . . . . 3.3599999999999999 114.339 -168.812 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 CA--C 1.541 0.599 0 N-CA-C 109.088 -0.708 . . . . 2.4399999999999999 109.088 . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 13.7 t -79.57 -176.62 5.4 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.875 0.87 . . . . 2.2200000000000002 111.828 -166.706 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -62.98 -67.58 0.41 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.491 0.716 . . . . 3.27 112.26 -165.278 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 18.6 mt -50.07 -45.46 52.49 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.03 -1.044 . . . . 1.1599999999999999 111.244 176.139 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -56.93 -37.46 71.52 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.252 1.021 . . . . 3.6899999999999999 111.686 177.123 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.72 -44.21 51.09 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.195 0.998 . . . . 4.1900000000000004 109.241 179.521 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 25.7 t -57.39 -46.95 82.89 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.272 0.629 . . . . 1.7 110.07 -179.031 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.275 2.7 pp -65.98 -18.93 24.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 O-C-N 121.172 -0.955 . . . . 1.78 112.282 174.505 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.38 -56.17 5.16 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.751 1.16 . . . . 3.1699999999999999 110.639 167.496 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.1 t -47.48 -43.91 24.83 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.051 1.296 . . . . 1.3799999999999999 111.422 -169.836 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 15.4 m -69.36 -37.93 76.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 O-C-N 121.562 -0.711 . . . . 1.05 112.128 178.032 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.65 -42.36 95.76 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.133 0.973 . . . . 1.3200000000000001 109.585 175.011 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 18' ' ' THR . . . . . . . . . . . . 0.269 9.8 t -68.26 -36.9 80.14 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 120.774 -1.204 . . . . 1.3500000000000001 111.358 174.69 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.0 m -53.59 -57.52 10.45 Favored 'General case' 0 C--N 1.345 0.382 0 CA-C-N 120.705 1.593 . . . . 1.3999999999999999 109.248 169.632 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -41.59 -55.54 2.87 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.269 1.028 . . . . 4.2599999999999998 110.539 172.503 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -58.28 -53.21 60.81 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.251 1.02 . . . . 2.3799999999999999 111.1 -174.624 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 40.3 p -56.1 -52.9 62.63 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.729 0.411 . . . . 2.3100000000000001 110.893 -178.955 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -61.47 -47.8 84.01 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 118.042 0.383 . . . . 2.8700000000000001 110.632 177.699 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.19 -29.55 61.04 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 126.221 1.809 . . . . 0.98999999999999999 111.271 -176.176 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.16 -15.67 47.7 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 117.951 -1.023 . . . . 3.46 113.038 176.524 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 26' ' ' GLN . . . . . 0.412 ' CB ' ' HG2' ' B' ' 37' ' ' GLU . 1.1 tp-100 -58.13 -65.13 0.69 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 116.131 1.9 . . . . 1.98 116.131 -166.801 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -88.02 -77.88 0.34 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.371 0.532 . . . . 2.98 112.205 -163.199 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.39 164.9 25.94 Favored Glycine 0 C--N 1.339 0.728 0 C-N-CA 128.048 2.737 . . . . 1.8300000000000001 110.609 150.805 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 17.9 mmt85 53.47 98.96 0.01 OUTLIER 'General case' 0 C--O 1.24 0.591 0 N-CA-C 115.326 1.602 . . . . 3.5499999999999998 115.326 135.565 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -72.82 60.68 0.52 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.018 1.727 . . . . 3.3300000000000001 112.261 178.615 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -164.25 -61.24 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 106.716 -1.587 . . . . 4.0199999999999996 106.716 -171.406 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 87.6 p -58.88 138.94 57.09 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 118.008 -0.996 . . . . 2.3199999999999998 109.938 168.774 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 6.5 mp -102.08 101.45 11.81 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.248 -1.019 . . . . 2.4399999999999999 108.248 152.353 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 1.4 p -84.25 176.11 8.96 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.684 1.194 . . . . 2.5099999999999998 108.521 168.841 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 7.8 p -91.6 50.94 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 O-C-N 120.516 -1.365 . . . . 2.5499999999999998 111.492 -170.523 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -156.37 52.78 0.54 Allowed 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 106.376 -1.712 . . . . 2.6400000000000001 106.376 149.254 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 37' ' ' GLU . . . . . 0.412 ' HG2' ' CB ' ' B' ' 26' ' ' GLN . 91.8 mt-10 -158.68 -54.83 0.07 Allowed 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 130.915 3.686 . . . . 1.72 104.046 -178.099 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -62.63 -57.64 10.34 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.801 -1.09 . . . . 2.1400000000000001 109.105 173.683 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -59.13 -41.52 88.42 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 110.061 -0.348 . . . . 2.7599999999999998 110.061 -175.334 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -47.88 -41.94 25.55 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.621 0.6 . . . . 3.54 112.621 170.549 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 tp -63.24 -52.4 62.29 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 119.115 0.871 . . . . 1.9399999999999999 108.807 -175.018 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -68.51 -48.52 71.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.436 -0.802 . . . . 0.63 109.242 -173.307 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 68.2 m -56.67 -54.87 41.09 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 123.909 0.884 . . . . 0.87 111.178 177.34 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -80.68 -59.38 2.7 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 117.792 0.269 . . . . 2.48 111.627 -170.375 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -81.3 -48.51 11.9 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 112.404 0.52 . . . . 3.1099999999999999 112.404 -160.075 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mp -64.77 -24.43 1.21 Allowed Pre-proline 0 CA--C 1.534 0.361 0 N-CA-C 113.727 1.01 . . . . 2.3700000000000001 113.727 -164.178 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.79 -10.72 18.0 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.027 -2.072 . . . . 1.6399999999999999 112.365 -82.837 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 70.1 t60 -95.98 -34.95 11.59 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.02 1.328 . . . . 2.52 111.15 179.761 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 33.5 tp -55.08 -66.6 0.38 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-N 119.014 0.824 . . . . 1.03 110.313 -169.078 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 80.3 mt -92.14 156.33 17.42 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 105.984 -1.858 . . . . 2.0600000000000001 105.984 152.186 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.45 -166.19 2.35 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 106.42 -1.696 . . . . 6.0599999999999996 106.42 -170.945 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 57.53 33.38 23.19 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 122.651 1.215 . . . . 4.7000000000000002 109.456 -177.356 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 21.1 m -56.71 -29.98 31.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 125.756 1.622 . . . . 1.99 111.328 -166.564 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -41.78 -46.38 4.87 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 123.688 0.661 . . . . 2.9300000000000002 111.737 172.869 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 2.4 t -93.7 19.72 8.35 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.626 0.77 . . . . 2.6800000000000002 112.48 -174.389 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -42.65 -41.65 3.18 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 124.313 1.045 . . . . 1.0700000000000001 111.201 178.693 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -34.58 -44.54 0.21 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.05 2.14 . . . . 4.2199999999999998 113.722 173.569 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -65.11 -43.16 92.91 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.001 -1.062 . . . . 3.6699999999999999 110.844 178.074 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? -65.67 -44.94 84.75 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 118.539 -0.743 . . . . 4.2300000000000004 109.283 177.431 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -47.15 -53.55 12.71 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 119.196 0.907 . . . . 1.8899999999999999 109.651 170.628 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -61.38 -39.26 90.0 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 122.182 -0.324 . . . . 3.6299999999999999 111.568 -178.531 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 32.4 t -61.52 -41.96 98.1 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.846 0.859 . . . . 1.5600000000000001 111.754 173.852 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 33.9 mt -77.94 -53.52 7.36 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 124.305 1.042 . . . . 1.51 110.254 -171.606 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.256 17.9 t0 -59.41 -8.88 1.98 Allowed 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 127.011 2.124 . . . . 1.4199999999999999 116.535 -164.09 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.0 m -33.76 -19.26 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 C-N-CA 131.111 3.764 . . . . 1.45 119.414 -131.66 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -58.39 -28.2 64.96 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 120.962 1.71 . . . . 3.0099999999999998 111.321 158.083 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 59.42 62.34 1.8 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.427 1.491 . . . . 3.9100000000000001 110.991 175.401 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -103.18 -15.34 16.05 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.202 1.801 . . . . 1.96 111.591 175.21 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 11.8 m 73.79 21.92 2.62 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.783 1.633 . . . . 2.04 113.464 -175.254 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -129.52 109.7 11.25 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 125.36 1.464 . . . . 3.5 107.592 162.135 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -77.77 106.38 9.56 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.847 -1.168 . . . . 1.05 107.847 176.931 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 12.0 ptmt -85.54 -178.46 6.68 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 126.551 1.94 . . . . 3.8999999999999999 112.115 -174.803 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -75.65 82.55 2.65 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 124.591 1.156 . . . . 3.8300000000000001 108.284 -172.539 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 96.53 47.79 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.314 1 C-N-CA 133.554 4.742 . . . . 2.25 108.295 178.088 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -89.63 -60.93 1.81 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 107.934 -1.136 . . . . 1.9399999999999999 107.934 120.467 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -38.71 -53.67 1.63 Allowed 'General case' 0 C--N 1.344 0.358 0 C-N-CA 127.049 2.14 . . . . 3.4500000000000002 111.529 -174.172 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 77' ' ' TRP . . . . . 0.611 ' CE2' ' CZ2' ' A' ' 77' ' ' TRP . 43.0 t90 -43.4 -38.42 2.75 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 125.989 1.716 . . . . 4.0999999999999996 112.42 -171.292 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -38.85 -48.66 1.57 Allowed 'General case' 0 C--N 1.342 0.25 0 C-N-CA 123.866 0.866 . . . . 5.2300000000000004 111.746 174.988 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 6.0 tp -52.12 -48.05 65.01 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.033 0.533 . . . . 0.89000000000000001 111.504 -177.271 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 64.5 mt -62.16 -30.68 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 N-CA-C 107.529 -1.285 . . . . 1.3700000000000001 107.529 -178.255 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 81' ' ' GLY . . . . . 0.577 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -69.33 -52.94 19.75 Favored Glycine 0 CA--C 1.496 -1.154 0 C-N-CA 124.894 1.235 . . . . 1.29 111.392 179.965 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -50.54 -63.22 1.19 Allowed 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 107.192 -1.41 . . . . 3.3700000000000001 107.192 174.047 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 83' ' ' LEU . . . . . 0.456 HD12 HG21 ' A' ' 13' ' ' ILE 0.289 4.5 pp -58.98 -34.05 71.38 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.941 0.719 . . . . 1.9399999999999999 112.941 -173.645 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.91 -38.62 73.1 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 118.265 -0.874 . . . . 1.1699999999999999 111.966 174.939 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.315 0.0 OUTLIER -80.39 -41.12 25.2 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-O 116.101 -1.904 . . . . 3.3900000000000001 112.189 166.451 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -45.62 -36.05 4.5 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 121.331 1.878 . . . . 2.6200000000000001 112.914 -169.862 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 10.5 tt -44.05 -50.85 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 CA-C-N 118.316 0.507 . . . . 0.95999999999999996 111.969 171.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.44 -50.18 8.0 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.861 2.464 . . . . 4.1399999999999997 112.613 175.133 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 10.5 tttm . . . . . 0 CA--C 1.531 0.241 0 C-N-CA 126.04 1.736 . . . . 5.96 112.313 -168.68 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.0 mtt . . . . . 0 N--CA 1.474 0.738 0 N-CA-C 108.551 -0.907 . . . . 6.6600000000000001 108.551 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -146.15 170.76 16.06 Favored 'General case' 0 C--O 1.233 0.197 0 N-CA-C 106.202 -1.777 . . . . 3.0899999999999999 106.202 170.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.71 71.47 0.0 OUTLIER 'General case' 0 N--CA 1.454 -0.225 0 C-N-CA 128.189 2.596 . . . . 3.7599999999999998 108.792 -172.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 mp0 -62.82 133.22 95.08 Favored Pre-proline 0 N--CA 1.444 -0.756 0 C-N-CA 126.053 1.741 . . . . 4.2999999999999998 110.457 -168.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.7 Cg_endo -71.62 106.99 2.08 Favored 'Trans proline' 0 N--CA 1.453 -0.902 0 C-N-CA 122.829 2.353 . . . . 2.21 110.757 -174.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.5 mt -66.27 162.75 19.43 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.584 1.154 . . . . 1.24 110.089 172.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 1.9 t -76.31 170.1 16.98 Favored 'General case' 0 C--O 1.226 -0.135 0 O-C-N 121.554 -0.717 . . . . 1.72 109.89 -178.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.8 tt0 -59.56 -50.21 74.79 Favored 'General case' 0 N--CA 1.454 -0.242 0 C-N-CA 123.477 0.711 . . . . 2.0 109.635 -174.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.451 HD12 ' HG2' ' B' ' 45' ' ' GLN . 3.7 mt -62.09 -53.39 56.18 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-O 117.55 -1.214 . . . . 1.5600000000000001 111.696 176.156 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 63.6 mt-10 -47.33 -55.66 8.34 Favored 'General case' 0 N--CA 1.471 0.595 0 C-N-CA 125.163 1.385 . . . . 2.2799999999999998 110.785 177.636 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -49.71 -60.16 3.15 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.435 1.494 . . . . 3.9399999999999999 109.616 173.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.4 p -57.05 -40.5 76.91 Favored 'General case' 0 CA--C 1.538 0.489 0 O-C-N 121.403 -0.811 . . . . 1.6599999999999999 112.239 -175.548 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.295 2.8 pp -69.59 -42.2 80.52 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.215 0 O-C-N 121.819 -0.55 . . . . 0.57999999999999996 110.248 177.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 24.2 tt0 -58.66 -47.65 83.73 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 118.997 0.817 . . . . 3.4700000000000002 109.804 177.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.9 m -46.03 -45.77 16.18 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 125.582 1.553 . . . . 1.8400000000000001 112.745 174.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 32.6 m -79.89 -35.78 16.48 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 O-C-N 120.376 -1.453 . . . . 0.72999999999999998 110.993 177.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 49.2 t -58.47 -44.23 88.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.214 0 CA-C-N 118.779 0.718 . . . . 0.56999999999999995 110.415 176.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.8 t -63.05 -46.53 87.1 Favored 'General case' 0 CA--C 1.533 0.289 0 CA-C-N 119.02 0.827 . . . . 0.62 110.058 177.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 16.2 m -59.33 -49.48 77.65 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 118.293 0.497 . . . . 0.67000000000000004 109.774 179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 12.1 t80 -46.73 -52.07 14.77 Favored 'General case' 0 C--O 1.219 -0.539 0 C-N-CA 124.146 0.978 . . . . 3.52 110.043 168.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 14.9 t80 -57.75 -50.18 74.08 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 118.566 0.621 . . . . 3.3900000000000001 110.21 -174.085 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -55.79 -58.53 7.46 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 122.14 -0.35 . . . . 2.4900000000000002 110.798 174.562 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 48.7 m-85 -62.98 -23.23 67.33 Favored 'General case' 0 C--O 1.218 -0.6 0 N-CA-C 112.377 0.51 . . . . 2.6600000000000001 112.377 -177.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -80.46 -26.58 38.23 Favored 'General case' 0 N--CA 1.449 -0.501 0 O-C-N 120.996 -1.065 . . . . 0.81000000000000005 110.338 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 71.4 ttp85 -80.43 -25.73 38.8 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.888 0.875 . . . . 4.3700000000000001 112.317 -177.505 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -39.06 -60.59 0.85 Allowed 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 125.12 1.368 . . . . 2.2999999999999998 112.974 -178.633 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -118.84 167.5 11.64 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 127.447 2.299 . . . . 2.3700000000000001 106.354 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 0.74 108.73 0.01 OUTLIER Glycine 0 CA--C 1.536 1.383 0 C-N-CA 127.021 2.248 . . . . 1.3100000000000001 115.636 171.463 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 92.6 mtt180 66.13 103.25 0.04 OUTLIER 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 114.928 1.455 . . . . 4.6500000000000004 114.928 165.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 52.5 pttt -62.92 64.71 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 126.816 2.047 . . . . 4.0099999999999998 110.973 166.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -177.2 -30.08 0.01 OUTLIER 'General case' 0 CA--C 1.542 0.637 0 C-N-CA 127.066 2.146 . . . . 3.6099999999999999 110.599 -158.655 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 34.1 t -134.83 148.69 50.23 Favored 'General case' 0 C--O 1.24 0.559 0 O-C-N 121.307 -0.871 . . . . 3.0800000000000001 111.964 166.792 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -83.99 120.04 25.64 Favored 'General case' 0 N--CA 1.448 -0.53 0 C-N-CA 125.501 1.521 . . . . 1.9399999999999999 107.473 165.078 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 16.4 m -84.48 169.6 14.34 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 125.599 1.56 . . . . 3.04 108.176 166.396 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 10.0 p -66.21 -43.64 91.79 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 O-C-N 120.854 -1.154 . . . . 2.0099999999999998 112.215 -170.788 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -64.63 -51.45 62.54 Favored 'General case' 0 C--N 1.341 0.207 0 N-CA-C 108.989 -0.745 . . . . 2.2000000000000002 108.989 -178.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 5.3 mt-10 -37.97 -54.31 1.31 Allowed 'General case' 0 C--O 1.232 0.136 0 C-N-CA 124.965 1.306 . . . . 1.8500000000000001 112.139 166.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -60.21 -51.96 67.33 Favored 'General case' 0 N--CA 1.448 -0.537 0 O-C-N 122.009 -0.432 . . . . 3.0499999999999998 109.849 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 16.2 ttmt -55.46 -39.55 70.49 Favored 'General case' 0 N--CA 1.451 -0.39 0 O-C-N 122.069 -0.394 . . . . 3.71 110.927 -179.121 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.5 mt-10 -55.42 -40.14 71.1 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 118.609 0.64 . . . . 2.5600000000000001 111.851 173.474 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.3 tm? -62.88 -51.17 68.03 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 119.52 1.055 . . . . 2.6000000000000001 108.664 -177.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -69.01 -38.75 78.84 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.258 0 CA-C-N 115.991 -0.55 . . . . 1.0600000000000001 110.169 -175.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 78.0 m -63.15 -42.76 99.51 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 123.666 0.786 . . . . 1.3400000000000001 111.224 175.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 -79.84 -53.81 6.42 Favored 'General case' 0 N--CA 1.453 -0.311 0 CA-C-O 119.283 -0.389 . . . . 2.1400000000000001 110.308 -168.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 36.6 mt-30 -98.0 -127.64 0.16 Allowed 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 109.858 -0.423 . . . . 3.6699999999999999 109.858 171.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.487 HD22 ' H ' ' A' ' 46' ' ' LEU . 3.2 mm? 29.7 59.56 0.84 Allowed Pre-proline 0 CA--C 1.541 0.633 0 C-N-CA 127.268 2.227 . . . . 2.1699999999999999 114.374 -173.52 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.1 Cg_endo -69.31 -42.54 3.77 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 122.488 2.125 . . . . 1.74 111.864 179.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 36.2 t60 -122.96 -20.6 5.75 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 113.618 0.97 . . . . 3.1000000000000001 113.618 -170.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.971 HD23 ' HG ' ' A' ' 83' ' ' LEU . 2.0 mp -64.84 -97.2 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 118.898 0.772 . . . . 1.4199999999999999 111.212 172.7 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 75.5 mt -88.74 71.66 8.71 Favored 'General case' 0 N--CA 1.452 -0.351 0 O-C-N 120.87 -1.144 . . . . 2.27 109.31 -163.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.5 ttmm -56.06 156.03 5.84 Favored 'General case' 0 N--CA 1.443 -0.809 0 CA-C-N 115.155 -0.93 . . . . 6.0099999999999998 110.845 170.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 57.0 t0 57.0 66.06 1.25 Allowed 'General case' 0 N--CA 1.451 -0.411 0 CA-C-O 123.496 1.617 . . . . 4.8200000000000003 109.987 -157.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 22.4 m -68.19 -3.3 2.36 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 112.851 -1.977 . . . . 2.0 111.616 162.244 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -75.4 -55.93 4.89 Favored Glycine 0 C--N 1.343 0.948 0 N-CA-C 108.136 -1.986 . . . . 1.75 108.136 176.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 17.5 t -74.08 52.06 0.43 Allowed 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 125.158 1.383 . . . . 2.1000000000000001 110.61 173.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -72.09 -45.57 60.14 Favored 'General case' 0 N--CA 1.441 -0.889 0 C-N-CA 125.015 1.326 . . . . 1.2 108.339 170.08 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.79 -38.14 74.95 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.561 1.144 . . . . 4.7199999999999998 110.248 -164.411 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -54.07 -55.06 31.06 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.415 1.086 . . . . 3.1600000000000001 111.669 167.778 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.35 -51.36 68.57 Favored 'General case' 0 C--O 1.223 -0.291 0 N-CA-C 107.653 -1.24 . . . . 2.9199999999999999 107.653 179.399 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -46.94 -53.74 11.61 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.441 0.696 . . . . 1.49 110.698 177.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.8 mtmp? -59.56 -26.26 65.23 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 112.91 0.707 . . . . 3.23 112.91 178.045 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 10.2 m -79.76 -48.59 13.35 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 123.951 0.9 . . . . 2.2999999999999998 111.466 178.089 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.4 mp -62.19 -48.82 78.33 Favored 'General case' 0 C--N 1.341 0.209 0 N-CA-C 109.381 -0.6 . . . . 1.6000000000000001 109.381 177.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 13.6 t70 -74.33 73.07 1.83 Allowed 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 107.84 -1.17 . . . . 1.8999999999999999 107.84 179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 20.9 m -49.47 -30.34 4.77 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.457 0 C-N-CA 124.484 1.113 . . . . 1.79 113.09 -173.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.1 p30 -87.33 -21.21 25.85 Favored 'General case' 0 CA--C 1.531 0.236 0 C-N-CA 125.837 1.655 . . . . 2.54 112.645 179.762 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 84.1 mt-30 55.16 50.88 14.24 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.509 1.124 . . . . 3.9199999999999999 109.338 -176.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 34.1 p30 -94.09 -18.05 22.2 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.953 1.701 . . . . 1.9399999999999999 110.612 172.552 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 17.9 m 70.4 17.21 6.98 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.371 1.468 . . . . 1.79 113.453 179.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -107.21 107.75 18.85 Favored 'General case' 0 C--O 1.232 0.154 0 N-CA-C 104.094 -2.558 . . . . 3.79 104.094 155.441 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.57 96.74 8.17 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 103.455 -2.794 . . . . 1.03 103.455 171.202 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.59 162.18 16.07 Favored 'General case' 0 N--CA 1.452 -0.36 0 N-CA-C 107.909 -1.145 . . . . 5.1699999999999999 107.909 176.224 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 92.0 t80 -39.58 -52.49 2.19 Favored 'General case' 0 C--O 1.224 -0.277 0 C-N-CA 123.578 0.751 . . . . 6.6399999999999997 111.628 176.129 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 12.8 t-20 -66.81 -27.58 67.67 Favored 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 113.496 0.924 . . . . 2.6200000000000001 113.496 -176.132 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 52.9 mt-10 -79.73 -56.44 4.28 Favored 'General case' 0 N--CA 1.45 -0.47 0 N-CA-C 107.628 -1.249 . . . . 2.02 107.628 179.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 37.9 t80 -45.5 -50.48 12.74 Favored 'General case' 0 N--CA 1.463 0.178 0 C-N-CA 124.42 1.088 . . . . 3.2599999999999998 111.209 173.003 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.595 ' CH2' ' CH2' ' B' ' 77' ' ' TRP . 2.5 t-105 -39.78 -41.1 1.06 Allowed 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.426 1.89 . . . . 4.1299999999999999 111.77 179.018 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 21.7 mmt180 -39.86 -48.12 2.25 Favored 'General case' 0 C--N 1.342 0.274 0 C-N-CA 123.651 0.781 . . . . 4.4299999999999997 111.599 176.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.2 tp -48.64 -46.18 39.61 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.681 0.793 . . . . 0.88 110.405 -178.13 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 66.8 mt -63.46 -29.36 47.05 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.745 0 N-CA-C 107.913 -1.143 . . . . 1.6200000000000001 107.913 -172.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.488 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -69.98 -45.37 57.34 Favored Glycine 0 N--CA 1.444 -0.813 0 N-CA-C 109.743 -1.343 . . . . 1.54 109.743 179.994 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -68.42 -48.19 65.27 Favored 'General case' 0 N--CA 1.437 -1.096 0 N-CA-C 106.667 -1.605 . . . . 2.5 106.667 -175.896 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.971 ' HG ' HD23 ' A' ' 49' ' ' LEU . 4.3 mp -42.04 -58.92 1.92 Allowed 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 118.613 0.642 . . . . 2.3700000000000001 110.945 166.564 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.99 -19.73 53.96 Favored 'General case' 0 CA--C 1.535 0.39 0 N-CA-C 113.133 0.79 . . . . 1.2 113.133 179.546 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.9 ttmt -80.45 -52.74 7.29 Favored 'General case' 0 CA--C 1.53 0.208 0 C-N-CA 125.757 1.623 . . . . 1.6100000000000001 109.761 174.695 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 28.7 mm-40 -58.43 -29.15 65.9 Favored 'General case' 0 N--CA 1.456 -0.138 0 C-N-CA 127.305 2.242 . . . . 2.6299999999999999 110.962 -171.317 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 6.0 tp -40.59 -38.2 0.48 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.614 0 C-N-CA 124.534 1.134 . . . . 1.6200000000000001 111.766 168.491 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -115.23 -43.73 3.05 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 124.462 1.105 . . . . 5.1600000000000001 111.371 177.304 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 49.0 tttp -75.44 65.66 1.74 Allowed 'General case' 0 C--O 1.223 -0.341 0 C-N-CA 123.765 0.826 . . . . 3.5299999999999998 110.414 177.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 11.8 tttp -69.04 -18.34 64.01 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 121.585 -0.697 . . . . 8.1600000000000001 110.486 165.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.7 ttmt -158.53 -81.87 0.05 Allowed 'General case' 0 C--O 1.236 0.39 0 C-N-CA 125.276 1.43 . . . . 8.2300000000000004 108.721 177.598 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . 2.475 39.9 m-20 137.21 -35.81 0.01 OUTLIER 'General case' 0 N--CA 1.444 -0.743 0 C-N-CA 123.78 0.832 . . . . 5.3600000000000003 109.814 176.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . 2.531 10.4 tt 161.51 -153.13 0.0 OUTLIER 'General case' 0 CA--C 1.552 1.047 1 C-N-CA 139.749 7.219 . . . . 8.1999999999999993 101.532 -15.794 . . . . . . . . 3 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -142.66 144.29 32.7 Favored 'General case' 0 N--CA 1.465 0.277 0 CA-C-N 121.151 1.796 . . . . 10.369999999999999 110.007 174.23 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 19.0 mt 48.43 57.13 0.34 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 N-CA-C 107.363 -1.347 . . . . 10.789999999999999 107.363 -156.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 7.2 ptp85 -79.0 -113.49 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.535 1.134 . . . . 13.869999999999999 110.588 -171.241 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 1.6 tmtm? -176.78 132.64 0.2 Allowed 'General case' 0 C--O 1.237 0.415 0 N-CA-C 104.971 -2.233 . . . . 9.8800000000000008 104.971 -179.785 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . 2.208 31.9 mttm . . . . . 0 C--O 1.251 1.155 0 C-N-CA 129.529 3.132 . . . . 12.859999999999999 113.782 171.27 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 59.0 mmm . . . . . 0 CA--C 1.534 0.355 0 N-CA-C 106.736 -1.579 . . . . 6.4000000000000004 106.736 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.346 . . 61.05 134.74 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 119.0 2.963 . . . . 4.7199999999999998 119.0 156.869 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 79.27 92.48 0.06 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 116.772 2.138 . . . . 4.4299999999999997 116.772 112.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 3.0 mt-10 -164.37 145.7 6.78 Favored Pre-proline 0 CA--C 1.541 0.611 0 C-N-CA 125.167 1.387 . . . . 6.3499999999999996 108.783 161.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 63.5 Cg_endo -81.83 159.31 18.69 Favored 'Trans proline' 0 CA--C 1.538 0.719 0 C-N-CA 124.56 3.506 . . . . 2.3500000000000001 110.234 173.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.526 ' HB3' ' HB3' ' B' ' 10' ' ' GLU . 1.7 mt -150.88 -175.47 5.14 Favored 'General case' 0 CA--C 1.55 0.952 0 N-CA-C 113.884 1.068 . . . . 2.1899999999999999 113.884 -153.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 4.2 t -89.05 -163.72 1.03 Allowed 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 125.316 1.446 . . . . 1.6299999999999999 113.464 173.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -65.14 -67.29 0.45 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 126.98 2.112 . . . . 2.1000000000000001 113.057 -172.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 16.3 mt -57.16 -41.46 79.25 Favored 'General case' 0 N--CA 1.463 0.207 0 O-C-N 120.622 -1.299 . . . . 1.05 109.976 178.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.62 ' HG2' HD22 ' A' ' 49' ' ' LEU . 99.2 mt-10 -49.77 -42.97 47.8 Favored 'General case' 0 CA--C 1.563 1.473 0 C-N-CA 123.794 0.838 . . . . 3.1499999999999999 112.512 167.864 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -61.05 -46.98 88.5 Favored 'General case' 0 N--CA 1.465 0.289 0 O-C-N 119.677 -1.889 . . . . 3.8799999999999999 110.124 172.061 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 54.1 p -61.23 -36.96 81.36 Favored 'General case' 0 CA--C 1.534 0.341 0 O-C-N 121.613 -0.68 . . . . 1.8999999999999999 111.121 -175.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.283 2.9 pp -68.63 -43.05 83.6 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 O-C-N 121.587 -0.696 . . . . 1.04 110.476 171.588 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -57.07 -43.55 82.23 Favored 'General case' 0 CA--C 1.537 0.456 0 CA-C-N 119.263 0.938 . . . . 4.2999999999999998 110.845 179.4 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -66.38 -28.77 68.89 Favored 'General case' 0 CA--C 1.539 0.535 0 C-N-CA 123.1 0.56 . . . . 1.4199999999999999 111.735 -174.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 34.3 m -81.35 -36.84 15.13 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 O-C-N 120.888 -1.132 . . . . 0.93000000000000005 111.276 168.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 39.5 t -56.89 -43.92 81.23 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.238 0 CA-C-N 118.731 0.696 . . . . 1.3 110.688 177.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.6 t -59.49 -50.53 73.58 Favored 'General case' 0 CA--C 1.536 0.42 0 CA-C-N 118.59 0.632 . . . . 1.6499999999999999 110.268 176.672 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.9 m -53.83 -55.03 30.31 Favored 'General case' 0 CA--C 1.532 0.265 0 O-C-N 121.395 -0.816 . . . . 1.05 110.351 177.056 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 8.1 t80 -42.84 -56.7 3.12 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 123.929 0.891 . . . . 4.4199999999999999 110.3 171.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 70.0 t80 -57.01 -52.15 66.42 Favored 'General case' 0 N--CA 1.452 -0.365 0 C-N-CA 122.791 0.436 . . . . 3.6200000000000001 110.996 -177.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 75.7 p -56.64 -32.9 65.79 Favored 'General case' 0 CA--C 1.531 0.24 0 N-CA-C 112.334 0.494 . . . . 2.6200000000000001 112.334 -177.341 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -81.1 -47.2 13.84 Favored 'General case' 0 C--O 1.223 -0.306 0 CA-C-N 118.844 0.747 . . . . 2.71 111.534 171.827 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.32 -40.89 68.41 Favored 'General case' 0 C--N 1.326 -0.438 0 O-C-N 120.769 -1.207 . . . . 1.02 109.854 -175.352 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -67.51 -17.19 64.57 Favored 'General case' 0 N--CA 1.451 -0.378 0 CA-C-O 117.234 -1.365 . . . . 4.75 113.097 -175.379 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -47.75 -60.87 2.26 Favored 'General case' 0 CA--C 1.534 0.353 0 CA-C-N 119.987 1.267 . . . . 2.2200000000000002 114.262 -168.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -79.54 -35.38 39.98 Favored 'General case' 0 CA--C 1.54 0.564 0 N-CA-C 118.65 2.833 . . . . 3.2799999999999998 118.65 -158.442 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -81.6 -92.94 0.52 Allowed Glycine 0 C--N 1.34 0.766 1 C-N-CA 131.448 4.356 . . . . 3.1299999999999999 114.308 7.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.1 mmt-85 49.15 73.12 0.25 Allowed 'General case' 0 C--O 1.237 0.438 0 N-CA-C 107.876 -1.157 . . . . 5.5099999999999998 107.876 -153.43 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 48.9 pttt -78.89 49.78 0.95 Allowed 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.962 1.705 . . . . 3.71 110.949 -175.035 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 8.2 p-10 -161.03 -48.94 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.296 0 C-N-CA 126.73 2.012 . . . . 4.2300000000000004 107.448 -168.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 29.8 m -116.35 140.21 49.58 Favored 'General case' 0 N--CA 1.445 -0.692 0 C-N-CA 124.676 1.19 . . . . 3.0499999999999998 110.956 -174.853 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 6.3 mp -93.59 120.68 34.17 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 124.711 1.204 . . . . 2.3599999999999999 109.249 178.084 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 7.1 m -83.38 171.55 13.38 Favored 'General case' 0 C--N 1.328 -0.364 0 N-CA-C 108.399 -0.963 . . . . 2.4100000000000001 108.399 173.475 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 7.1 p -85.37 51.5 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 O-C-N 120.098 -1.626 . . . . 2.6699999999999999 110.507 177.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -158.53 57.25 0.45 Allowed 'General case' 0 N--CA 1.454 -0.242 0 N-CA-C 106.124 -1.806 . . . . 2.0600000000000001 106.124 157.584 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 7.0 mt-10 -176.29 -57.6 0.01 OUTLIER 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 102.024 -3.324 . . . . 1.5800000000000001 102.024 -167.451 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 3.0 t80 -62.91 -60.73 3.07 Favored 'General case' 0 N--CA 1.449 -0.509 0 CA-C-N 114.914 -1.039 . . . . 2.1800000000000002 110.479 171.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 2.0 ttmp? -58.78 -39.17 80.28 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 109.984 -0.376 . . . . 3.5099999999999998 109.984 -176.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 74.9 mt-10 -54.39 -34.3 60.96 Favored 'General case' 0 N--CA 1.451 -0.396 0 CA-C-O 118.862 -0.59 . . . . 2.5600000000000001 112.428 175.337 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 30.8 tp -67.44 -45.77 75.05 Favored 'General case' 0 C--N 1.338 0.092 0 CA-C-N 119.754 1.161 . . . . 1.9199999999999999 109.045 -177.419 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.557 ' HA ' HD23 ' B' ' 46' ' ' LEU . 5.6 m -68.67 -45.49 81.28 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 N-CA-C 110.009 -0.367 . . . . 0.98999999999999999 110.009 -177.391 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 97.7 m -55.56 -51.15 68.03 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 123.431 0.692 . . . . 1.0900000000000001 111.111 174.682 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 12.6 tt0 -80.04 -57.49 3.61 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 123.094 0.558 . . . . 2.1299999999999999 111.641 -168.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . 0.451 ' HG2' HD12 ' A' ' 9' ' ' LEU . 34.9 tp60 -80.23 -54.21 5.95 Favored 'General case' 0 N--CA 1.454 -0.244 0 N-CA-C 112.817 0.673 . . . . 3.8399999999999999 112.817 -158.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . 0.557 HD23 ' HA ' ' B' ' 42' ' ' VAL 0.269 1.0 OUTLIER -39.37 -49.57 4.81 Favored Pre-proline 0 CA--C 1.537 0.462 0 N-CA-C 116.053 1.872 . . . . 2.4500000000000002 116.053 -136.425 . . . . . . . . 4 4 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 59.1 Cg_endo -84.34 -28.17 1.21 Allowed 'Trans proline' 0 N--CA 1.448 -1.19 0 CA-C-N 120.672 1.276 . . . . 2.71 108.871 -36.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 3.1 t60 -100.82 -37.4 8.71 Favored 'General case' 0 C--N 1.341 0.204 0 C-N-CA 125.291 1.437 . . . . 2.5600000000000001 110.047 -171.335 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.438 HD23 ' HB2' ' B' ' 83' ' ' LEU . 43.9 tp -35.31 -58.95 0.55 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 125.99 1.716 . . . . 2.04 115.235 -171.762 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -122.89 -175.24 3.12 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 108.408 -0.96 . . . . 2.71 108.408 168.396 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.42 ' NZ ' ' OE1' ' B' ' 86' ' ' GLU . 0.0 OUTLIER -150.57 169.88 20.47 Favored 'General case' 0 N--CA 1.447 -0.621 0 C-N-CA 124.97 1.308 . . . . 5.7400000000000002 108.04 -163.39 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 11.7 t0 58.9 67.1 0.96 Allowed 'General case' 0 C--O 1.237 0.396 0 CA-C-O 123.443 1.592 . . . . 4.2400000000000002 109.11 -171.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 16.1 m -83.54 -12.1 11.9 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.531 0 CA-C-N 112.213 -2.267 . . . . 1.79 109.897 164.681 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -64.96 -61.86 5.46 Favored Glycine 0 C--N 1.34 0.803 0 N-CA-C 108.884 -1.686 . . . . 2.4199999999999999 108.884 176.083 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 35.5 t -78.3 57.28 1.86 Allowed 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.943 -1.132 . . . . 2.8199999999999998 107.943 173.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.419 HD23 HG21 ' B' ' 42' ' ' VAL . 2.8 tm? -60.93 -44.29 97.43 Favored 'General case' 0 N--CA 1.449 -0.476 0 O-C-N 119.67 -1.894 . . . . 1.0800000000000001 108.116 173.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -65.03 -24.02 67.37 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 124.256 1.022 . . . . 4.3200000000000003 112.25 -166.637 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 17.8 tt0 -50.95 -60.12 3.42 Favored 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 124.647 1.179 . . . . 2.3500000000000001 109.585 161.592 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -57.47 -51.59 68.82 Favored 'General case' 0 N--CA 1.448 -0.532 0 N-CA-C 108.106 -1.072 . . . . 4.0099999999999998 108.106 177.631 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -44.42 -60.47 1.93 Allowed 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 119.303 0.956 . . . . 1.6699999999999999 110.618 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -61.66 -36.38 80.65 Favored 'General case' 0 CA--C 1.535 0.376 0 O-C-N 122.377 -0.202 . . . . 3.1600000000000001 110.935 -175.328 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 18.5 m -66.24 -32.48 73.92 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 112.4 0.518 . . . . 2.2799999999999998 112.4 175.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 22.0 mt -80.65 -43.8 19.86 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.789 1.236 . . . . 1.54 111.158 -177.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 21.1 t0 -66.45 -7.15 17.63 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 129.905 3.282 . . . . 1.5900000000000001 116.787 -166.52 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 17.1 m -36.95 -19.95 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 C-N-CA 128.629 2.771 . . . . 1.99 117.844 -160.459 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 19.9 m120 -69.12 -1.3 7.4 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 120.689 1.586 . . . . 4.0099999999999998 112.043 170.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 17.4 tp60 82.43 -29.56 0.1 Allowed 'General case' 0 C--N 1.342 0.241 0 C-N-CA 127.613 2.365 . . . . 4.5999999999999996 113.284 161.385 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 18.0 p-10 -50.8 109.16 0.29 Allowed 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.421 -0.955 . . . . 3.3100000000000001 108.421 160.489 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 41.0 p -66.85 66.93 0.06 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.31 1.844 . . . . 2.75 111.469 -179.386 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 27.6 mt-10 -167.03 120.28 0.98 Allowed 'General case' 0 N--CA 1.448 -0.542 0 C-N-CA 128.472 2.709 . . . . 3.0 104.828 -167.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -87.55 97.9 11.1 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 107.514 -1.291 . . . . 1.1299999999999999 107.514 -175.381 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 4.0 tttt -80.25 167.74 19.92 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 122.949 0.5 . . . . 4.0999999999999996 109.691 -165.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -83.15 54.6 2.83 Favored 'General case' 0 CA--C 1.538 0.484 0 O-C-N 121.536 -0.727 . . . . 4.7999999999999998 110.065 175.535 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -167.37 50.73 0.06 Allowed 'General case' 0 CA--C 1.551 0.995 0 C-N-CA 124.879 1.271 . . . . 2.2000000000000002 107.713 111.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -93.21 -60.69 1.73 Allowed 'General case' 0 N--CA 1.451 -0.416 0 O-C-N 119.286 -2.133 . . . . 1.8500000000000001 108.34 140.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.467 ' CZ ' HD11 ' B' ' 80' ' ' ILE . 1.3 t80 -41.37 -50.45 3.79 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 126.135 1.774 . . . . 3.4399999999999999 111.53 -173.621 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.595 ' CH2' ' CH2' ' A' ' 77' ' ' TRP . 25.8 t-105 -39.02 -45.99 1.3 Allowed 'General case' 0 N--CA 1.446 -0.628 0 C-N-CA 125.787 1.635 . . . . 4.8099999999999996 111.78 178.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 40.9 mtt-85 -39.42 -52.4 2.08 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 124.374 1.07 . . . . 5.5800000000000001 111.681 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 11.9 tp -52.17 -42.29 63.3 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 123.399 0.679 . . . . 1.0900000000000001 111.384 -177.476 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.467 HD11 ' CZ ' ' B' ' 76' ' ' TYR . 4.1 mp -62.82 -33.47 60.43 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.822 0 N-CA-C 107.063 -1.458 . . . . 2.9100000000000001 107.063 -175.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.485 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -67.41 -44.03 85.6 Favored Glycine 0 N--CA 1.441 -0.99 0 N-CA-C 110.151 -1.18 . . . . 1.3300000000000001 110.151 -179.885 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.8 mm-40 -68.38 -54.75 15.12 Favored 'General case' 0 N--CA 1.437 -1.077 0 N-CA-C 108.185 -1.043 . . . . 2.3399999999999999 108.185 -176.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.438 ' HB2' HD23 ' B' ' 49' ' ' LEU . 4.6 pp -57.52 -38.1 74.11 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.608 1.095 . . . . 1.9399999999999999 111.924 177.094 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.28 -58.57 7.39 Favored 'General case' 0 C--N 1.341 0.213 0 CA-C-N 118.859 0.754 . . . . 1.6599999999999999 109.912 173.071 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -51.79 -39.33 58.46 Favored 'General case' 0 CA--C 1.536 0.412 0 C-N-CA 125.66 1.584 . . . . 1.49 111.802 177.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.42 ' OE1' ' NZ ' ' B' ' 51' ' ' LYS . 8.6 mm-40 -60.22 -24.15 64.62 Favored 'General case' 0 C--N 1.338 0.072 0 C-N-CA 125.063 1.345 . . . . 3.0899999999999999 111.431 -176.788 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 5.0 tt -52.05 -39.45 26.35 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.537 0 CA-C-N 118.897 0.771 . . . . 0.93000000000000005 109.865 171.14 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 18.4 tpt180 -84.94 -54.46 4.64 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.747 1.219 . . . . 4.7699999999999996 112.916 169.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 72.9 tttt -91.71 141.75 28.34 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.938 0.895 . . . . 5.0 112.397 -159.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . 0.282 16.6 pttp -80.75 -14.29 58.22 Favored 'General case' 0 CA--C 1.545 0.754 0 N-CA-C 115.472 1.656 . . . . 6.5599999999999996 115.472 -178.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 49.4 mtpt 73.93 49.77 0.12 Allowed 'General case' 0 N--CA 1.475 0.788 0 C-N-CA 127.128 2.171 . . . . 8.5099999999999998 106.873 -143.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 26.6 t70 -56.2 -65.91 0.52 Allowed 'General case' 0 N--CA 1.451 -0.394 0 C-N-CA 126.153 1.781 . . . . 6.0199999999999996 110.978 179.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 24.0 tp -126.63 137.71 53.34 Favored 'General case' 0 N--CA 1.436 -1.128 0 N-CA-C 105.649 -1.982 . . . . 7.9100000000000001 105.649 168.712 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.22 140.45 58.87 Favored 'General case' 0 N--CA 1.451 -0.412 0 C-N-CA 124.268 1.027 . . . . 7.0099999999999998 112.128 177.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 2.3 pt -79.0 105.3 8.05 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 C-N-CA 123.074 0.55 . . . . 9.2599999999999998 110.37 176.733 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.58 148.1 26.13 Favored 'General case' 0 N--CA 1.457 -0.086 0 O-C-N 121.355 -0.841 . . . . 7.2599999999999998 109.494 165.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -178.16 136.14 0.17 Allowed 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 105.059 -2.2 . . . . 7.4800000000000004 105.059 -177.414 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.253 1.265 0 N-CA-C 100.825 -3.768 . . . . 6.7000000000000002 100.825 148.054 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.9 mtt . . . . . 0 N--CA 1.472 0.651 0 N-CA-C 106.135 -1.802 . . . . 7.2400000000000002 106.135 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -105.61 174.28 5.95 Favored 'General case' 0 N--CA 1.456 -0.128 0 C-N-CA 124.47 1.108 . . . . 4.8799999999999999 110.091 177.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.09 99.11 0.01 OUTLIER 'General case' 0 N--CA 1.456 -0.143 0 C-N-CA 128.957 2.903 . . . . 3.46 110.092 -178.612 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.4 pt-20 -110.1 100.36 43.41 Favored Pre-proline 0 CA--C 1.538 0.487 0 C-N-CA 125.661 1.584 . . . . 5.9900000000000002 108.357 -176.142 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -71.96 154.98 58.04 Favored 'Trans proline' 0 N--CA 1.456 -0.699 0 C-N-CA 122.306 2.004 . . . . 2.6600000000000001 109.718 -179.304 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 31.7 mt -118.06 176.83 5.03 Favored 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.856 1.262 . . . . 1.4199999999999999 109.414 -169.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.482 HG22 ' CG ' ' A' ' 10' ' ' GLU . 1.0 OUTLIER -74.09 159.03 33.19 Favored 'General case' 0 CA--C 1.535 0.401 0 O-C-N 121.107 -0.996 . . . . 1.8899999999999999 110.077 178.835 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.7 mt-10 -43.4 -56.52 3.53 Favored 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 124.237 1.015 . . . . 3.0499999999999998 112.188 -178.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.8 mt -59.16 -47.38 85.53 Favored 'General case' 0 N--CA 1.451 -0.408 0 CA-C-O 118.178 -0.915 . . . . 1.3100000000000001 110.818 179.964 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.482 ' CG ' HG22 ' A' ' 7' ' ' THR . 83.9 mt-10 -53.08 -50.92 63.42 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 124.354 1.061 . . . . 2.1899999999999999 111.569 176.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.5 mm-40 -54.85 -53.06 60.23 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-O 121.488 0.661 . . . . 4.2300000000000004 110.011 175.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 84.8 p -62.07 -44.03 97.56 Favored 'General case' 0 CA--C 1.534 0.353 0 O-C-N 121.867 -0.521 . . . . 1.6000000000000001 111.69 -174.943 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.452 HG21 HD12 ' B' ' 83' ' ' LEU . 1.8 pp -65.38 -40.6 88.91 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.388 0 CA-C-O 117.695 -1.145 . . . . 0.78000000000000003 110.023 175.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 10.9 tm-20 -51.52 -55.84 16.77 Favored 'General case' 0 CA--C 1.53 0.204 0 CA-C-N 119.779 1.172 . . . . 2.9100000000000001 110.033 175.918 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 4.7 t -58.42 -36.82 74.19 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 112.469 0.544 . . . . 1.3200000000000001 112.469 -171.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.3 m -77.67 -37.2 23.88 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 O-C-N 120.629 -1.294 . . . . 0.71999999999999997 111.148 175.055 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 33.5 t -61.09 -43.55 96.48 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 124.394 1.078 . . . . 0.80000000000000004 110.18 179.845 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -64.87 -49.35 70.86 Favored 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 118.576 0.625 . . . . 0.63 110.339 176.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 39.7 m -53.3 -44.62 68.49 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.307 0.643 . . . . 0.82999999999999996 110.055 176.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -59.89 -61.97 2.22 Favored 'General case' 0 N--CA 1.453 -0.29 0 C-N-CA 124.037 0.935 . . . . 3.2799999999999998 110.512 175.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.9 m-85 -62.52 -41.28 98.75 Favored 'General case' 0 C--O 1.233 0.204 0 O-C-N 121.163 -0.96 . . . . 5.3899999999999997 111.89 -171.053 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.1 t -65.6 -22.13 66.65 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 119.365 -0.35 . . . . 2.2000000000000002 111.247 179.553 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 3.3 m-30 -81.35 -43.09 19.55 Favored 'General case' 0 C--O 1.216 -0.661 0 CA-C-N 118.415 0.552 . . . . 3.0099999999999998 111.059 166.154 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.08 -28.78 62.92 Favored 'General case' 0 C--N 1.326 -0.451 0 C-N-CA 126.304 1.842 . . . . 1.1299999999999999 111.929 -166.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 33.6 ptt85 -66.38 -34.21 77.45 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.365 1.066 . . . . 3.5899999999999999 112.383 177.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -41.18 -60.09 1.33 Allowed 'General case' 0 C--N 1.345 0.401 0 C-N-CA 124.604 1.162 . . . . 2.0499999999999998 112.962 -163.586 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.2 mt-10 -106.05 75.75 1.12 Allowed 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 104.931 -2.248 . . . . 2.9500000000000002 104.931 -178.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 60.21 164.16 0.16 Allowed Glycine 0 CA--C 1.533 1.204 0 C-N-CA 125.449 1.499 . . . . 1.6000000000000001 114.478 178.144 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 95.1 mtt180 28.72 100.38 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 128.104 2.562 . . . . 4.7699999999999996 114.839 165.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 22.9 pttt -69.38 65.06 0.17 Allowed 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.317 1.847 . . . . 3.3700000000000001 112.741 -177.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -169.31 -45.08 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 127.571 2.348 . . . . 3.8199999999999998 108.066 -175.166 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.96 110.92 19.24 Favored 'General case' 0 C--O 1.242 0.659 0 C-N-CA 127.548 2.339 . . . . 1.6799999999999999 110.193 171.66 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 9.9 mp -91.3 124.52 35.56 Favored 'General case' 0 C--O 1.221 -0.423 0 CA-C-O 118.776 -0.631 . . . . 2.5499999999999998 109.549 172.03 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 1.9 t -100.05 -179.88 4.28 Favored 'General case' 0 C--O 1.234 0.284 0 CA-C-O 122.007 0.908 . . . . 2.48 111.109 172.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 19.6 m -57.59 -35.97 52.33 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.411 0 CA-C-N 114.958 -1.019 . . . . 2.9399999999999999 112.923 -167.123 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -73.18 -50.72 21.0 Favored 'General case' 0 C--O 1.223 -0.316 0 N-CA-C 108.373 -0.973 . . . . 2.0699999999999998 108.373 -177.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 62.3 mt-10 -46.09 -48.17 17.11 Favored 'General case' 0 N--CA 1.464 0.227 0 C-N-CA 124.138 0.975 . . . . 1.8600000000000001 110.901 172.327 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.4 t80 -60.17 -58.77 7.08 Favored 'General case' 0 N--CA 1.447 -0.616 0 CA-C-N 115.897 -0.592 . . . . 2.8500000000000001 110.138 177.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.419 ' HA ' HG22 ' A' ' 42' ' ' VAL . 11.0 ttmm -58.0 -37.05 73.55 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 118.243 0.474 . . . . 2.4399999999999999 111.577 -175.526 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.7 mt-10 -53.33 -44.98 68.87 Favored 'General case' 0 N--CA 1.453 -0.317 0 C-N-CA 123.735 0.814 . . . . 3.23 110.547 173.721 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -65.57 -50.28 65.71 Favored 'General case' 0 C--O 1.234 0.248 0 CA-C-N 119.441 1.019 . . . . 2.4399999999999999 108.699 -172.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.419 HG22 ' HA ' ' A' ' 39' ' ' LYS . 31.0 m -62.66 -41.31 91.76 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.281 0 CA-C-N 114.767 -1.106 . . . . 1.3799999999999999 108.782 -173.478 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 96.6 m -62.19 -50.13 73.02 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.102 0.961 . . . . 2.3199999999999998 111.235 172.591 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 17.9 tt0 -62.77 -54.29 41.39 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.219 1.408 . . . . 3.71 111.818 -168.454 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 58.7 mt-30 -149.36 66.86 1.01 Allowed 'General case' 0 N--CA 1.464 0.243 0 CA-C-N 118.185 0.448 . . . . 4.3600000000000003 110.336 -177.483 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.427 ' N ' ' CD ' ' A' ' 47' ' ' PRO . 2.5 tp -155.04 29.13 0.04 OUTLIER Pre-proline 0 CA--C 1.544 0.74 0 N-CA-C 114.049 1.129 . . . . 1.8799999999999999 114.049 173.323 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.427 ' CD ' ' N ' ' A' ' 46' ' ' LEU . 58.8 Cg_endo -64.12 -46.14 8.69 Favored 'Trans proline' 0 C--N 1.351 0.68 0 C-N-CA 122.943 2.429 . . . . 1.76 112.932 -166.082 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.0 t-80 -79.6 -45.53 18.98 Favored 'General case' 0 C--O 1.237 0.396 0 N-CA-C 108.47 -0.937 . . . . 5.1600000000000001 108.47 -179.953 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.553 ' CD2' ' HB2' ' A' ' 83' ' ' LEU . 3.4 tp -66.36 -44.24 83.74 Favored 'General case' 0 N--CA 1.449 -0.497 0 CA-C-N 115.455 -0.793 . . . . 1.55 111.996 -168.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.7 mt -129.16 75.02 1.62 Allowed 'General case' 0 N--CA 1.462 0.137 0 CA-C-N 119.191 0.905 . . . . 2.5699999999999998 109.628 165.243 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.96 157.51 5.67 Favored 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 115.164 -0.926 . . . . 5.2999999999999998 109.64 165.595 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 42.9 t0 61.21 74.05 0.46 Allowed 'General case' 0 N--CA 1.457 -0.114 0 CA-C-O 123.378 1.561 . . . . 4.7699999999999996 108.838 -164.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 17.2 m -76.97 4.38 1.21 Allowed 'Isoleucine or valine' 0 N--CA 1.447 -0.581 0 CA-C-N 113.079 -1.873 . . . . 2.4500000000000002 110.582 163.65 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -78.19 -66.89 1.69 Allowed Glycine 0 C--N 1.341 0.83 0 N-CA-C 107.924 -2.07 . . . . 1.9199999999999999 107.924 179.475 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 29.2 t -76.28 63.36 1.9 Allowed 'General case' 0 C--O 1.235 0.325 0 CA-C-O 123.227 1.489 . . . . 1.8999999999999999 110.23 178.685 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -77.83 -31.42 51.59 Favored 'General case' 0 N--CA 1.44 -0.955 0 C-N-CA 127.978 2.511 . . . . 1.3100000000000001 108.323 174.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -46.41 -51.16 15.57 Favored 'General case' 0 CA--C 1.532 0.285 0 C-N-CA 127.102 2.161 . . . . 4.1200000000000001 112.206 172.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.411 ' OE2' ' NZ ' ' A' ' 94' ' ' LYS . 37.9 tt0 -55.78 -53.97 50.16 Favored 'General case' 0 N--CA 1.45 -0.441 0 N-CA-C 109.436 -0.579 . . . . 2.9199999999999999 109.436 179.787 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -57.4 -48.75 78.26 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 109.119 -0.697 . . . . 3.2999999999999998 109.119 179.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 8.2 ttt -48.89 -53.73 18.33 Favored 'General case' 0 C--O 1.227 -0.099 0 C-N-CA 123.861 0.864 . . . . 2.3199999999999998 109.976 179.193 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 28.7 mtpp -60.19 -45.78 91.97 Favored 'General case' 0 CA--C 1.532 0.285 0 CA-C-O 119.798 -0.144 . . . . 3.1299999999999999 111.003 -178.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 26.6 m -60.67 -41.45 95.1 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 112.291 0.478 . . . . 2.4100000000000001 112.291 177.398 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 29.8 mt -71.39 -56.17 6.51 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 124.178 0.991 . . . . 1.8400000000000001 110.77 -176.139 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.8 t70 -75.09 82.41 2.28 Favored 'General case' 0 N--CA 1.449 -0.497 0 C-N-CA 123.356 0.663 . . . . 2.4199999999999999 109.83 -170.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.9 m -45.04 -39.92 2.11 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.354 0 C-N-CA 124.492 1.117 . . . . 1.6699999999999999 113.548 -173.862 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 23.9 p-10 -97.46 -4.32 38.34 Favored 'General case' 0 CA--C 1.535 0.386 0 N-CA-C 112.93 0.715 . . . . 2.6099999999999999 112.93 -178.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 51.03 50.1 19.81 Favored 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.325 1.85 . . . . 3.3100000000000001 111.243 177.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.9 p30 -82.2 -42.32 19.14 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.468 0.707 . . . . 2.2799999999999998 110.291 176.901 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 7.4 m 99.92 16.56 0.01 OUTLIER 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 129.652 3.181 . . . . 1.74 112.112 -170.436 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 70.8 mt-10 -116.23 108.62 16.35 Favored 'General case' 0 N--CA 1.443 -0.821 0 N-CA-C 105.145 -2.168 . . . . 2.8900000000000001 105.145 161.268 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.5 mm? -79.04 87.42 4.83 Favored 'General case' 0 N--CA 1.442 -0.829 0 N-CA-C 102.312 -3.218 . . . . 1.1599999999999999 102.312 168.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -61.36 145.9 50.0 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.841 -1.541 . . . . 3.3799999999999999 106.841 177.511 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.5 p90 -37.61 -51.78 1.2 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 114.775 1.398 . . . . 5.3899999999999997 114.775 -169.385 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -73.3 -26.5 61.09 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 119.519 1.054 . . . . 1.6699999999999999 112.167 -178.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -63.79 -60.36 3.39 Favored 'General case' 0 C--N 1.341 0.238 0 N-CA-C 108.338 -0.986 . . . . 2.3399999999999999 108.338 164.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 62.7 t80 -50.59 -44.41 56.88 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 123.253 0.621 . . . . 3.1899999999999999 110.604 -175.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.671 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 41.7 t90 -44.32 -38.22 3.78 Favored 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 125.498 1.519 . . . . 4.3200000000000003 111.887 -178.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 13.2 mmt85 -39.72 -46.6 1.9 Allowed 'General case' 0 C--N 1.341 0.238 0 C-N-CA 124.06 0.944 . . . . 4.0099999999999998 111.619 173.075 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 12.7 tp -49.58 -50.59 41.85 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 123.974 0.909 . . . . 0.85999999999999999 111.492 178.813 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.6 mp -64.7 -24.21 35.1 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.608 0 N-CA-C 107.616 -1.253 . . . . 1.75 107.616 -176.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.59 ' CA ' ' CZ2' ' B' ' 77' ' ' TRP . . . -69.79 -55.21 9.94 Favored Glycine 0 CA--C 1.49 -1.525 0 C-N-CA 125.334 1.445 . . . . 1.3200000000000001 111.822 176.255 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -55.69 -47.19 77.21 Favored 'General case' 0 N--CA 1.432 -1.344 0 N-CA-C 107.389 -1.337 . . . . 2.3900000000000001 107.389 -177.476 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.553 ' HB2' ' CD2' ' A' ' 49' ' ' LEU . 4.0 pp -74.09 -39.97 63.05 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 115.098 1.518 . . . . 2.1099999999999999 115.098 -179.685 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.99 -31.95 63.51 Favored 'General case' 0 N--CA 1.462 0.144 0 O-C-N 121.236 -0.915 . . . . 1.2 110.228 170.935 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -79.7 -42.41 24.74 Favored 'General case' 0 N--CA 1.446 -0.667 0 C-N-CA 124.809 1.244 . . . . 1.9299999999999999 111.461 175.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -45.36 -42.15 9.71 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 126.123 1.769 . . . . 2.9300000000000002 110.626 179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.8 tt -46.46 -32.25 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.652 0 C-N-CA 123.697 0.799 . . . . 1.6499999999999999 112.638 178.555 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 14.6 ptm180 -121.93 -18.83 6.88 Favored 'General case' 0 CA--C 1.539 0.532 0 N-CA-C 113.925 1.083 . . . . 4.9400000000000004 113.925 177.431 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 30.4 tttp -77.91 69.17 4.09 Favored 'General case' 0 CA--C 1.534 0.328 0 CA-C-O 123.177 1.465 . . . . 3.3799999999999999 109.139 175.835 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.73 -34.51 0.11 Allowed 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 130.16 3.384 . . . . 11.16 117.258 -167.488 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -158.44 61.53 0.44 Allowed 'General case' 0 N--CA 1.467 0.405 0 N-CA-C 107.234 -1.395 . . . . 8.2899999999999991 107.234 175.809 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . 0.261 7.5 p-10 7.57 -111.12 0.0 OUTLIER 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 128.772 2.829 . . . . 9.8800000000000008 116.616 172.121 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 9.0 tp -97.86 -45.25 6.38 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.144 2.578 . . . . 12.33 108.065 155.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.411 ' NZ ' ' OE2' ' A' ' 58' ' ' GLU . 16.6 mmtt -74.34 -173.56 1.74 Allowed 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 126.159 1.783 . . . . 15.83 110.027 -171.808 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . 0.537 HD13 ' H ' ' A' ' 95' ' ' ILE . 0.1 OUTLIER -120.32 160.82 20.55 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 C-N-CA 124.473 1.109 . . . . 12.109999999999999 108.11 171.219 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 9.8 ttt85 -149.46 -68.27 0.21 Allowed 'General case' 0 CA--C 1.531 0.216 0 C-N-CA 122.919 0.488 . . . . 15.41 109.86 -166.094 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 8.9 tttp 177.01 138.24 0.07 Allowed 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 105.573 -2.01 . . . . 10.57 105.573 -168.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 63.5 pttt . . . . . 0 C--O 1.252 1.194 0 N-CA-C 105.048 -2.204 . . . . 14.76 105.048 150.584 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.069 0 CA-C-O 117.273 -1.346 . . . . 5.9100000000000001 108.449 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 86.94 167.42 0.07 Allowed 'General case' 0 N--CA 1.467 0.392 0 C-N-CA 127.32 2.248 . . . . 6.3399999999999999 113.02 178.218 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.66 100.24 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 130.252 3.421 . . . . 6.2699999999999996 109.431 -166.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -132.43 -78.15 0.01 OUTLIER Pre-proline 0 CA--C 1.555 1.154 0 CA-C-O 117.22 -1.372 . . . . 5.79 114.337 -159.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 93.4 Cg_endo -74.85 156.84 43.67 Favored 'Trans proline' 0 C--N 1.354 0.824 0 C-N-CA 122.869 2.379 . . . . 3.9500000000000002 112.779 -171.203 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.3 mt -141.68 134.41 28.58 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 123.22 0.608 . . . . 2.9700000000000002 110.364 -165.767 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.617 HG22 ' CD ' ' B' ' 10' ' ' GLU . 15.3 t -73.98 -154.35 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 123.543 0.737 . . . . 1.9399999999999999 109.924 156.885 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 43.5 tt0 -84.13 -62.02 1.67 Allowed 'General case' 0 N--CA 1.452 -0.361 0 O-C-N 121.073 -1.017 . . . . 3.1000000000000001 111.866 -164.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 mt -47.08 -43.8 20.58 Favored 'General case' 0 N--CA 1.466 0.361 0 CA-C-N 120.611 1.55 . . . . 1.26 111.715 168.283 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.617 ' CD ' HG22 ' B' ' 7' ' ' THR . 90.6 mt-10 -53.83 -44.58 70.36 Favored 'General case' 0 CA--C 1.553 1.065 0 C-N-CA 124.541 1.136 . . . . 3.0699999999999998 111.676 173.917 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.34 -35.07 63.58 Favored 'General case' 0 CA--C 1.537 0.444 0 O-C-N 120.026 -1.671 . . . . 3.8599999999999999 111.705 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 22.9 t -59.14 -47.19 86.19 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 123.717 0.807 . . . . 1.8100000000000001 110.551 177.438 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.263 2.2 pp -58.05 -37.2 60.24 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.287 0 O-C-N 121.124 -0.985 . . . . 1.1399999999999999 111.522 172.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -58.4 -55.17 38.52 Favored 'General case' 0 N--CA 1.454 -0.266 0 CA-C-N 118.663 0.665 . . . . 2.98 110.137 174.952 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . 0.251 4.0 t -54.2 -33.27 57.83 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.247 0.931 . . . . 1.3700000000000001 112.617 -172.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 33.9 m -78.43 -44.35 26.53 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.291 0 CA-C-N 119.008 0.822 . . . . 1.0800000000000001 111.522 173.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 38.2 t -53.23 -46.74 56.85 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-O 119.025 -0.512 . . . . 1.1399999999999999 110.491 177.423 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 15.3 t -62.38 -45.89 91.08 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 119.15 0.886 . . . . 1.46 111.43 178.752 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 20.4 m -54.82 -50.65 68.06 Favored 'General case' 0 CA--C 1.533 0.298 0 CA-C-N 120.621 1.555 . . . . 1.2 109.788 174.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -55.21 -51.46 66.5 Favored 'General case' 0 N--CA 1.452 -0.356 0 C-N-CA 123.207 0.603 . . . . 7.1299999999999999 110.513 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -64.06 -48.26 76.93 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 126.505 1.922 . . . . 2.73 111.285 -175.823 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 30.4 p -57.36 -53.29 59.82 Favored 'General case' 0 N--CA 1.454 -0.269 0 N-CA-C 109.412 -0.588 . . . . 2.1600000000000001 109.412 176.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 11.5 m-85 -56.1 -39.57 72.36 Favored 'General case' 0 CA--C 1.536 0.424 0 CA-C-N 118.782 0.719 . . . . 3.0699999999999998 111.258 175.286 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.32 -29.23 63.77 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 124.266 1.026 . . . . 1.21 110.851 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 1.2 ppt_? -53.74 -32.0 50.51 Favored 'General case' 0 N--CA 1.455 -0.2 0 CA-C-O 118.105 -0.95 . . . . 4.6399999999999997 111.494 176.696 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -50.16 -65.99 0.47 Allowed 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 116.033 1.864 . . . . 2.2000000000000002 116.033 -143.142 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 71.7 mt-10 -91.72 -74.87 0.49 Allowed 'General case' 0 N--CA 1.453 -0.314 0 CA-C-O 121.846 0.831 . . . . 3.7000000000000002 112.319 -175.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.46 163.73 28.9 Favored Glycine 0 C--N 1.336 0.563 0 C-N-CA 126.898 2.19 . . . . 1.96 111.361 167.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 38.1 ttm180 36.25 102.93 0.0 OUTLIER 'General case' 0 C--O 1.242 0.709 0 C-N-CA 125.675 1.59 . . . . 4.1200000000000001 115.155 142.386 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 65.0 pttt -72.11 34.82 0.06 Allowed 'General case' 0 CA--C 1.534 0.343 0 N-CA-C 115.213 1.56 . . . . 3.3599999999999999 115.213 -173.254 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 16.2 m-20 -147.8 -50.82 0.18 Allowed 'General case' 0 C--N 1.33 -0.246 0 N-CA-C 108.458 -0.942 . . . . 4.0499999999999998 108.458 -167.799 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 20.2 m -87.43 130.68 34.58 Favored 'General case' 0 C--O 1.244 0.777 0 CA-C-N 115.851 -0.613 . . . . 1.96 109.837 173.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -87.11 160.19 18.64 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 125.488 1.515 . . . . 2.4399999999999999 109.186 172.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 7.0 m -154.71 169.51 23.75 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 123.787 0.835 . . . . 2.1800000000000002 109.699 -167.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 2.7 t -83.55 120.36 34.52 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.407 0 N-CA-C 101.503 -3.517 . . . . 3.6899999999999999 101.503 152.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 4.2 t30 -118.1 98.45 6.32 Favored 'General case' 0 C--N 1.331 -0.198 1 C-N-CA 131.944 4.098 . . . . 2.3100000000000001 107.309 9.889 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -155.03 -52.49 0.09 Allowed 'General case' 0 C--N 1.32 -0.676 0 CA-C-N 113.592 -1.64 . . . . 2.4300000000000002 106.852 -175.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 1.8 t80 -59.3 -49.35 78.18 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 114.132 -1.394 . . . . 1.98 108.314 176.148 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 31.7 tttt -58.38 -36.83 74.11 Favored 'General case' 0 C--N 1.342 0.262 0 C-N-CA 120.259 -0.576 . . . . 2.77 110.631 -175.569 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -58.0 -38.83 76.89 Favored 'General case' 0 N--CA 1.448 -0.569 0 N-CA-C 112.512 0.56 . . . . 2.7000000000000002 112.512 176.585 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 7.7 tp -66.75 -47.79 71.15 Favored 'General case' 0 C--O 1.233 0.205 0 CA-C-N 119.207 0.912 . . . . 1.96 108.849 -178.288 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 16.2 m -69.59 -39.01 77.82 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 115.814 -0.63 . . . . 0.71999999999999997 109.536 -172.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 97.8 m -64.21 -60.1 3.61 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 123.446 0.698 . . . . 1.01 110.604 174.9 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -81.83 -57.39 3.45 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.701 0.8 . . . . 1.99 111.939 -166.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 mm-40 -82.47 -40.61 20.89 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 124.709 1.204 . . . . 3.1099999999999999 112.74 -167.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 18.4 tp -81.0 -19.16 0.27 Allowed Pre-proline 0 CA--C 1.538 0.499 0 N-CA-C 116.095 1.887 . . . . 1.97 116.095 -167.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_endo -30.67 -63.26 0.1 Allowed 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 124.82 3.68 . . . . 1.75 116.938 -126.355 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 20.2 t-160 -80.7 -51.26 8.89 Favored 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 118.87 0.759 . . . . 2.1099999999999999 112.799 -162.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.418 HD23 ' HB2' ' B' ' 83' ' ' LEU . 17.5 tp -18.84 -62.82 0.02 OUTLIER 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 127.296 2.238 . . . . 1.72 116.329 -175.156 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 3.2 pp -117.71 145.22 44.58 Favored 'General case' 0 N--CA 1.457 -0.099 0 CA-C-O 121.354 0.597 . . . . 2.5299999999999998 109.438 168.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.22 163.2 18.82 Favored 'General case' 0 N--CA 1.454 -0.232 0 CA-C-N 115.558 -0.746 . . . . 5.7999999999999998 111.054 -173.637 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 61.1 t0 57.35 66.73 1.09 Allowed 'General case' 0 N--CA 1.45 -0.464 0 CA-C-O 124.606 2.146 . . . . 3.73 110.236 172.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 18.3 m -71.82 8.59 0.38 Allowed 'Isoleucine or valine' 0 N--CA 1.441 -0.892 0 CA-C-N 110.486 -3.052 . . . . 1.9099999999999999 111.171 157.26 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -83.59 -55.37 2.87 Favored Glycine 0 C--N 1.343 0.933 0 N-CA-C 108.467 -1.853 . . . . 2.3300000000000001 108.467 179.138 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 17.2 t -69.05 59.16 0.1 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 127.811 2.445 . . . . 2.5499999999999998 109.83 175.664 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -86.16 -29.5 23.2 Favored 'General case' 0 N--CA 1.441 -0.9 0 C-N-CA 124.257 1.023 . . . . 1.1200000000000001 110.348 -172.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -57.75 -46.45 84.47 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 123.845 0.858 . . . . 3.71 110.281 173.59 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 7.9 tt0 -51.51 -60.27 3.33 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.174 0.99 . . . . 2.48 109.832 171.863 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -56.07 -49.05 74.87 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 122.846 0.458 . . . . 3.2400000000000002 109.957 -176.734 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tpt -49.05 -56.84 7.77 Favored 'General case' 0 C--N 1.331 -0.236 0 C-N-CA 126.464 1.906 . . . . 3.04 108.614 178.346 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 61.4 mttm -60.83 -39.73 90.12 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 111.624 0.231 . . . . 3.5699999999999998 111.624 178.624 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.6 t -58.35 -39.05 78.49 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.83 0.452 . . . . 1.6399999999999999 111.322 176.917 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 3.5 mp -74.61 -52.89 10.48 Favored 'General case' 0 CA--C 1.529 0.154 0 O-C-N 121.549 -0.719 . . . . 1.6000000000000001 111.956 174.153 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 19.1 t0 -54.39 -10.9 0.44 Allowed 'General case' 0 CA--C 1.532 0.273 0 N-CA-C 116.939 2.2 . . . . 1.46 116.939 -163.962 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 28.1 m -34.27 -22.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.596 0 C-N-CA 130.591 3.557 . . . . 1.49 118.906 -137.855 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.5 p-10 -57.26 -24.48 55.1 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.669 1.577 . . . . 2.7200000000000002 111.608 163.625 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 5.4 tp-100 69.73 56.62 0.33 Allowed 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.119 1.367 . . . . 3.3700000000000001 110.871 168.358 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 47.2 p30 -110.6 -12.29 14.36 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 125.578 1.551 . . . . 1.79 111.898 177.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 14.2 m 72.96 1.08 3.9 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 126.41 1.884 . . . . 2.0800000000000001 114.154 -174.915 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 9.4 mt-10 -105.14 107.15 17.98 Favored 'General case' 0 C--O 1.235 0.318 0 C-N-CA 125.351 1.46 . . . . 2.98 107.594 169.299 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.4 mm? -80.86 94.86 6.54 Favored 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 107.354 -1.35 . . . . 1.03 107.354 -179.364 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 7.6 ptmt -83.38 175.11 10.09 Favored 'General case' 0 C--O 1.234 0.287 0 C-N-CA 123.03 0.532 . . . . 3.3700000000000001 110.248 -173.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 40.7 p90 -93.76 52.87 1.74 Allowed 'General case' 0 CA--C 1.536 0.409 0 O-C-N 121.616 -0.677 . . . . 4.5499999999999998 111.996 -175.27 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.1 t30 -155.62 49.54 0.54 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.377 -0.971 . . . . 2.46 108.377 112.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -93.32 -62.09 1.44 Allowed 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 107.475 -1.306 . . . . 2.1299999999999999 107.475 142.23 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 7.2 t80 -46.85 -48.28 21.02 Favored 'General case' 0 C--N 1.34 0.193 0 C-N-CA 126.431 1.893 . . . . 4.1200000000000001 112.156 -172.505 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.671 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 7.5 t-105 -40.34 -40.68 1.22 Allowed 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 124.754 1.222 . . . . 4.8300000000000001 111.916 175.662 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 8.3 mtp-105 -39.54 -46.31 1.72 Allowed 'General case' 0 C--N 1.347 0.462 0 C-N-CA 124.11 0.964 . . . . 4.9699999999999998 112.681 177.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.0 tp -54.68 -38.73 67.33 Favored 'General case' 0 N--CA 1.454 -0.237 0 CA-C-O 118.861 -0.59 . . . . 0.80000000000000004 110.922 -176.47 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 68.3 mt -58.66 -38.09 69.45 Favored 'Isoleucine or valine' 0 C--N 1.341 0.224 0 N-CA-C 109.17 -0.678 . . . . 1.4099999999999999 109.17 -177.379 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.575 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -74.2 -42.83 34.41 Favored Glycine 0 CA--C 1.488 -1.655 0 N-CA-C 110.715 -0.954 . . . . 1.25 110.715 -174.264 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . 0.405 ' C ' ' HG2' ' B' ' 86' ' ' GLU . 1.8 mm-40 -64.38 -63.27 1.18 Allowed 'General case' 0 N--CA 1.427 -1.616 0 N-CA-C 104.722 -2.325 . . . . 2.1800000000000002 104.722 179.392 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.452 HD12 HG21 ' A' ' 13' ' ' ILE . 3.4 pp -52.12 -38.97 59.16 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-N 119.069 0.849 . . . . 1.9199999999999999 111.948 -176.068 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.2 -60.04 3.86 Favored 'General case' 0 C--N 1.341 0.212 0 N-CA-C 112.237 0.458 . . . . 1.4099999999999999 112.237 171.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -73.18 -35.15 66.35 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 119.001 0.819 . . . . 1.5700000000000001 111.71 -174.112 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.405 ' HG2' ' C ' ' B' ' 82' ' ' GLU . 0.9 OUTLIER -48.62 -34.21 11.24 Favored 'General case' 0 C--N 1.342 0.258 0 C-N-CA 125.719 1.607 . . . . 2.9300000000000002 110.524 -178.509 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 11.8 tt -39.94 -48.29 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 C-N-CA 123.972 0.909 . . . . 1.0600000000000001 110.839 174.077 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 49.3 ttt180 -85.72 -56.76 3.34 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 125.339 1.455 . . . . 4.1900000000000004 111.692 168.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 18.2 mttt -86.13 58.31 4.98 Favored 'General case' 0 N--CA 1.461 0.11 0 C-N-CA 124.957 1.303 . . . . 7.3499999999999996 112.859 -157.592 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -38.57 -42.69 0.79 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 127.401 2.281 . . . . 5.3200000000000003 114.244 -171.766 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -150.67 44.66 0.85 Allowed 'General case' 0 C--O 1.234 0.244 0 N-CA-C 108.491 -0.929 . . . . 7.2599999999999998 108.491 174.932 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 9.5 m-20 -140.0 70.07 1.36 Allowed 'General case' 0 C--O 1.231 0.1 0 N-CA-C 109.119 -0.697 . . . . 4.3399999999999999 109.119 -159.524 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 1.4 pt? -142.41 -66.3 0.39 Allowed 'General case' 0 CA--C 1.533 0.311 0 N-CA-C 113.929 1.085 . . . . 5.4400000000000004 113.929 -167.888 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 178.97 170.79 0.88 Allowed 'General case' 0 CA--C 1.529 0.149 0 C-N-CA 125.209 1.404 . . . . 9.3300000000000001 108.686 -171.945 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 20.7 tt -145.92 155.14 12.81 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.213 0 C-N-CA 125.85 1.66 . . . . 7.1299999999999999 106.621 176.093 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 5.0 tmm_? -61.93 131.98 51.49 Favored 'General case' 0 CA--C 1.532 0.262 0 N-CA-C 109.872 -0.418 . . . . 8.5500000000000007 109.872 -176.747 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 30.0 mttp -174.66 135.4 0.4 Allowed 'General case' 0 N--CA 1.456 -0.162 0 C-N-CA 128.18 2.592 . . . . 9.8499999999999996 104.488 -176.946 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 9.7 tptp . . . . . 0 C--O 1.253 1.258 0 N-CA-C 103.586 -2.746 . . . . 7.1299999999999999 103.586 -176.077 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.6 ptt? . . . . . 0 N--CA 1.469 0.511 0 CA-C-O 118.753 -0.641 . . . . 11.19 112.011 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -136.6 43.12 2.46 Favored 'General case' 0 C--N 1.339 0.15 0 CA-C-N 118.782 0.719 . . . . 3.3700000000000001 111.808 -178.344 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 75.05 78.15 0.11 Allowed 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 125.501 1.52 . . . . 5.0899999999999999 109.492 168.409 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.0 pm0 -121.74 63.92 16.03 Favored Pre-proline 0 N--CA 1.442 -0.865 0 C-N-CA 124.891 1.276 . . . . 6.0300000000000002 107.625 -173.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -64.02 149.22 90.95 Favored 'Trans proline' 0 N--CA 1.451 -1.002 0 N-CA-C 107.65 -1.711 . . . . 2.23 107.65 172.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -109.53 -164.19 0.92 Allowed 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 108.729 -0.841 . . . . 1.6000000000000001 108.729 -172.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.406 ' HB ' ' HB2' ' A' ' 10' ' ' GLU . 7.3 m -64.93 140.92 58.92 Favored 'General case' 0 C--O 1.223 -0.326 0 O-C-N 120.914 -1.116 . . . . 3.9700000000000002 109.615 177.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.7 tt0 -39.51 -56.52 1.62 Allowed 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 124.159 0.984 . . . . 2.8599999999999999 112.322 173.748 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 65.1 mt -69.62 -38.75 77.36 Favored 'General case' 0 CA--C 1.535 0.386 0 O-C-N 121.257 -0.902 . . . . 1.6399999999999999 112.153 179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.406 ' HB2' ' HB ' ' A' ' 7' ' ' THR . 80.6 tt0 -50.04 -49.45 51.02 Favored 'General case' 0 CA--C 1.54 0.572 0 C-N-CA 124.802 1.241 . . . . 3.1699999999999999 111.16 170.867 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -52.25 -52.11 54.48 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 123.583 0.753 . . . . 4.25 109.077 173.161 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 26.9 p -63.19 -42.37 99.33 Favored 'General case' 0 CA--C 1.536 0.423 0 CA-C-N 116.241 -0.436 . . . . 1.8100000000000001 111.765 -173.622 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.28 2.6 pp -71.1 -36.15 61.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.267 0 O-C-N 121.742 -0.599 . . . . 0.59999999999999998 110.405 179.079 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -55.46 -56.03 24.9 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.122 0.874 . . . . 2.6600000000000001 109.678 172.647 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 7.2 t -58.57 -28.63 65.71 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 119.712 -0.795 . . . . 1.3200000000000001 112.75 -170.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 34.7 m -80.72 -39.56 18.3 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.31 0 O-C-N 121.361 -0.837 . . . . 0.63 111.556 170.976 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.8 t -54.57 -46.89 72.35 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.29 0 CA-C-N 119.267 0.939 . . . . 0.53000000000000003 110.743 175.42 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.5 t -59.25 -46.88 87.31 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 119.715 1.143 . . . . 0.79000000000000004 111.055 176.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 17.6 m -59.63 -39.3 83.83 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.848 0.859 . . . . 0.96999999999999997 110.839 179.067 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -56.63 -61.13 2.64 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.474 0.71 . . . . 3.6400000000000001 109.635 168.608 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 26.4 t80 -62.09 -45.97 91.16 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 123.81 0.844 . . . . 2.7799999999999998 110.801 -164.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -59.79 -33.57 71.89 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.526 -0.306 . . . . 1.99 110.935 179.227 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 1.4 m-85 -76.98 -41.57 42.42 Favored 'General case' 0 C--O 1.22 -0.472 0 O-C-N 121.921 -0.487 . . . . 2.7599999999999998 111.338 173.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.38 -25.76 66.13 Favored 'General case' 0 C--O 1.238 0.486 0 C-N-CA 125.442 1.497 . . . . 0.98999999999999999 111.604 -169.351 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -71.21 -25.18 62.39 Favored 'General case' 0 N--CA 1.451 -0.419 0 CA-C-O 117.079 -1.439 . . . . 3.96 113.329 175.871 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -44.11 -53.82 6.08 Favored 'General case' 0 C--N 1.345 0.401 0 CA-C-N 119.742 1.156 . . . . 1.6899999999999999 112.355 -167.367 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -124.26 170.71 10.5 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 106.422 -1.695 . . . . 2.7000000000000002 106.422 176.042 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -7.87 119.15 0.01 OUTLIER Glycine 0 CA--C 1.537 1.409 0 C-N-CA 127.47 2.462 . . . . 1.8600000000000001 115.972 177.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 75.7 mtp85 60.4 105.33 0.02 OUTLIER 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 125.397 1.479 . . . . 6.1900000000000004 114.885 159.257 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 60.2 pttt -72.56 60.87 0.49 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.467 1.107 . . . . 3.9399999999999999 113.471 177.508 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -147.65 -48.1 0.17 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 129.02 2.928 . . . . 4.8799999999999999 105.419 167.712 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -81.77 117.15 21.84 Favored 'General case' 0 C--O 1.242 0.669 0 C-N-CA 128.141 2.576 . . . . 1.6599999999999999 111.116 174.949 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.402 HD22 ' CD1' ' A' ' 76' ' ' TYR . 6.7 mp -89.27 132.48 34.88 Favored 'General case' 0 C--O 1.224 -0.237 0 C-N-CA 122.661 0.384 . . . . 2.2999999999999998 110.068 164.434 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 29.1 t -82.23 174.67 10.95 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 125.473 1.509 . . . . 2.46 109.313 175.644 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 48.6 t -55.07 -46.34 77.33 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.179 0 N-CA-C 108.893 -0.78 . . . . 2.1800000000000002 108.893 172.412 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 7.3 t-20 -54.8 -62.3 1.75 Allowed 'General case' 0 C--N 1.34 0.179 0 C-N-CA 123.056 0.543 . . . . 4.0499999999999998 109.897 176.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 51.2 mt-10 -49.78 -48.4 50.5 Favored 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 124.435 1.094 . . . . 1.96 110.857 -177.365 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.588 ' CZ ' HD21 ' A' ' 56' ' ' LEU . 3.7 t80 -61.59 -55.89 25.87 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-N 116.197 -0.456 . . . . 2.71 110.567 178.421 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 40.3 tttt -60.14 -38.18 82.3 Favored 'General case' 0 CA--C 1.533 0.309 0 O-C-N 121.549 -0.72 . . . . 2.8599999999999999 111.174 -174.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 96.4 mt-10 -54.74 -34.23 62.22 Favored 'General case' 0 CA--C 1.536 0.441 0 CA-C-O 118.813 -0.613 . . . . 2.5499999999999998 112.087 174.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -63.81 -55.64 21.51 Favored 'General case' 0 C--O 1.234 0.247 0 CA-C-N 119.751 1.16 . . . . 2.6899999999999999 108.407 -177.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.9 m -65.94 -38.56 82.39 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.316 0 CA-C-N 115.042 -0.981 . . . . 1.0600000000000001 109.464 -172.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.8 m -60.84 -52.49 64.84 Favored 'General case' 0 N--CA 1.449 -0.511 0 C-N-CA 123.627 0.771 . . . . 1.2 110.865 174.156 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.2 tt0 -76.25 -51.2 12.52 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.039 0.536 . . . . 2.4900000000000002 111.709 -167.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 41.0 mt-30 -146.02 78.25 1.52 Allowed 'General case' 0 CA--C 1.523 -0.086 0 C-N-CA 123.006 0.522 . . . . 3.5600000000000001 110.1 -175.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.4 tp -153.78 48.99 0.45 Allowed Pre-proline 0 CA--C 1.542 0.644 0 N-CA-C 113.313 0.857 . . . . 1.72 113.313 159.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.4 Cg_endo -68.02 139.81 48.04 Favored 'Trans proline' 0 N--CA 1.454 -0.819 0 C-N-CA 122.793 2.329 . . . . 4.0499999999999998 111.984 -177.696 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 8.1 t-160 76.48 -1.74 2.84 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 125.241 1.417 . . . . 3.9700000000000002 113.681 165.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 11.1 tp -100.47 -92.25 0.29 Allowed 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 124.313 1.045 . . . . 1.3100000000000001 110.565 -175.688 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 28.6 mt -65.74 -42.06 91.43 Favored 'General case' 0 C--N 1.341 0.215 0 CA-C-N 118.283 0.492 . . . . 3.1499999999999999 110.864 -179.169 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.7 mmtt 57.1 -168.59 0.11 Allowed 'General case' 0 C--N 1.344 0.367 0 C-N-CA 123.185 0.594 . . . . 7.1600000000000001 110.869 -160.818 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 24.6 t0 60.39 44.11 12.56 Favored 'General case' 0 N--CA 1.449 -0.522 0 CA-C-O 124.028 1.871 . . . . 3.9399999999999999 110.447 175.114 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 26.4 m -53.48 -24.32 8.85 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.524 0 CA-C-N 112.76 -2.018 . . . . 2.5 110.796 159.031 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -62.99 -78.31 0.18 Allowed Glycine 0 CA--C 1.528 0.88 0 N-CA-C 110.64 -0.984 . . . . 1.52 110.64 171.276 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.8 OUTLIER -84.25 32.34 0.5 Allowed 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 124.229 1.012 . . . . 2.9700000000000002 111.528 -167.208 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.588 HD21 ' CZ ' ' A' ' 38' ' ' PHE . 3.2 tm? -50.31 -37.55 37.13 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 124.761 1.225 . . . . 1.3700000000000001 110.022 -179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -58.91 -19.74 45.23 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 126.25 1.82 . . . . 4.3300000000000001 113.682 -177.317 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.1 pt-20 -80.18 -41.23 25.68 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 120.62 1.554 . . . . 2.98 110.351 166.234 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.66 -47.19 70.6 Favored 'General case' 0 C--O 1.225 -0.206 0 N-CA-C 108.515 -0.92 . . . . 2.8999999999999999 108.515 174.749 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -43.96 -51.83 7.4 Favored 'General case' 0 C--O 1.226 -0.157 0 C-N-CA 124.688 1.195 . . . . 1.47 110.153 175.119 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 48.5 mttp -69.39 -47.47 64.11 Favored 'General case' 0 CA--C 1.531 0.245 0 N-CA-C 110.333 -0.247 . . . . 3.8700000000000001 110.333 -177.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 18.5 m -57.29 -31.49 65.68 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.31 0.644 . . . . 2.73 112.476 177.086 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 33.1 mt -75.69 -60.17 2.43 Favored 'General case' 0 C--O 1.234 0.248 0 C-N-CA 125.155 1.382 . . . . 2.0 109.409 174.939 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 23.7 t0 -76.43 75.37 3.18 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 123.685 0.794 . . . . 1.8400000000000001 110.717 -174.429 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.2 m -49.55 -34.49 8.46 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 C-N-CA 124.203 1.001 . . . . 2.4100000000000001 113.059 -179.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.7 p30 -89.86 -32.28 16.96 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 123.19 0.596 . . . . 2.9900000000000002 112.127 -178.454 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 56.85 44.1 23.84 Favored 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 124.296 1.038 . . . . 3.0800000000000001 111.466 179.889 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 23.8 p30 -50.95 -42.1 59.61 Favored 'General case' 0 CA--C 1.544 0.718 0 C-N-CA 124.14 0.976 . . . . 2.1299999999999999 110.02 155.658 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 10.6 t 113.25 18.37 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.635 1 C-N-CA 131.706 4.002 . . . . 1.7 112.277 -174.325 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -134.24 126.98 30.96 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.802 1.241 . . . . 4.6500000000000004 109.211 178.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -80.43 77.58 7.2 Favored 'General case' 0 N--CA 1.446 -0.645 0 N-CA-C 104.218 -2.512 . . . . 1.25 104.218 168.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 2.1 tppt? -49.93 153.76 1.25 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 128.124 2.569 . . . . 4.0 108.885 173.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 17.3 t80 -38.95 -59.95 0.91 Allowed 'General case' 0 N--CA 1.469 0.492 0 CA-C-N 120.352 1.433 . . . . 5.4299999999999997 112.836 -166.165 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -63.08 -40.03 96.45 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 123.096 0.558 . . . . 1.8100000000000001 110.853 -177.022 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -64.06 -41.72 97.26 Favored 'General case' 0 CA--C 1.53 0.196 0 C-N-CA 123.176 0.591 . . . . 2.3799999999999999 111.278 177.467 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.402 ' CD1' HD22 ' A' ' 33' ' ' LEU . 31.5 t80 -68.64 -53.86 19.92 Favored 'General case' 0 C--O 1.232 0.167 0 CA-C-N 118.937 0.79 . . . . 2.6600000000000001 109.31 176.122 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.508 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.7 OUTLIER -40.5 -42.19 1.59 Allowed 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.317 1.047 . . . . 4.8200000000000003 108.918 176.216 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 11.3 ttt180 -38.69 -52.39 1.67 Allowed 'General case' 0 CA--C 1.515 -0.396 0 CA-C-O 117.868 -1.063 . . . . 5.0199999999999996 111.266 178.352 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.4 tp -43.77 -42.47 5.55 Favored 'General case' 0 C--O 1.222 -0.37 0 C-N-CA 123.929 0.892 . . . . 0.70999999999999996 111.085 179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 29.5 mt -68.66 -43.61 83.07 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.207 0 C-N-CA 125.81 1.644 . . . . 1.45 108.066 -174.238 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -59.46 -47.76 89.32 Favored Glycine 0 CA--C 1.522 0.51 0 N-CA-C 110.591 -1.004 . . . . 1.22 110.591 172.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -58.42 -39.94 81.14 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 124.156 0.982 . . . . 2.52 109.898 178.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 13.7 mt -56.76 -48.62 77.44 Favored 'General case' 0 CA--C 1.531 0.234 0 CA-C-N 120.069 1.304 . . . . 2.3300000000000001 110.984 174.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.36 -27.71 64.45 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.222 0.609 . . . . 1.23 111.86 -179.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.2 ttmt -75.58 -60.64 2.22 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.333 0.653 . . . . 1.8600000000000001 109.744 168.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.9 mm-40 -48.67 -49.3 38.15 Favored 'General case' 0 C--N 1.334 -0.068 0 C-N-CA 125.861 1.664 . . . . 2.3399999999999999 111.223 -172.791 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.9 tt -51.2 -39.78 21.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.547 0 C-N-CA 122.577 0.351 . . . . 1.1000000000000001 111.625 177.088 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.43 -31.02 26.83 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 125.015 1.326 . . . . 4.4699999999999998 109.965 -177.025 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.4 ' NZ ' ' OD1' ' A' ' 92' ' ' ASP . 43.4 tttm -107.16 32.49 4.58 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 125.561 1.544 . . . . 4.1500000000000004 112.138 -168.714 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 58.4 mttt -67.18 -65.15 0.72 Allowed 'General case' 0 CA--C 1.533 0.323 0 O-C-N 120.888 -1.133 . . . . 8.0 112.684 -173.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 89.2 mttt -62.27 -24.82 67.49 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 118.941 0.791 . . . . 12.119999999999999 112.312 -169.406 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.4 ' OD1' ' NZ ' ' A' ' 89' ' ' LYS . 0.1 OUTLIER -56.49 -39.69 73.69 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 126.217 1.807 . . . . 6.4500000000000002 111.671 173.802 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 21.1 tp -125.94 -55.72 1.48 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 123.902 0.881 . . . . 9.8699999999999992 110.72 -168.798 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 13.3 mptt -69.04 162.83 26.05 Favored 'General case' 0 CA--C 1.532 0.275 0 N-CA-C 109.192 -0.67 . . . . 14.18 109.192 175.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 19.5 tt -49.71 144.16 1.7 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.43 0 CA-C-N 115.809 -0.632 . . . . 10.73 109.804 170.176 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 99.8 mtt180 -62.18 100.58 0.17 Allowed 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 123.541 0.737 . . . . 12.859999999999999 109.863 -175.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 69.9 mmtt -174.24 140.63 0.68 Allowed 'General case' 0 N--CA 1.454 -0.245 0 C-N-CA 126.233 1.813 . . . . 12.67 107.495 -161.917 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.409 ' NZ ' ' OE1' ' B' ' 4' ' ' GLU . 3.7 ptmt . . . . . 0 C--O 1.253 1.266 0 C-N-CA 126.093 1.757 . . . . 11.630000000000001 112.517 166.767 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.338 1.5 ppp? . . . . . 0 N--CA 1.47 0.546 0 CA-C-O 116.853 -1.546 . . . . 6.2800000000000002 107.044 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.42 . . 79.05 -171.25 0.05 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 119.429 1.013 . . . . 4.2699999999999996 113.363 166.197 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 83.3 79.37 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 127.9 2.48 . . . . 5.3899999999999997 114.456 171.527 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.409 ' OE1' ' NZ ' ' A' ' 98' ' ' LYS . 6.2 mt-10 -150.12 158.73 36.39 Favored Pre-proline 0 CA--C 1.54 0.587 0 C-N-CA 125.641 1.576 . . . . 5.5499999999999998 107.427 159.526 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_endo -70.09 159.31 53.62 Favored 'Trans proline' 0 C--N 1.347 0.48 0 C-N-CA 123.883 3.056 . . . . 3.2400000000000002 111.609 -177.554 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 5.7 mt -132.98 -127.49 0.18 Allowed 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 123.139 0.575 . . . . 2.3700000000000001 110.762 -158.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 1.7 t -129.43 -79.9 0.56 Allowed 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 124.857 1.263 . . . . 2.6200000000000001 112.381 -174.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -159.5 -71.32 0.08 Allowed 'General case' 0 C--N 1.342 0.263 0 CA-C-N 119.38 0.991 . . . . 2.3199999999999998 109.256 -176.021 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.2 mt -50.98 -49.67 59.77 Favored 'General case' 0 CA--C 1.531 0.236 0 O-C-N 121.522 -0.736 . . . . 1.05 110.106 169.026 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 22.8 mp0 -50.68 -46.17 58.57 Favored 'General case' 0 N--CA 1.441 -0.876 0 C-N-CA 124.636 1.175 . . . . 3.9100000000000001 111.788 173.16 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -60.34 -41.18 93.04 Favored 'General case' 0 CA--C 1.538 0.492 0 O-C-N 121.519 -0.738 . . . . 4.4400000000000004 110.398 176.485 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 31.6 p -64.96 -39.3 93.28 Favored 'General case' 0 CA--C 1.537 0.464 0 O-C-N 121.595 -0.691 . . . . 1.6100000000000001 111.51 -179.985 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.322 2.8 pp -69.57 -32.44 52.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.421 0 O-C-N 121.524 -0.735 . . . . 0.80000000000000004 111.41 172.006 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.4 tm-20 -58.76 -57.27 13.78 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.466 -0.771 . . . . 2.79 110.339 173.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.4 t -51.52 -39.46 57.71 Favored 'General case' 0 CA--C 1.542 0.647 0 CA-C-N 118.762 0.71 . . . . 1.3500000000000001 111.731 -171.879 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 23.2 m -72.68 -37.02 54.74 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 120.995 -1.066 . . . . 0.76000000000000001 111.896 176.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 42.1 t -60.57 -45.27 97.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 119.43 1.014 . . . . 0.89000000000000001 110.786 173.436 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -66.22 -41.4 90.15 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 120.98 -1.075 . . . . 1.1100000000000001 110.783 176.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 61.6 m -59.23 -46.7 87.78 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.151 0.887 . . . . 0.98999999999999999 110.826 176.315 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 2.7 t80 -48.25 -61.86 1.78 Allowed 'General case' 0 CA--C 1.53 0.189 0 N-CA-C 108.073 -1.084 . . . . 3.8500000000000001 108.073 169.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -52.95 -52.81 56.71 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.203 1.001 . . . . 3.21 112.238 -172.498 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 7.1 t -61.55 -29.97 70.35 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-O 119.075 -0.488 . . . . 2.6699999999999999 111.826 -174.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 15.8 m-85 -81.69 -40.25 23.09 Favored 'General case' 0 C--O 1.22 -0.45 0 CA-C-N 119.358 0.981 . . . . 3.0099999999999998 111.538 170.381 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.16 -25.26 65.4 Favored 'General case' 0 C--N 1.327 -0.412 0 C-N-CA 126.913 2.085 . . . . 0.90000000000000002 112.653 -168.391 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 20.3 ptt180 -58.62 -28.86 66.04 Favored 'General case' 0 CA--C 1.531 0.227 0 CA-C-O 117.675 -1.155 . . . . 5.0899999999999999 112.9 172.23 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.1 tp60 -52.01 -63.83 1.01 Allowed 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 115.448 1.647 . . . . 2.1200000000000001 115.448 -155.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -88.93 -76.74 0.4 Allowed 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.361 0.6 . . . . 3.3300000000000001 112.384 -166.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.75 165.38 27.03 Favored Glycine 0 C--N 1.337 0.635 0 C-N-CA 127.791 2.615 . . . . 2.1499999999999999 110.885 158.634 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 94.7 mtt180 38.94 103.07 0.0 OUTLIER 'General case' 0 C--O 1.238 0.487 0 N-CA-C 115.973 1.842 . . . . 3.6299999999999999 115.973 139.121 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 18.3 pttm -54.58 -32.08 57.96 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.948 1.299 . . . . 3.9700000000000002 114.033 174.642 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 3.0 m-20 -79.37 -33.43 42.88 Favored 'General case' 0 CA--C 1.531 0.226 0 O-C-N 121.591 -0.693 . . . . 4.0499999999999998 111.626 -173.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.0 p -100.73 130.23 46.74 Favored 'General case' 0 C--O 1.236 0.367 0 N-CA-C 108.953 -0.758 . . . . 1.6899999999999999 108.953 -179.535 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -65.26 170.72 4.39 Favored 'General case' 0 N--CA 1.451 -0.38 0 CA-C-O 122.486 1.136 . . . . 1.98 108.995 161.894 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 4.7 m -157.24 -173.5 4.46 Favored 'General case' 0 N--CA 1.442 -0.858 0 N-CA-C 106.259 -1.756 . . . . 3.5699999999999998 106.259 -154.37 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 93.3 t -71.77 -111.52 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.323 -0.546 0 N-CA-C 101.397 -3.557 . . . . 3.1299999999999999 101.397 -175.926 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.9 t30 -75.07 59.68 0.97 Allowed 'General case' 0 CA--C 1.551 0.998 0 O-C-N 119.597 -1.94 . . . . 2.3799999999999999 110.074 -176.856 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 67.4 mt-10 -115.37 -52.05 2.67 Favored 'General case' 0 N--CA 1.452 -0.347 1 C-N-CA 132.574 4.35 . . . . 2.4500000000000002 107.621 144.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -56.31 -50.33 71.76 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 107.677 -1.231 . . . . 2.8900000000000001 107.677 173.347 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 7.8 tttp -56.0 -39.5 71.97 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 121.02 -0.272 . . . . 2.96 110.723 178.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -56.36 -45.06 80.64 Favored 'General case' 0 C--O 1.225 -0.225 0 C-N-CA 122.642 0.377 . . . . 2.5499999999999998 110.745 175.821 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 7.2 tt -64.23 -48.83 74.31 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 108.381 -0.97 . . . . 2.1499999999999999 108.381 -174.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.406 HG21 HD23 ' B' ' 56' ' ' LEU . 6.8 m -67.05 -42.69 88.78 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.349 0 CA-C-N 115.773 -0.649 . . . . 0.80000000000000004 109.899 -173.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 88.1 m -61.22 -53.33 58.28 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.929 0.892 . . . . 0.96999999999999997 110.843 175.72 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -76.76 -61.16 2.06 Favored 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 124.036 0.935 . . . . 1.8500000000000001 110.617 -167.167 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -82.64 -53.13 6.18 Favored 'General case' 0 N--CA 1.456 -0.165 0 C-N-CA 122.72 0.408 . . . . 2.8500000000000001 110.575 -173.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 5.8 tp -83.47 -18.77 0.26 Allowed Pre-proline 0 CA--C 1.542 0.653 0 N-CA-C 121.281 3.808 . . . . 2.29 121.281 -143.163 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 9.9 Cg_endo -46.17 -54.81 4.26 Favored 'Trans proline' 0 CA--C 1.536 0.578 0 CA-C-N 123.108 2.146 . . . . 3.0800000000000001 116.154 -145.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 56.8 t-80 -79.69 55.85 2.12 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-N 118.971 0.805 . . . . 2.4399999999999999 112.055 -175.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 33.2 tp -147.39 -87.1 0.09 Allowed 'General case' 0 N--CA 1.443 -0.779 0 C-N-CA 125.898 1.679 . . . . 1.3 107.117 170.624 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 53.1 mt -73.99 77.46 1.69 Allowed 'General case' 0 N--CA 1.454 -0.257 0 N-CA-C 107.29 -1.374 . . . . 1.8700000000000001 107.29 165.17 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -50.5 151.76 2.15 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-N 115.247 -0.888 . . . . 5.5899999999999999 109.583 174.77 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 61.3 t0 66.7 73.47 0.35 Allowed 'General case' 0 N--CA 1.452 -0.357 0 CA-C-O 123.665 1.697 . . . . 3.5899999999999999 108.893 -179.713 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 14.3 m -78.42 6.68 0.96 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.713 0 CA-C-N 112.172 -2.285 . . . . 1.55 110.284 163.803 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -74.11 -58.9 4.15 Favored Glycine 0 C--N 1.342 0.904 0 N-CA-C 106.681 -2.568 . . . . 2.3500000000000001 106.681 172.907 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 1.7 t -77.34 49.07 0.68 Allowed 'General case' 0 CA--C 1.535 0.389 0 CA-C-O 121.706 0.765 . . . . 2.6200000000000001 110.46 172.48 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.406 HD23 HG21 ' B' ' 42' ' ' VAL . 2.2 tm? -62.32 -47.47 84.12 Favored 'General case' 0 N--CA 1.441 -0.883 0 N-CA-C 107.634 -1.247 . . . . 0.95999999999999996 107.634 167.745 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.9 m-20 -63.25 -30.72 71.81 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.844 0.857 . . . . 4.5899999999999999 111.221 -165.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -52.98 -59.94 3.91 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.132 0.973 . . . . 2.4100000000000001 110.113 163.82 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -58.51 -39.42 80.04 Favored 'General case' 0 N--CA 1.451 -0.415 0 CA-C-O 118.436 -0.792 . . . . 4.6200000000000001 109.982 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -52.49 -55.77 19.74 Favored 'General case' 0 C--O 1.221 -0.427 0 CA-C-N 119.066 0.848 . . . . 1.8400000000000001 109.232 174.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 35.1 mtmt -58.1 -40.9 82.35 Favored 'General case' 0 CA--C 1.537 0.454 0 CA-C-N 119.226 0.921 . . . . 3.29 111.954 176.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 18.0 t -61.35 -25.27 67.04 Favored 'General case' 0 CA--C 1.541 0.615 0 O-C-N 121.734 -0.604 . . . . 1.75 112.475 173.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.831 ' HB3' HD11 ' B' ' 71' ' ' LEU . 1.2 tp -81.95 -52.07 7.43 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 126.035 1.734 . . . . 2.4399999999999999 110.625 176.929 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 30.5 t0 -62.16 -13.73 30.17 Favored 'General case' 0 C--O 1.235 0.336 0 C-N-CA 128.662 2.785 . . . . 1.6699999999999999 115.211 -164.187 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 30.1 m -35.98 -27.12 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 C-N-CA 130.931 3.693 . . . . 1.48 118.456 -130.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 22.7 p30 -65.25 -11.52 42.05 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 119.603 1.092 . . . . 2.3700000000000001 111.643 166.957 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 70.15 28.67 3.94 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.712 1.205 . . . . 4.1900000000000004 112.297 165.099 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 55.4 p30 -91.54 -1.21 57.59 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 124.783 1.233 . . . . 2.1299999999999999 112.73 177.664 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 8.1 t 69.39 1.56 3.35 Favored 'General case' 0 CA--C 1.534 0.358 0 N-CA-C 114.524 1.305 . . . . 2.7000000000000002 114.524 -176.394 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 21.5 mt-10 -103.64 126.77 50.99 Favored 'General case' 0 C--O 1.236 0.345 0 CA-C-N 119.855 1.207 . . . . 3.7000000000000002 108.412 171.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . 0.831 HD11 ' HB3' ' B' ' 63' ' ' LEU . 3.8 mm? -98.76 80.85 2.58 Favored 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 107.802 -1.184 . . . . 1.5700000000000001 107.802 175.47 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 11.0 ptpp? -83.42 177.75 8.34 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 124.513 1.125 . . . . 3.9199999999999999 111.772 -174.207 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 93.3 m-85 -83.08 56.65 3.57 Favored 'General case' 0 CA--C 1.541 0.63 0 O-C-N 121.373 -0.829 . . . . 3.9100000000000001 112.898 -173.144 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -163.19 49.07 0.15 Allowed 'General case' 0 CA--C 1.534 0.359 0 N-CA-C 108.375 -0.972 . . . . 2.3100000000000001 108.375 109.689 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 40.5 mt-10 -93.78 -62.47 1.35 Allowed 'General case' 0 N--CA 1.437 -1.116 0 C-N-CA 124.885 1.274 . . . . 1.76 108.428 150.376 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 22.4 t80 -61.1 -32.32 71.99 Favored 'General case' 0 CA--C 1.51 -0.57 0 CA-C-N 115.174 -0.921 . . . . 4.6900000000000004 112.012 -164.073 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.425 ' C ' ' CD1' ' B' ' 77' ' ' TRP . 5.8 t90 -41.11 -44.64 2.55 Favored 'General case' 0 CA--C 1.542 0.663 0 O-C-N 124.49 1.119 . . . . 4.5800000000000001 109.541 175.916 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 60.1 mtp85 -38.92 -41.19 0.73 Allowed 'General case' 0 C--N 1.344 0.36 0 C-N-CA 123.833 0.853 . . . . 4.1100000000000003 111.509 -178.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 16.7 tp -51.53 -54.5 26.7 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 118.934 0.788 . . . . 1.0900000000000001 112.822 176.329 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.6 mt -70.23 -30.94 45.44 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.341 0 CA-C-N 120.144 1.338 . . . . 1.4299999999999999 108.529 -178.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -41.92 -51.98 4.9 Favored Glycine 0 C--N 1.344 0.999 0 C-N-CA 125.437 1.494 . . . . 1.4099999999999999 110.184 165.867 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -75.58 -57.9 3.61 Favored 'General case' 0 N--CA 1.439 -1.012 0 CA-C-N 112.89 -1.655 . . . . 2.23 109.862 -176.775 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 10.5 mp -41.69 -59.33 1.68 Allowed 'General case' 0 CA--C 1.541 0.6 0 CA-C-N 120.62 1.555 . . . . 2.1899999999999999 112.212 -176.95 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.71 -28.84 70.16 Favored 'General case' 0 C--N 1.339 0.121 0 CA-C-N 115.436 -0.802 . . . . 1.3200000000000001 111.739 -174.662 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -71.24 -62.09 1.53 Allowed 'General case' 0 N--CA 1.447 -0.584 0 N-CA-C 108.12 -1.067 . . . . 1.76 108.12 172.877 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 33.0 mm-40 -58.27 -39.11 78.38 Favored 'General case' 0 N--CA 1.453 -0.298 0 C-N-CA 124.047 0.939 . . . . 2.73 111.87 -166.462 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 11.4 tt -47.51 -47.37 10.64 Favored 'Isoleucine or valine' 0 C--N 1.347 0.492 0 CA-C-N 119.603 1.092 . . . . 1.05 112.104 -179.755 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 5.9 ttp85 -82.27 -48.4 11.26 Favored 'General case' 0 CA--C 1.532 0.256 0 CA-C-O 122.313 1.054 . . . . 4.2699999999999996 110.14 173.511 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 2.7 tttt -83.43 61.01 5.95 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 126.846 2.058 . . . . 6.4100000000000001 109.022 -169.685 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -41.16 -41.5 1.81 Allowed 'General case' 0 C--O 1.24 0.578 0 C-N-CA 126.125 1.77 . . . . 5.2000000000000002 113.275 -167.212 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 3.5 tpmp? -142.16 -47.87 0.35 Allowed 'General case' 0 C--N 1.326 -0.426 0 CA-C-O 118.148 -0.929 . . . . 7.04 111.441 162.386 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 15.1 t0 -2.34 74.87 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 130.725 3.61 . . . . 5.2199999999999998 114.753 164.667 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 50.7 tp -151.79 -74.53 0.14 Allowed 'General case' 0 N--CA 1.445 -0.701 0 O-C-N 121.069 -1.02 . . . . 5.3099999999999996 108.499 -177.982 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 62.2 pttt -168.92 167.74 10.68 Favored 'General case' 0 C--N 1.339 0.145 0 C-N-CA 124.088 0.955 . . . . 7.1500000000000004 108.613 177.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 44.1 pt -134.54 19.23 1.19 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.458 0 C-N-CA 123.988 0.915 . . . . 10.210000000000001 110.561 160.956 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.22 113.76 1.63 Allowed 'General case' 0 CA--C 1.532 0.254 0 O-C-N 121.494 -0.753 . . . . 8.6199999999999992 110.681 -174.377 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 27.1 tptp 152.09 120.05 0.0 OUTLIER 'General case' 0 C--O 1.234 0.266 0 C-N-CA 129.02 2.928 . . . . 6.2599999999999998 107.544 158.154 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.4 ttpt . . . . . 0 C--O 1.249 1.068 0 N-CA-C 103.045 -2.946 . . . . 9.7799999999999994 103.045 151.81 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptt? . . . . . 0 N--CA 1.476 0.858 0 N-CA-C 111.913 0.338 . . . . 10.220000000000001 111.913 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -160.93 176.99 10.81 Favored 'General case' 0 N--CA 1.452 -0.339 0 N-CA-C 106.637 -1.616 . . . . 4.1399999999999997 106.637 -177.274 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.03 96.65 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 128.914 2.885 . . . . 3.7999999999999998 109.726 -173.087 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 45.1 mt-10 -75.74 128.86 82.79 Favored Pre-proline 0 CA--C 1.537 0.462 0 C-N-CA 123.844 0.858 . . . . 5.5099999999999998 110.199 -173.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.69 103.4 1.7 Allowed 'Trans proline' 0 N--CA 1.453 -0.906 0 C-N-CA 122.912 2.408 . . . . 2.6299999999999999 110.467 -177.238 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 88.5 mt -67.65 164.82 18.4 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 121.228 0.537 . . . . 1.29 110.833 173.575 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 4.8 t -83.18 175.68 9.77 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.658 -0.867 . . . . 2.0299999999999998 108.658 171.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.5 tt0 -69.37 -48.52 60.99 Favored 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 123.567 0.747 . . . . 2.5800000000000001 109.175 -167.562 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.5 mp -62.33 -52.46 63.56 Favored 'General case' 0 N--CA 1.45 -0.44 0 CA-C-O 119.361 -0.352 . . . . 2.3300000000000001 111.226 178.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 97.1 mt-10 -54.42 -50.55 67.34 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.226 1.01 . . . . 2.8900000000000001 110.248 178.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 19.3 tp10 -50.99 -55.2 18.52 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 124.3 1.04 . . . . 3.5800000000000001 110.606 172.451 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 53.9 m -55.24 -49.77 71.17 Favored 'General case' 0 CA--C 1.531 0.216 0 O-C-N 121.878 -0.514 . . . . 2.23 111.654 -178.434 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.293 2.9 pp -62.49 -37.12 78.02 Favored 'Isoleucine or valine' 0 C--N 1.339 0.13 0 C-N-CA 119.763 -0.775 . . . . 0.67000000000000004 110.332 178.074 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -60.65 -58.08 9.98 Favored 'General case' 0 CA--C 1.533 0.296 0 CA-C-N 119.093 0.86 . . . . 2.6299999999999999 110.431 175.499 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.9 t -52.33 -39.86 61.18 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 119.392 0.996 . . . . 1.1799999999999999 111.583 -172.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.0 m -73.36 -42.09 57.14 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 O-C-N 121.107 -0.996 . . . . 0.75 111.271 175.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 28.2 t -55.39 -51.29 58.21 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.206 0 CA-C-N 119.376 0.989 . . . . 0.62 110.853 175.312 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.6 t -60.27 -48.34 82.15 Favored 'General case' 0 CA--C 1.537 0.463 0 CA-C-N 119.163 0.892 . . . . 0.83999999999999997 110.448 179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 90.6 m -55.29 -51.38 66.85 Favored 'General case' 0 C--N 1.344 0.347 0 CA-C-N 118.691 0.678 . . . . 0.97999999999999998 110.251 178.252 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.0 t80 -46.88 -58.9 3.47 Favored 'General case' 0 C--O 1.224 -0.243 0 C-N-CA 123.658 0.783 . . . . 2.96 109.447 171.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 26.7 t80 -57.09 -47.07 81.95 Favored 'General case' 0 N--CA 1.453 -0.296 0 C-N-CA 124.617 1.167 . . . . 2.6400000000000001 111.452 -169.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.8 OUTLIER -53.05 -41.85 65.19 Favored 'General case' 0 C--O 1.234 0.278 0 CA-C-O 119.101 -0.476 . . . . 2.3799999999999999 111.945 178.203 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 33.6 m-85 -81.41 -31.18 33.31 Favored 'General case' 0 C--O 1.221 -0.427 0 C-N-CA 123.668 0.787 . . . . 3.54 111.71 176.455 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.01 -34.91 72.42 Favored 'General case' 0 C--N 1.33 -0.24 0 O-C-N 120.432 -1.417 . . . . 0.97999999999999998 109.762 178.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 33.7 ttp180 -69.27 -26.24 64.66 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 126.12 1.768 . . . . 4.5899999999999999 113.589 178.214 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -41.05 -60.82 1.11 Allowed 'General case' 0 C--N 1.344 0.345 0 CA-C-N 120.49 1.495 . . . . 1.78 113.514 -168.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 33.2 mt-10 -110.54 169.27 8.86 Favored 'General case' 0 N--CA 1.447 -0.625 0 C-N-CA 127.009 2.124 . . . . 2.6299999999999999 106.346 175.972 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -11.91 121.09 0.01 OUTLIER Glycine 0 CA--C 1.533 1.2 0 C-N-CA 127.264 2.364 . . . . 1.3999999999999999 115.19 175.518 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 69.27 106.3 0.06 Allowed 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 123.932 0.893 . . . . 5.7599999999999998 113.072 170.118 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.4 ptpt -68.08 55.22 0.07 Allowed 'General case' 0 CA--C 1.542 0.646 0 C-N-CA 125.163 1.385 . . . . 3.6299999999999999 111.769 168.062 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.7 t0 -158.83 -61.8 0.08 Allowed 'General case' 0 C--N 1.333 -0.143 0 C-N-CA 126.572 1.949 . . . . 4.1399999999999997 105.771 179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.7 m -82.53 127.24 33.14 Favored 'General case' 0 N--CA 1.445 -0.707 0 CA-C-N 115.003 -0.999 . . . . 2.2999999999999998 109.365 -177.632 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.408 HD22 ' CE2' ' A' ' 76' ' ' TYR . 5.8 mp -93.29 132.41 37.51 Favored 'General case' 0 N--CA 1.451 -0.39 0 CA-C-O 120.694 0.283 . . . . 2.2799999999999998 110.537 170.956 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.5 t -81.5 175.78 10.23 Favored 'General case' 0 CA--C 1.533 0.325 0 C-N-CA 125.276 1.43 . . . . 2.5600000000000001 108.429 172.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 61.1 t -64.73 -48.58 84.0 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.21 0 C-N-CA 123.1 0.56 . . . . 1.97 109.642 -175.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.3 t30 -59.5 -56.8 17.45 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-O 118.932 -0.556 . . . . 2.1099999999999999 109.537 175.657 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -39.23 -52.14 1.96 Allowed 'General case' 0 CA--C 1.529 0.144 0 C-N-CA 125.098 1.359 . . . . 1.72 112.479 172.765 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.9 t80 -58.58 -58.2 9.59 Favored 'General case' 0 N--CA 1.451 -0.394 0 N-CA-C 109.476 -0.564 . . . . 3.04 109.476 175.778 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 33.9 tttm -52.98 -39.59 63.14 Favored 'General case' 0 N--CA 1.451 -0.398 0 CA-C-O 119.216 -0.421 . . . . 3.5499999999999998 111.823 -175.124 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 67.9 mt-10 -47.78 -47.56 30.7 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-O 118.972 -0.537 . . . . 2.8900000000000001 111.224 177.0 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.3 tp -65.95 -46.76 77.0 Favored 'General case' 0 C--N 1.337 0.063 0 CA-C-N 119.816 1.189 . . . . 2.6800000000000002 109.266 -171.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 13.8 m -69.04 -36.29 73.03 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.297 0 CA-C-O 121.494 0.664 . . . . 0.94999999999999996 109.471 -173.676 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 57.9 m -75.35 -30.34 60.2 Favored 'General case' 0 CA--C 1.54 0.565 0 C-N-CA 123.393 0.677 . . . . 1.1899999999999999 110.795 179.533 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -80.53 -57.42 3.59 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.754 1.222 . . . . 2.1800000000000002 110.655 -176.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.4 mp0 -97.95 -125.95 0.15 Allowed 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 109.109 -0.701 . . . . 3.98 109.109 177.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.587 ' CD1' HD23 ' A' ' 49' ' ' LEU . 1.4 mm? 28.96 64.61 0.73 Allowed Pre-proline 0 CA--C 1.545 0.788 0 C-N-CA 127.973 2.509 . . . . 2.3399999999999999 115.62 175.377 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -75.54 -50.12 0.13 Allowed 'Trans proline' 0 N--CA 1.454 -0.836 0 C-N-CA 121.918 1.745 . . . . 1.72 111.062 176.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 19.6 t-160 -107.47 -22.77 12.43 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.13 0.972 . . . . 4.1200000000000001 112.181 -166.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.816 HD21 ' HB2' ' A' ' 83' ' ' LEU . 18.1 tp -74.73 -91.08 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.475 1.11 . . . . 1.2 109.733 -167.285 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 70.6 mt -82.65 68.08 8.97 Favored 'General case' 0 N--CA 1.452 -0.371 0 N-CA-C 108.117 -1.068 . . . . 2.1099999999999999 108.117 172.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -59.74 156.1 14.62 Favored 'General case' 0 CA--C 1.535 0.391 0 CA-C-N 116.155 -0.475 . . . . 5.4199999999999999 110.054 170.927 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 60.1 t0 67.69 84.58 0.15 Allowed 'General case' 0 C--O 1.231 0.089 0 C-N-CA 125.879 1.672 . . . . 4.4400000000000004 109.055 -155.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 25.2 m -100.09 28.72 0.62 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 CA-C-N 114.224 -1.353 . . . . 2.0800000000000001 109.244 166.819 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -104.57 -59.0 0.68 Allowed Glycine 0 C--N 1.34 0.778 0 C-N-CA 126.419 1.961 . . . . 1.45 108.74 177.221 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.6 t -77.28 60.81 2.04 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-O 123.242 1.496 . . . . 2.04 109.571 175.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -73.88 -25.01 59.81 Favored 'General case' 0 N--CA 1.439 -1.007 0 C-N-CA 124.782 1.233 . . . . 1.2 109.078 -179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 22.6 p-10 -52.83 -53.07 53.86 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 125.953 1.701 . . . . 4.0199999999999996 111.613 171.641 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . 0.409 ' OE1' ' NZ ' ' A' ' 59' ' ' LYS . 2.1 tt0 -54.26 -56.74 15.41 Favored 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 124.132 0.973 . . . . 3.3900000000000001 108.903 177.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.409 ' NZ ' ' OE1' ' A' ' 58' ' ' GLU . 0.0 OUTLIER -53.43 -45.52 69.48 Favored 'General case' 0 CA--C 1.534 0.354 0 CA-C-N 115.969 -0.56 . . . . 2.6200000000000001 110.034 179.502 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -57.35 -56.06 26.68 Favored 'General case' 0 N--CA 1.457 -0.103 0 C-N-CA 123.514 0.725 . . . . 1.3700000000000001 109.693 -179.068 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 60.1 mttt -63.05 -33.08 74.67 Favored 'General case' 0 N--CA 1.454 -0.236 0 N-CA-C 111.665 0.246 . . . . 3.6699999999999999 111.665 -179.299 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -62.09 -41.96 98.73 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.132 -0.355 . . . . 1.9199999999999999 110.781 173.396 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 21.5 mt -76.54 -56.4 4.65 Favored 'General case' 0 C--O 1.234 0.264 0 C-N-CA 125.214 1.406 . . . . 1.5 112.773 -174.948 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 65.6 t0 -59.34 114.42 2.65 Favored 'General case' 0 N--CA 1.451 -0.406 0 C-N-CA 124.04 0.936 . . . . 1.8500000000000001 108.834 -175.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 1.2 t -73.76 -30.66 29.34 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.575 0 N-CA-C 109.169 -0.678 . . . . 3.6299999999999999 109.169 -173.403 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 3.6 m120 -84.19 -40.5 18.06 Favored 'General case' 0 C--O 1.227 -0.109 0 N-CA-C 109.197 -0.668 . . . . 2.1200000000000001 109.197 179.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 65.36 64.56 0.6 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 125.014 1.326 . . . . 3.4199999999999999 108.032 -158.569 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 12.2 p30 -104.11 -125.11 0.21 Allowed 'General case' 0 N--CA 1.446 -0.634 0 N-CA-C 105.467 -2.049 . . . . 3.6400000000000001 105.467 172.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 2.3 t -137.28 18.22 2.96 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.365 1.066 . . . . 2.4700000000000002 110.117 170.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 40.0 mp0 -133.12 113.38 12.66 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 125.282 1.433 . . . . 5.0199999999999996 107.399 -165.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.1 mm? -84.27 87.85 7.21 Favored 'General case' 0 N--CA 1.449 -0.483 0 N-CA-C 105.461 -2.052 . . . . 1.0 105.461 167.241 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 20.2 tptm -54.64 158.96 2.34 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-O 118.222 -0.894 . . . . 4.5300000000000002 109.485 176.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -37.25 -53.03 1.07 Allowed 'General case' 0 N--CA 1.469 0.516 0 C-N-CA 124.44 1.096 . . . . 4.8799999999999999 112.011 -176.707 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 18.0 t-20 -70.23 -40.31 74.56 Favored 'General case' 0 CA--C 1.538 0.491 0 N-CA-C 112.565 0.58 . . . . 2.5499999999999998 112.565 -178.08 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -63.07 -34.76 78.28 Favored 'General case' 0 N--CA 1.456 -0.168 0 C-N-CA 122.873 0.469 . . . . 2.1200000000000001 110.576 176.358 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.408 ' CE2' HD22 ' A' ' 33' ' ' LEU . 28.3 t80 -75.63 -47.04 28.18 Favored 'General case' 0 N--CA 1.447 -0.598 0 CA-C-O 119.008 -0.52 . . . . 3.4300000000000002 109.832 175.999 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.526 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 2.3 t-105 -43.74 -43.94 6.31 Favored 'General case' 0 C--N 1.344 0.348 0 N-CA-C 108.73 -0.841 . . . . 4.79 108.73 173.515 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.0 mtp180 -39.71 -51.48 2.33 Favored 'General case' 0 C--O 1.213 -0.862 0 CA-C-O 117.087 -1.435 . . . . 4.2800000000000002 109.44 178.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.7 tp -43.6 -47.64 7.52 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 120.44 1.473 . . . . 0.72999999999999998 112.198 177.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.5 mp -68.19 -44.11 84.4 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.19 0 C-N-CA 125.689 1.595 . . . . 1.76 108.707 -179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -60.49 -36.97 92.53 Favored Glycine 0 C--N 1.332 0.314 0 CA-C-O 122.121 0.845 . . . . 1.5600000000000001 113.48 176.952 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.422 ' O ' ' HD2' ' A' ' 85' ' ' LYS . 5.9 mm-40 -75.99 -56.04 5.03 Favored 'General case' 0 N--CA 1.43 -1.461 0 N-CA-C 104.979 -2.23 . . . . 3.1200000000000001 104.979 -175.347 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.816 ' HB2' HD21 ' A' ' 49' ' ' LEU 0.282 4.6 pp -57.14 -32.18 66.11 Favored 'General case' 0 N--CA 1.448 -0.545 0 O-C-N 121.207 -0.933 . . . . 2.2000000000000002 113.38 177.027 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -63.12 -25.09 68.2 Favored 'General case' 0 CA--C 1.531 0.233 0 CA-C-O 118.065 -0.969 . . . . 1.77 112.876 175.615 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.422 ' HD2' ' O ' ' A' ' 82' ' ' GLU 0.308 0.0 OUTLIER -84.74 -41.4 16.24 Favored 'General case' 0 C--N 1.344 0.346 0 CA-C-N 120.201 1.364 . . . . 2.2400000000000002 112.507 158.968 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.487 ' HB2' ' HA ' ' A' ' 83' ' ' LEU . 16.8 mm-40 -52.94 -39.39 62.84 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 119.211 0.914 . . . . 2.54 111.336 -171.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.415 HG21 HG21 ' B' ' 17' ' ' VAL . 4.3 tp -26.87 -50.47 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.449 1.1 . . . . 1.8100000000000001 111.963 166.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -115.24 -42.68 3.15 Favored 'General case' 0 CA--C 1.546 0.812 0 C-N-CA 124.007 0.923 . . . . 4.6500000000000004 112.981 -176.445 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 44.6 tttm -53.67 -54.38 38.68 Favored 'General case' 0 C--O 1.232 0.166 0 O-C-N 119.92 -1.737 . . . . 3.0499999999999998 109.298 171.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.531 ' C ' ' H3 ' ' B' ' 1' ' ' MET . 0.2 OUTLIER -75.78 -41.67 52.33 Favored 'General case' 0 N--CA 1.448 -0.564 0 N-CA-C 107.976 -1.12 . . . . 8.5500000000000007 107.976 178.982 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . 0.613 0.1 OUTLIER -138.32 57.07 1.71 Allowed 'General case' 0 CA--C 1.565 1.533 1 N-CA-C 121.803 4.001 . . . . 10.359999999999999 121.803 -177.569 . . . . . . . . 4 3 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . 0.563 ' O ' ' HB3' ' B' ' 1' ' ' MET . 0.0 OUTLIER -130.03 129.24 43.43 Favored 'General case' 0 N--CA 1.49 1.556 0 C-N-CA 129.915 3.286 . . . . 7.4299999999999997 109.199 147.529 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.496 ' H ' ' HB2' ' B' ' 2' ' ' ALA 0.577 0.1 OUTLIER 91.91 24.01 0.02 OUTLIER 'General case' 0 CA--C 1.573 1.829 2 C-N-CA 136.37 5.868 . . . . 11.0 126.554 169.273 . . . . . . . . 5 4 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.428 ' CD ' ' HG3' ' B' ' 1' ' ' MET . 4.1 tttp -158.26 -71.27 0.09 Allowed 'General case' 0 N--CA 1.486 1.365 1 CA-C-N 126.385 4.175 . . . . 10.710000000000001 120.302 -178.242 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 49.3 mm -61.4 86.54 0.03 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.465 0 C-N-CA 125.168 1.387 . . . . 8.4199999999999999 111.275 -154.592 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 27.4 mtp85 64.68 -65.23 0.14 Allowed 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.208 1.803 . . . . 13.220000000000001 108.017 -165.715 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 34.0 mtmt 152.91 62.58 0.0 OUTLIER 'General case' 0 C--O 1.233 0.221 0 C-N-CA 131.285 3.834 . . . . 11.029999999999999 105.407 151.374 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 37.8 mmtm . . . . . 0 C--O 1.251 1.144 0 C-N-CA 125.89 1.676 . . . . 11.4 107.237 -173.364 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.563 ' HB3' ' O ' ' A' ' 92' ' ' ASP 2.36 0.0 OUTLIER . . . . . 0 CA--C 1.579 2.084 0 CA-C-O 116.725 -1.607 . . . . 8.6199999999999992 113.078 . . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . 0.496 ' HB2' ' H ' ' A' ' 93' ' ' LEU 2.333 . . 120.03 90.53 0.0 OUTLIER 'General case' 0 N--CA 1.502 2.159 0 CA-C-N 124.927 3.512 . . . . 5.7400000000000002 119.631 177.869 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 104.03 70.26 0.0 OUTLIER 'General case' 0 CA--C 1.555 1.166 0 N-CA-C 120.48 3.511 . . . . 6.1500000000000004 120.48 124.1 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.401 ' HB3' ' CD ' ' B' ' 5' ' ' PRO 0.452 21.2 tt0 91.02 -117.22 0.0 OUTLIER Pre-proline 0 CA--C 1.559 1.311 0 N-CA-C 118.915 2.932 . . . . 6.3899999999999997 118.915 131.307 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . 0.401 ' CD ' ' HB3' ' B' ' 4' ' ' GLU . 59.2 Cg_endo -66.08 152.17 81.95 Favored 'Trans proline' 0 C--N 1.357 0.996 0 C-N-CA 123.805 3.003 . . . . 3.5600000000000001 114.563 -147.187 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.442 ' HB2' ' HB3' ' B' ' 10' ' ' GLU . 0.3 OUTLIER -160.02 158.41 30.49 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 120.011 -0.676 . . . . 3.3700000000000001 112.188 -149.42 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 5.1 t -79.85 -159.9 0.24 Allowed 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 126.403 1.881 . . . . 2.0499999999999998 113.068 -173.13 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -75.28 -66.83 0.72 Allowed 'General case' 0 C--O 1.223 -0.29 0 O-C-N 121.957 -0.465 . . . . 2.6800000000000002 111.786 -172.745 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.0 mt -48.81 -41.67 33.54 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 120.852 -1.155 . . . . 1.04 110.353 175.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.599 ' HG3' HD22 ' A' ' 49' ' ' LEU . 1.6 mt-10 -44.69 -61.51 1.55 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 126.323 1.849 . . . . 3.52 113.71 164.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -62.66 -34.94 78.12 Favored 'General case' 0 CA--C 1.536 0.414 0 O-C-N 120.464 -1.397 . . . . 4.29 110.234 -177.963 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.8 m -64.16 -38.06 89.71 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.204 0.602 . . . . 2.2999999999999998 111.238 178.591 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.263 2.9 pp -71.47 -36.51 60.9 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.209 0 O-C-N 121.477 -0.765 . . . . 1.1200000000000001 111.209 167.562 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -53.11 -57.3 10.9 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-N 118.857 0.753 . . . . 2.6499999999999999 110.043 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.1 t -47.24 -44.51 22.77 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 119.284 0.947 . . . . 1.3600000000000001 112.699 -176.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.0 m -74.36 -36.22 41.84 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.307 0 O-C-N 120.832 -1.168 . . . . 1.23 110.967 177.377 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.415 HG21 HG21 ' A' ' 87' ' ' ILE . 56.3 t -61.53 -48.18 89.98 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.318 0 CA-C-N 118.828 0.74 . . . . 0.98999999999999999 110.739 175.696 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 10.1 t -59.89 -44.91 93.97 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 120.197 1.362 . . . . 1.1499999999999999 110.532 176.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 56.5 m -55.7 -49.81 72.0 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-O 121.422 0.63 . . . . 1.1799999999999999 110.483 175.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 22.9 t80 -49.75 -55.64 13.24 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-O 118.155 -0.926 . . . . 3.79 110.751 170.77 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.8 m-85 -49.61 -57.74 6.58 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 120.125 1.329 . . . . 4.21 111.161 178.408 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 30.5 p -60.05 -45.75 91.82 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 122.311 -0.243 . . . . 2.04 110.398 -172.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -66.21 -49.38 67.47 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-O 121.506 0.67 . . . . 3.54 110.488 177.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.02 -30.24 64.03 Favored 'General case' 0 C--N 1.327 -0.406 0 C-N-CA 126.011 1.724 . . . . 0.81999999999999995 110.384 -177.805 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 79.3 ttt180 -58.5 -26.11 63.1 Favored 'General case' 0 N--CA 1.449 -0.51 0 CA-C-O 117.541 -1.218 . . . . 7.1600000000000001 111.453 178.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.403 ' HB2' ' HG2' ' B' ' 37' ' ' GLU . 0.3 OUTLIER -45.05 -66.19 0.43 Allowed 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 115.87 1.804 . . . . 1.72 115.87 -156.949 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 54.5 mt-10 -90.21 -75.41 0.46 Allowed 'General case' 0 C--N 1.341 0.219 0 C-N-CA 119.604 -0.838 . . . . 3.48 111.694 -168.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.85 165.18 29.28 Favored Glycine 0 C--N 1.337 0.628 0 C-N-CA 126.891 2.186 . . . . 1.98 110.741 156.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 18.4 mmt85 36.33 105.5 0.0 OUTLIER 'General case' 0 C--O 1.242 0.67 0 N-CA-C 116.819 2.155 . . . . 5.46 116.819 136.773 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 59.7 pttt -66.09 46.76 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 126.833 2.053 . . . . 4.0700000000000003 114.448 176.059 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 21.6 t0 -148.07 -55.98 0.22 Allowed 'General case' 0 N--CA 1.461 0.115 0 C-N-CA 124.872 1.269 . . . . 4.4299999999999997 108.161 -178.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 2.6 p -81.89 117.55 22.23 Favored 'General case' 0 N--CA 1.448 -0.554 0 C-N-CA 125.791 1.636 . . . . 1.73 109.952 179.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.423 ' N ' HD12 ' B' ' 33' ' ' LEU . 7.7 mp -96.22 137.59 35.07 Favored 'General case' 0 C--O 1.224 -0.259 0 N-CA-C 108.382 -0.97 . . . . 2.2200000000000002 108.382 169.382 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . 0.457 ' C ' ' H ' ' B' ' 36' ' ' ASN . 0.8 OUTLIER -81.77 -171.5 3.38 Favored 'General case' 0 N--CA 1.446 -0.657 0 C-N-CA 128.547 2.739 . . . . 2.54 108.055 179.464 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 13.2 p -96.52 42.99 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.899 0 CA-C-O 123.454 1.597 . . . . 2.5099999999999998 108.569 164.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . 0.457 ' H ' ' C ' ' B' ' 34' ' ' SER . 0.6 OUTLIER -161.09 170.55 20.22 Favored 'General case' 0 CA--C 1.544 0.747 1 C-N-CA 141.317 7.847 . . . . 3.6800000000000002 101.403 169.592 . . . . . . . . 4 4 . 1 . 004 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.403 ' HG2' ' HB2' ' B' ' 26' ' ' GLN . 63.8 mt-10 58.0 -65.36 0.03 OUTLIER 'General case' 0 C--N 1.324 -0.531 0 CA-C-N 121.918 2.145 . . . . 1.6000000000000001 110.156 -153.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -57.62 -50.59 72.64 Favored 'General case' 0 N--CA 1.451 -0.423 0 N-CA-C 108.709 -0.849 . . . . 2.2000000000000002 108.709 177.289 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.6 ttmt -57.32 -48.58 78.6 Favored 'General case' 0 N--CA 1.45 -0.461 0 CA-C-N 116.741 -0.208 . . . . 4.4000000000000004 110.885 179.954 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 9.8 mt-10 -53.86 -38.48 64.74 Favored 'General case' 0 CA--C 1.529 0.168 0 O-C-N 121.917 -0.49 . . . . 3.6099999999999999 111.137 174.145 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 8.8 tt -68.56 -47.04 67.85 Favored 'General case' 0 N--CA 1.45 -0.428 0 N-CA-C 108.955 -0.758 . . . . 2.4199999999999999 108.955 -177.183 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.451 HG21 HD23 ' B' ' 56' ' ' LEU . 0.2 OUTLIER -65.24 -51.79 60.67 Favored 'Isoleucine or valine' 0 C--N 1.34 0.155 0 CA-C-N 118.379 0.536 . . . . 1.01 110.187 -179.535 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 63.3 m -53.39 -53.58 49.17 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.878 0.871 . . . . 0.93999999999999995 111.252 177.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -81.64 -60.44 2.25 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 122.93 0.492 . . . . 1.6799999999999999 112.139 -171.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 17.6 mm-40 -80.92 -44.19 18.64 Favored 'General case' 0 C--N 1.337 0.039 0 N-CA-C 113.808 1.04 . . . . 2.5099999999999998 113.808 -159.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . 0.423 HD23 ' HA ' ' B' ' 42' ' ' VAL . 1.2 mm? -39.89 -57.08 2.83 Favored Pre-proline 0 N--CA 1.467 0.418 0 CA-C-O 117.333 -1.317 . . . . 2.3900000000000001 112.823 -164.196 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 56.9 Cg_endo -87.22 -27.57 5.2 Favored 'Cis proline' 0 N--CA 1.45 -1.04 0 CA-C-N 120.48 1.207 . . . . 2.1499999999999999 109.506 -25.07 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 22.2 t-160 -98.72 -44.36 6.44 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.467 1.107 . . . . 2.73 110.327 -166.824 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.467 HD23 ' HG ' ' B' ' 83' ' ' LEU . 13.0 tp -29.34 -57.8 0.15 Allowed 'General case' 0 CA--C 1.537 0.442 0 C-N-CA 126.555 1.942 . . . . 1.0700000000000001 114.652 -179.058 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 72.0 mt -97.56 116.19 29.29 Favored 'General case' 0 C--N 1.338 0.095 0 N-CA-C 109.398 -0.593 . . . . 1.5700000000000001 109.398 175.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.21 178.23 8.19 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.108 0.563 . . . . 5.3099999999999996 109.617 164.414 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.326 1.0 OUTLIER 62.6 16.26 8.67 Favored 'General case' 0 N--CA 1.468 0.443 0 C-N-CA 126.761 2.025 . . . . 4.3099999999999996 114.075 176.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 19.3 m -54.76 -20.17 5.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.384 0 C-N-CA 125.812 1.645 . . . . 2.3799999999999999 113.101 171.005 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.3 -44.95 21.42 Favored Glycine 0 CA--C 1.532 1.095 0 N-CA-C 110.456 -1.058 . . . . 2.6000000000000001 110.456 166.04 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 18.4 m -92.17 40.34 1.04 Allowed 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.821 1.248 . . . . 2.5499999999999998 110.872 174.832 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.522 HD13 ' C ' ' B' ' 56' ' ' LEU . 2.6 tm? -48.36 -48.67 36.39 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-N 119.541 1.064 . . . . 1.1299999999999999 109.809 176.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -45.41 -36.73 4.5 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 126.188 1.795 . . . . 4.8300000000000001 112.819 177.663 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -64.69 -51.39 62.73 Favored 'General case' 0 C--O 1.235 0.323 0 O-C-N 121.139 -0.976 . . . . 2.8799999999999999 110.111 172.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 4.4 mmpt? -54.16 -53.61 51.04 Favored 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 107.997 -1.112 . . . . 3.3500000000000001 107.997 179.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -62.03 -42.08 98.78 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 118.876 -0.583 . . . . 2.02 110.464 -174.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 34.4 mttm -53.84 -37.17 63.34 Favored 'General case' 0 CA--C 1.536 0.416 0 CA-C-N 119.178 0.899 . . . . 3.54 112.051 171.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 9.2 m -68.86 -44.81 72.6 Favored 'General case' 0 CA--C 1.537 0.467 0 C-N-CA 122.708 0.403 . . . . 1.96 111.703 176.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 6.5 mp -69.5 -43.61 72.77 Favored 'General case' 0 N--CA 1.467 0.385 0 O-C-N 121.23 -0.919 . . . . 1.6100000000000001 111.816 179.667 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.268 16.9 t0 -62.88 -9.0 8.12 Favored 'General case' 0 C--O 1.221 -0.395 0 C-N-CA 127.874 2.469 . . . . 1.46 115.99 -166.103 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.3 m -32.26 -21.06 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.472 0.639 0 C-N-CA 130.57 3.548 . . . . 1.54 120.139 -131.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.3 p30 -53.94 -33.82 57.89 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-N 121.191 1.814 . . . . 2.4100000000000001 110.723 155.672 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 62.8 mt-30 58.92 55.33 4.59 Favored 'General case' 0 CA--C 1.53 0.191 0 C-N-CA 123.638 0.775 . . . . 4.21 109.658 -178.378 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 34.2 p30 -81.66 -34.24 30.88 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 115.331 -0.849 . . . . 2.1299999999999999 109.056 172.791 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 24.8 m 109.07 -6.23 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.527 0 C-N-CA 129.531 3.132 . . . . 1.8999999999999999 111.879 -175.413 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 9.0 mp0 -111.85 98.22 7.23 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 125.852 1.661 . . . . 5.3899999999999997 106.568 -177.193 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -76.02 91.19 3.06 Favored 'General case' 0 N--CA 1.451 -0.395 0 C-N-CA 126.674 1.99 . . . . 0.97999999999999998 106.843 177.98 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 12.3 ptmt -84.25 176.37 8.79 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 124.873 1.269 . . . . 3.1400000000000001 110.25 -177.307 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -83.73 50.24 1.76 Allowed 'General case' 0 CA--C 1.548 0.888 0 N-CA-C 114.42 1.267 . . . . 4.5 114.42 -176.687 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 5.1 t30 -162.13 49.46 0.19 Allowed 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 125.206 1.402 . . . . 2.1400000000000001 107.882 125.762 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -95.54 -58.85 2.01 Favored 'General case' 0 N--CA 1.44 -0.963 0 O-C-N 119.498 -2.001 . . . . 1.8500000000000001 108.475 131.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 61.0 t80 -46.27 -44.53 16.56 Favored 'General case' 0 C--N 1.34 0.176 0 C-N-CA 124.15 0.98 . . . . 3.5699999999999998 112.967 -173.106 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.417 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 7.7 t90 -43.2 -46.65 6.13 Favored 'General case' 0 CA--C 1.538 0.501 0 O-C-N 123.636 0.585 . . . . 4.3099999999999996 110.207 -179.138 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 4.2 mpt_? -41.57 -37.7 1.18 Allowed 'General case' 0 C--O 1.223 -0.325 0 CA-C-O 118.749 -0.643 . . . . 5.7199999999999998 111.802 -177.776 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 11.1 tp -50.34 -55.51 15.26 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 119.186 0.903 . . . . 0.92000000000000004 111.935 175.735 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 2.2 mt -71.29 -30.51 40.31 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 CA-C-N 120.183 1.356 . . . . 1.45 108.353 -178.259 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -41.77 -49.57 5.05 Favored Glycine 0 C--N 1.344 1.001 0 C-N-CA 125.687 1.613 . . . . 1.6699999999999999 111.298 166.03 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.4 mm-40 -80.51 -59.54 2.65 Favored 'General case' 0 N--CA 1.431 -1.414 0 CA-C-N 112.538 -1.831 . . . . 2.4199999999999999 108.676 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.467 ' HG ' HD23 ' B' ' 49' ' ' LEU . 8.4 mp -39.01 -56.48 1.41 Allowed 'General case' 0 N--CA 1.474 0.76 0 CA-C-N 121.374 1.897 . . . . 2.27 113.893 -174.097 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.35 -30.34 69.48 Favored 'General case' 0 CA--C 1.528 0.102 0 C-N-CA 123.146 0.578 . . . . 1.29 111.953 -177.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 14.5 ttmt -75.84 -46.58 29.66 Favored 'General case' 0 N--CA 1.446 -0.626 0 C-N-CA 123.971 0.908 . . . . 1.73 109.896 169.629 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 10.5 mm-40 -56.77 -40.86 76.59 Favored 'General case' 0 C--O 1.227 -0.115 0 CA-C-N 120.372 1.442 . . . . 2.6600000000000001 111.931 -175.577 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 5.7 tt -55.52 -32.36 30.08 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.676 0 CA-C-N 118.776 0.717 . . . . 1.04 111.657 174.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 50.2 tpt85 -81.86 -40.53 22.29 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.449 1.1 . . . . 3.6099999999999999 112.79 175.482 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 43.4 tttp -85.31 142.57 29.25 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.182 1.393 . . . . 4.2800000000000002 112.866 -157.52 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 5.6 tmtp? -84.53 -61.0 1.9 Allowed 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 122.921 0.488 . . . . 4.9199999999999999 110.374 170.6 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 50.6 tttm -172.68 20.38 0.01 OUTLIER 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 126.086 1.754 . . . . 6.0899999999999999 110.335 -173.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -89.11 55.31 3.27 Favored 'General case' 0 N--CA 1.452 -0.331 0 O-C-N 121.165 -0.959 . . . . 4.3700000000000001 109.509 -150.545 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 54.4 tp -111.18 -77.43 0.59 Allowed 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 124.707 1.203 . . . . 4.9500000000000002 108.04 -172.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 56.5 pttt -171.82 179.46 2.75 Favored 'General case' 0 C--O 1.232 0.165 0 C-N-CA 124.985 1.314 . . . . 7.8899999999999997 108.176 175.837 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 65.5 mt -92.55 -78.0 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.237 0 N-CA-C 106.843 -1.54 . . . . 10.92 106.843 168.351 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -160.07 135.34 8.09 Favored 'General case' 0 N--CA 1.455 -0.223 0 N-CA-C 107.186 -1.413 . . . . 10.85 107.186 175.878 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 18.9 tttp -179.74 136.34 0.12 Allowed 'General case' 0 C--O 1.236 0.378 0 C-N-CA 125.323 1.449 . . . . 9.1099999999999994 108.207 -178.385 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 86.1 tttt . . . . . 0 C--O 1.253 1.241 0 N-CA-C 104.005 -2.591 . . . . 6.7800000000000002 104.005 148.821 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.4 mtt . . . . . 0 N--CA 1.471 0.592 0 N-CA-C 104.325 -2.472 . . . . 7.5899999999999999 104.325 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.16 173.78 0.78 Allowed 'General case' 0 CA--C 1.534 0.336 0 CA-C-N 119.223 0.919 . . . . 3.1200000000000001 109.179 149.447 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 80.68 80.29 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 126.481 1.912 . . . . 3.5 110.096 -175.512 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -59.17 123.39 69.45 Favored Pre-proline 0 N--CA 1.448 -0.548 0 C-N-CA 126.152 1.781 . . . . 4.2000000000000002 110.064 -179.475 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.2 Cg_endo -73.41 101.46 1.36 Allowed 'Trans proline' 0 N--CA 1.452 -0.967 0 C-N-CA 122.583 2.189 . . . . 2.71 109.688 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 91.4 mt -60.08 152.17 24.85 Favored 'General case' 0 CA--C 1.535 0.376 0 CA-C-O 121.473 0.654 . . . . 1.46 110.82 175.744 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 9.4 t -69.07 151.06 46.91 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 123.823 0.849 . . . . 2.0 109.249 178.855 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.5 tt0 -39.09 -59.12 1.04 Allowed 'General case' 0 CA--C 1.527 0.084 0 C-N-CA 126.291 1.836 . . . . 3.2000000000000002 112.147 -172.688 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 10.3 mt -69.07 -46.05 68.79 Favored 'General case' 0 N--CA 1.449 -0.485 0 CA-C-O 118.435 -0.793 . . . . 1.54 111.16 -172.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 83.3 mt-10 -54.61 -48.55 72.06 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.996 0.919 . . . . 2.9399999999999999 110.597 175.979 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 3.6 tp10 -50.67 -60.8 2.66 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.984 1.314 . . . . 3.8500000000000001 109.655 171.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 54.5 p -55.92 -42.95 76.86 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 122.606 0.362 . . . . 1.48 111.478 -173.625 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.306 2.6 pp -66.34 -41.03 88.22 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.37 0 CA-C-O 117.671 -1.157 . . . . 0.76000000000000001 111.346 179.735 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -57.72 -52.72 64.28 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 120.046 1.294 . . . . 2.52 108.818 172.591 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -43.23 -43.84 4.97 Favored 'General case' 0 CA--C 1.541 0.632 0 C-N-CA 124.962 1.305 . . . . 2.0600000000000001 113.72 177.839 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 35.1 m -81.43 -39.35 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.452 0 CA-C-N 119.886 1.221 . . . . 0.73999999999999999 112.619 173.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 32.3 t -57.47 -40.8 76.71 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 C-N-CA 123.816 0.847 . . . . 0.70999999999999996 110.592 -178.237 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.7 t -59.6 -50.78 72.55 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 118.544 0.611 . . . . 0.75 110.882 176.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.2 m -57.25 -50.89 71.45 Favored 'General case' 0 CA--C 1.532 0.259 0 O-C-N 121.376 -0.828 . . . . 0.81999999999999995 110.12 177.268 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -49.1 -58.57 4.74 Favored 'General case' 0 N--CA 1.452 -0.334 0 C-N-CA 123.945 0.898 . . . . 3.0099999999999998 109.951 176.318 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 9.1 m-85 -63.15 -45.86 89.93 Favored 'General case' 0 N--CA 1.452 -0.354 0 CA-C-O 118.552 -0.737 . . . . 5.0800000000000001 111.839 -175.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.6 t -60.58 -44.7 95.92 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.506 1.048 . . . . 2.1600000000000001 110.056 -176.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.1 m-85 -61.17 -48.61 80.8 Favored 'General case' 0 C--O 1.223 -0.338 0 CA-C-O 121.127 0.489 . . . . 2.6600000000000001 111.02 172.037 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.2 -22.12 66.82 Favored 'General case' 0 N--CA 1.45 -0.442 0 O-C-N 120.953 -1.092 . . . . 1.3100000000000001 112.178 -175.67 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 2.6 tmt_? -79.04 -17.18 55.73 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 126.665 1.986 . . . . 6.21 112.378 174.239 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.437 ' HB3' ' HG3' ' A' ' 37' ' ' GLU . 6.4 tp60 -39.74 -55.28 1.96 Allowed 'General case' 0 C--N 1.344 0.335 0 CA-C-N 119.86 1.209 . . . . 2.7999999999999998 111.255 179.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -145.64 -165.39 2.18 Favored 'General case' 0 C--O 1.239 0.519 0 C-N-CA 123.94 0.896 . . . . 5.3399999999999999 109.471 178.867 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -18.28 113.58 0.01 OUTLIER Glycine 0 CA--C 1.527 0.806 0 C-N-CA 128.393 2.901 . . . . 1.8899999999999999 114.37 -166.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? 66.05 106.9 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.48 1.112 . . . . 5.0700000000000003 112.956 173.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -59.89 -26.11 65.63 Favored 'General case' 0 CA--C 1.531 0.244 0 N-CA-C 113.32 0.859 . . . . 7.0499999999999998 113.32 176.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 41.1 m-20 -90.56 9.92 27.56 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 118.577 0.626 . . . . 4.6399999999999997 111.99 -178.74 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.6 p -151.35 160.5 43.74 Favored 'General case' 0 C--O 1.24 0.568 0 O-C-N 120.908 -1.12 . . . . 1.97 111.708 174.394 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.414 HD13 ' CG ' ' A' ' 76' ' ' TYR . 3.8 mp -118.03 127.97 54.32 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 122.678 0.391 . . . . 2.9100000000000001 110.918 -172.488 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 5.7 t -81.92 172.46 13.27 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 108.502 -0.925 . . . . 2.23 108.502 174.444 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 43.1 t -67.28 -48.75 77.1 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.233 0 O-C-N 121.492 -0.755 . . . . 2.9900000000000002 110.36 -168.667 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.6 t30 -56.99 -52.03 66.87 Favored 'General case' 0 CA--C 1.529 0.136 0 N-CA-C 109.473 -0.565 . . . . 2.5499999999999998 109.473 172.252 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.437 ' HG3' ' HB3' ' A' ' 26' ' ' GLN . 7.2 tt0 -48.71 -49.58 37.3 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.349 1.46 . . . . 2.1000000000000001 110.39 -176.596 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.564 ' CZ ' HD21 ' A' ' 56' ' ' LEU . 1.9 t80 -59.47 -57.65 12.05 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 124.553 1.141 . . . . 2.7999999999999998 109.932 172.652 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 ttmp? -52.02 -44.72 64.29 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-N 117.948 0.34 . . . . 4.7599999999999998 111.78 -174.145 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -48.58 -37.79 18.93 Favored 'General case' 0 CA--C 1.532 0.277 0 N-CA-C 112.295 0.48 . . . . 2.7400000000000002 112.295 177.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -64.65 -47.27 79.1 Favored 'General case' 0 CA--C 1.529 0.157 0 N-CA-C 108.534 -0.913 . . . . 2.23 108.534 -176.028 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.539 HG21 HD23 ' A' ' 56' ' ' LEU . 28.7 m -71.01 -40.64 76.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.292 0 CA-C-N 116.287 -0.415 . . . . 1.4199999999999999 110.126 -175.827 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.8 m -61.5 -42.01 98.14 Favored 'General case' 0 N--CA 1.448 -0.556 0 C-N-CA 123.385 0.674 . . . . 1.77 110.88 175.996 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.2 tt0 -80.63 -55.6 4.73 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 123.122 0.569 . . . . 2.1099999999999999 111.478 -171.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.0 mp0 -92.97 -122.34 0.09 Allowed 'General case' 0 CA--C 1.543 0.711 0 CA-C-N 118.303 0.501 . . . . 4.2699999999999996 110.421 177.461 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.653 ' H ' HD12 ' A' ' 46' ' ' LEU . 6.9 mp 12.81 71.53 0.11 Allowed Pre-proline 0 CA--C 1.545 0.754 0 C-N-CA 129.927 3.291 . . . . 2.4300000000000002 115.502 -174.018 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.8 Cg_endo -67.59 -52.22 0.6 Allowed 'Trans proline' 0 N--CA 1.454 -0.83 0 C-N-CA 123.055 2.504 . . . . 1.6599999999999999 113.263 -177.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 18.4 t-80 -136.0 61.58 1.64 Allowed 'General case' 0 N--CA 1.464 0.239 0 CA-C-O 121.78 0.8 . . . . 3.1299999999999999 110.081 -168.637 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.674 HD21 ' HB2' ' A' ' 83' ' ' LEU . 5.9 tp -143.94 -118.72 0.09 Allowed 'General case' 0 N--CA 1.45 -0.46 0 CA-C-N 114.876 -1.056 . . . . 1.8799999999999999 108.477 -164.459 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 68.2 mt -68.56 77.83 0.28 Allowed 'General case' 0 C--N 1.34 0.164 0 N-CA-C 108.524 -0.917 . . . . 2.7999999999999998 108.524 163.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.4 pttp -66.65 -168.91 0.07 Allowed 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.43 -0.805 . . . . 5.3300000000000001 110.433 172.063 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 13.1 m-20 63.93 37.84 9.19 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 124.698 1.199 . . . . 3.5499999999999998 109.46 178.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -63.02 -22.38 30.52 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 124.796 1.238 . . . . 2.0800000000000001 111.742 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -49.82 -35.82 24.98 Favored Glycine 0 CA--C 1.532 1.117 0 N-CA-C 111.235 -0.746 . . . . 1.98 111.235 166.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 13.8 t -108.06 46.59 0.94 Allowed 'General case' 0 CA--C 1.536 0.416 0 C-N-CA 125.118 1.367 . . . . 2.4500000000000002 109.55 173.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.564 HD21 ' CZ ' ' A' ' 38' ' ' PHE . 2.4 tm? -55.39 -46.5 76.56 Favored 'General case' 0 N--CA 1.453 -0.307 0 O-C-N 121.077 -1.015 . . . . 1.23 109.342 167.55 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -62.63 -22.82 66.71 Favored 'General case' 0 CA--C 1.539 0.547 0 C-N-CA 124.355 1.062 . . . . 5.2999999999999998 111.775 -169.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 41.1 tt0 -62.34 -48.73 78.52 Favored 'General case' 0 CA--C 1.539 0.52 0 O-C-N 120.801 -1.187 . . . . 3.27 110.437 166.286 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -60.23 -37.78 81.37 Favored 'General case' 0 C--O 1.225 -0.232 0 O-C-N 121.441 -0.787 . . . . 3.25 109.406 174.266 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 3.0 ttp -53.33 -53.47 50.53 Favored 'General case' 0 N--CA 1.465 0.295 0 CA-C-N 118.952 0.797 . . . . 1.8799999999999999 109.876 173.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 98.8 mttt -57.21 -41.63 79.81 Favored 'General case' 0 CA--C 1.532 0.268 0 CA-C-O 119.207 -0.425 . . . . 3.2599999999999998 112.021 177.566 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 28.8 t -55.79 -57.47 11.89 Favored 'General case' 0 C--N 1.341 0.227 0 CA-C-N 118.908 0.776 . . . . 2.2200000000000002 110.159 172.767 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 40.6 mt -58.97 -53.31 59.87 Favored 'General case' 0 N--CA 1.454 -0.27 0 C-N-CA 124.435 1.094 . . . . 1.5600000000000001 110.971 -171.259 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -68.96 81.05 0.31 Allowed 'General case' 0 N--CA 1.448 -0.534 0 O-C-N 123.66 0.6 . . . . 2.1200000000000001 109.461 178.858 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.8 m -47.27 -33.34 2.64 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.403 0 C-N-CA 124.252 1.021 . . . . 1.8200000000000001 111.722 172.468 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 25.6 p-10 -92.83 -11.5 33.49 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 113.636 0.976 . . . . 2.2400000000000002 113.636 179.824 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.8 tt0 45.41 59.02 3.79 Favored 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 125.587 1.555 . . . . 3.3999999999999999 111.208 -176.389 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 5.1 p30 -77.73 -98.88 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 106.316 -1.735 . . . . 3.29 106.316 164.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.1 m 178.72 44.27 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.341 0 C-N-CA 130.949 3.699 . . . . 1.8 106.003 162.091 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -152.66 109.34 3.45 Favored 'General case' 0 CA--C 1.516 -0.349 0 N-CA-C 105.792 -1.929 . . . . 4.0099999999999998 105.792 -169.07 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -84.7 94.75 8.73 Favored 'General case' 0 N--CA 1.442 -0.87 0 N-CA-C 105.443 -2.058 . . . . 0.90000000000000002 105.443 -176.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.54 151.67 45.87 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 107.858 -1.164 . . . . 3.2400000000000002 107.858 175.35 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 39.4 p90 -39.13 -54.11 1.78 Allowed 'General case' 0 CA--C 1.535 0.384 0 N-CA-C 113.593 0.96 . . . . 5.8600000000000003 113.593 -171.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.9 t30 -73.35 -26.95 61.24 Favored 'General case' 0 CA--C 1.538 0.516 0 N-CA-C 112.553 0.575 . . . . 1.78 112.553 -176.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -65.32 -59.65 3.82 Favored 'General case' 0 C--N 1.342 0.244 0 N-CA-C 108.08 -1.082 . . . . 2.1299999999999999 108.08 169.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.414 ' CG ' HD13 ' A' ' 33' ' ' LEU . 56.7 t80 -49.92 -49.53 49.49 Favored 'General case' 0 CA--C 1.518 -0.276 0 C-N-CA 124.044 0.937 . . . . 3.21 110.463 -177.189 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 1.3 t-105 -39.61 -42.41 1.18 Allowed 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 125.266 1.426 . . . . 4.1600000000000001 111.393 -178.844 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 4.1 ttm180 -49.13 -38.98 26.87 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-O 117.994 -1.003 . . . . 3.7400000000000002 112.102 -178.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 tp -46.43 -48.12 18.87 Favored 'General case' 0 N--CA 1.451 -0.393 0 CA-C-N 119.088 0.858 . . . . 0.96999999999999997 110.763 178.485 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.6 mp -60.78 -34.44 59.12 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.665 0 N-CA-C 108.0 -1.111 . . . . 1.8400000000000001 108.0 -177.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.569 ' HA3' ' CE2' ' B' ' 77' ' ' TRP . . . -70.4 -48.45 37.3 Favored Glycine 0 CA--C 1.491 -1.415 0 C-N-CA 124.217 0.913 . . . . 1.26 110.904 -178.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.18 -58.69 7.54 Favored 'General case' 0 N--CA 1.433 -1.315 0 N-CA-C 104.503 -2.406 . . . . 2.7400000000000002 104.503 -178.316 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.674 ' HB2' HD21 ' A' ' 49' ' ' LEU 0.26 3.8 pp -56.01 -40.95 74.15 Favored 'General case' 0 CA--C 1.545 0.759 0 N-CA-C 114.703 1.372 . . . . 2.0499999999999998 114.703 177.324 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.79 -23.87 66.49 Favored 'General case' 0 N--CA 1.466 0.346 0 CA-C-N 118.793 0.724 . . . . 1.4399999999999999 112.27 174.81 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 11.0 ttmt -80.91 -44.69 17.9 Favored 'General case' 0 N--CA 1.448 -0.555 0 C-N-CA 125.415 1.486 . . . . 1.9099999999999999 109.514 168.529 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.427 ' CD ' ' HZ2' ' A' ' 89' ' ' LYS . 36.7 mm-40 -61.84 -34.21 75.55 Favored 'General case' 0 C--N 1.34 0.164 0 CA-C-N 120.061 1.3 . . . . 2.2400000000000002 111.419 -172.149 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.4 tt -49.04 -37.7 10.0 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-N 118.114 0.415 . . . . 1.3700000000000001 111.955 171.849 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.66 -53.96 4.51 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.246 1.018 . . . . 5.3600000000000003 109.056 176.631 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.427 ' HZ2' ' CD ' ' A' ' 86' ' ' GLU . 3.1 ttpm? -78.38 49.55 0.86 Allowed 'General case' 0 N--CA 1.437 -1.122 0 C-N-CA 125.601 1.56 . . . . 3.7200000000000002 112.826 -170.002 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 15.2 ptmt -81.95 -19.1 41.36 Favored 'General case' 0 N--CA 1.451 -0.393 0 C-N-CA 124.773 1.229 . . . . 8.6099999999999994 113.876 -174.922 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 7.1 tptm -173.62 -41.88 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.298 0 CA-C-N 119.584 1.084 . . . . 8.8599999999999994 111.426 -177.589 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 67.25 8.69 6.41 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 114.103 1.149 . . . . 5.7999999999999998 114.103 159.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 43.5 tp -110.12 -76.21 0.61 Allowed 'General case' 0 N--CA 1.442 -0.843 0 N-CA-C 107.173 -1.417 . . . . 9.3000000000000007 107.173 -178.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 31.2 mmtp -83.05 67.13 8.99 Favored 'General case' 0 CA--C 1.533 0.29 0 O-C-N 121.372 -0.83 . . . . 13.01 112.105 -172.782 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 2.239 1.2 pp 57.21 -97.08 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 N-CA-C 115.279 1.585 . . . . 13.51 115.279 147.489 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 94.3 mtt-85 57.52 -93.67 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 128.305 2.642 . . . . 11.449999999999999 111.244 -164.909 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -177.53 139.64 0.25 Allowed 'General case' 0 C--O 1.237 0.413 0 N-CA-C 106.184 -1.784 . . . . 14.19 106.184 -159.107 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.545 ' HD3' ' H ' ' A' ' 98' ' ' LYS . 0.1 OUTLIER . . . . . 0 C--O 1.256 1.435 0 N-CA-C 101.288 -3.597 . . . . 14.039999999999999 101.288 128.509 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.476 0.843 0 N-CA-C 109.989 -0.374 . . . . 6.4800000000000004 109.989 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -176.67 -176.79 0.75 Allowed 'General case' 0 C--O 1.234 0.28 0 C-N-CA 126.235 1.814 . . . . 4.54 107.702 -175.677 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 76.9 104.91 0.07 Allowed 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 115.659 1.726 . . . . 3.9900000000000002 115.659 143.62 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 mt-10 -153.0 159.32 32.38 Favored Pre-proline 0 CA--C 1.538 0.507 0 C-N-CA 125.562 1.545 . . . . 7.9100000000000001 107.618 161.794 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -79.85 153.02 22.44 Favored 'Trans proline' 0 CA--C 1.535 0.539 0 C-N-CA 124.397 3.398 . . . . 3.2200000000000002 109.886 173.161 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 44.1 mt -139.37 172.2 13.17 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.772 0.656 . . . . 2.3399999999999999 112.772 -153.457 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 10.2 t -89.36 -132.04 0.09 Allowed 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 125.04 1.336 . . . . 1.8 110.513 171.238 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -92.44 -59.06 2.17 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 125.111 1.365 . . . . 2.1099999999999999 114.03 175.789 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.5 mt -62.93 -50.33 71.24 Favored 'General case' 0 N--CA 1.471 0.575 0 O-C-N 120.846 -1.159 . . . . 1.0600000000000001 111.482 -173.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.549 ' HG2' HD22 ' A' ' 49' ' ' LEU . 0.0 OUTLIER -88.02 115.22 25.34 Favored 'General case' 0 C--N 1.321 -0.643 0 N-CA-C 100.433 -3.914 . . . . 4.8200000000000003 100.433 138.399 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -54.67 -50.98 66.93 Favored 'General case' 0 C--N 1.342 0.271 1 C-N-CA 133.753 4.821 . . . . 3.6800000000000002 118.752 19.719 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 52.7 p -51.74 -40.05 59.55 Favored 'General case' 0 CA--C 1.537 0.475 0 N-CA-C 113.474 0.916 . . . . 1.45 113.474 -155.349 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.56 HD12 ' N ' ' B' ' 14' ' ' GLU . 2.7 pp -57.34 -42.68 80.85 Favored 'Isoleucine or valine' 0 C--N 1.339 0.134 0 N-CA-C 112.837 0.68 . . . . 1.03 112.837 174.103 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . 0.56 ' N ' HD12 ' B' ' 13' ' ' ILE . 1.2 tm-20 -60.2 -50.04 75.22 Favored 'General case' 0 N--CA 1.452 -0.357 0 N-CA-C 107.867 -1.16 . . . . 2.4199999999999999 107.867 173.544 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -50.05 -38.69 39.2 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.526 0.73 . . . . 2.5600000000000001 112.882 -178.529 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 35.8 m -80.36 -40.54 19.88 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.504 0 O-C-N 121.124 -0.985 . . . . 1.1399999999999999 111.924 171.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 18.0 t -55.22 -43.99 73.05 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.248 0 C-N-CA 123.645 0.778 . . . . 1.1200000000000001 111.308 179.899 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 10.2 t -57.26 -49.05 77.27 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 119.233 0.924 . . . . 1.3200000000000001 110.428 176.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 34.6 m -57.61 -52.68 64.45 Favored 'General case' 0 N--CA 1.453 -0.284 0 N-CA-C 109.753 -0.462 . . . . 1.28 109.753 176.958 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -46.47 -51.82 14.44 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 124.407 1.083 . . . . 4.4100000000000001 111.395 174.131 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -66.18 -53.87 32.11 Favored 'General case' 0 N--CA 1.452 -0.368 0 CA-C-O 121.088 0.47 . . . . 3.6699999999999999 109.8 -173.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 1.3 t -64.55 -32.66 74.4 Favored 'General case' 0 CA--C 1.534 0.346 0 O-C-N 122.092 -0.38 . . . . 3.3300000000000001 110.363 -176.159 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 2.9 t80 -61.35 -59.03 5.91 Favored 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 124.591 1.157 . . . . 5.6100000000000003 110.238 170.33 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.48 -22.94 35.8 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 126.638 1.975 . . . . 1.1000000000000001 112.033 -178.626 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -58.15 -18.01 22.58 Favored 'General case' 0 CA--C 1.534 0.338 0 CA-C-O 117.678 -1.153 . . . . 4.75 113.456 171.849 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 2.4 tp60 -45.99 -62.37 1.35 Allowed 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 115.237 1.569 . . . . 2.7000000000000002 115.237 -172.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 7.8 mt-10 -73.11 -42.5 62.89 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 116.174 1.916 . . . . 5.2400000000000002 116.174 -152.425 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -80.35 -88.29 0.55 Allowed Glycine 0 CA--C 1.528 0.874 0 C-N-CA 130.015 3.674 . . . . 2.8199999999999998 115.1 18.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 mmt180 43.49 72.88 0.16 Allowed 'General case' 0 C--O 1.237 0.44 0 O-C-N 121.864 -0.786 . . . . 4.5899999999999999 109.092 -163.272 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -77.62 61.23 2.31 Favored 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 124.951 1.3 . . . . 5.2400000000000002 111.064 -174.164 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 17.2 t70 -168.66 -59.7 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 127.286 2.234 . . . . 4.3899999999999997 106.658 171.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 4.1 p -83.86 149.41 26.39 Favored 'General case' 0 N--CA 1.442 -0.848 0 CA-C-N 115.72 -0.673 . . . . 1.8100000000000001 111.164 -174.05 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -107.12 128.64 54.57 Favored 'General case' 0 N--CA 1.455 -0.207 0 N-CA-C 107.951 -1.129 . . . . 2.27 107.951 174.573 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 52.8 m -114.11 174.65 5.84 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 119.335 0.97 . . . . 2.9199999999999999 108.851 166.322 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 12.7 p -84.88 56.1 0.14 Allowed 'Isoleucine or valine' 0 C--O 1.226 -0.167 0 O-C-N 120.826 -1.171 . . . . 2.6600000000000001 111.45 -174.977 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -152.9 55.89 0.78 Allowed 'General case' 0 N--CA 1.455 -0.209 0 CA-C-O 123.683 1.706 . . . . 2.1699999999999999 108.24 130.515 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -141.49 -57.51 0.48 Allowed 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 130.408 3.483 . . . . 1.9399999999999999 101.976 164.142 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -40.76 -52.82 2.93 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 124.206 1.003 . . . . 2.5600000000000001 112.616 -177.232 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 20.8 ttmt -68.19 -28.04 66.93 Favored 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 112.373 0.509 . . . . 2.9100000000000001 112.373 -177.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 61.6 mm-40 -66.91 -35.53 80.22 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 121.376 -0.827 . . . . 3.4500000000000002 110.886 -178.242 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.2 tm? -65.52 -49.13 70.11 Favored 'General case' 0 C--O 1.235 0.311 0 O-C-N 121.324 -0.86 . . . . 2.5699999999999998 109.181 -176.338 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -62.56 -44.07 99.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.328 0 CA-C-N 114.957 -1.019 . . . . 0.73999999999999999 109.217 -176.218 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 99.4 m -57.31 -55.65 32.04 Favored 'General case' 0 CA--C 1.538 0.501 0 C-N-CA 123.583 0.753 . . . . 1.04 111.257 172.555 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 18.1 tt0 -80.9 -62.61 1.62 Allowed 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 123.349 0.66 . . . . 1.97 112.443 -162.211 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 14.7 mp0 -82.41 -39.87 22.06 Favored 'General case' 0 N--CA 1.463 0.189 0 O-C-N 121.805 -0.559 . . . . 2.9700000000000002 111.985 -173.841 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -84.62 -12.77 0.19 Allowed Pre-proline 0 CA--C 1.544 0.746 1 N-CA-C 121.954 4.057 . . . . 2.1200000000000001 121.954 -153.919 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.6 Cg_endo -49.89 -41.46 47.39 Favored 'Trans proline' 0 CA--C 1.535 0.569 0 C-N-CA 122.726 2.284 . . . . 1.8999999999999999 116.676 -147.644 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 61.5 t-80 -86.77 50.03 1.93 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 120.795 1.634 . . . . 3.3500000000000001 109.415 -174.654 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.525 HD23 ' HB2' ' B' ' 83' ' ' LEU . 10.3 tp -151.18 -82.52 0.1 Allowed 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.076 0.55 . . . . 1.03 110.444 -175.877 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 69.9 mt -80.64 70.95 7.48 Favored 'General case' 0 CA--C 1.522 -0.117 0 N-CA-C 108.501 -0.926 . . . . 1.5900000000000001 108.501 171.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -48.05 137.53 10.27 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.513 -0.921 . . . . 6.0800000000000001 108.513 155.27 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 16.2 t0 70.71 79.07 0.18 Allowed 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 126.021 1.728 . . . . 3.3500000000000001 109.869 -156.641 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 18.1 m -90.47 6.87 4.52 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.501 0 CA-C-N 114.085 -1.416 . . . . 1.52 110.209 160.052 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -89.16 -65.13 1.27 Allowed Glycine 0 C--N 1.341 0.854 0 N-CA-C 108.123 -1.991 . . . . 2.2999999999999998 108.123 -171.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 13.0 t -78.17 50.04 0.87 Allowed 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.104 0.961 . . . . 2.6499999999999999 108.493 172.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -62.68 -41.47 99.12 Favored 'General case' 0 N--CA 1.445 -0.681 0 O-C-N 120.469 -1.394 . . . . 1.1599999999999999 108.214 171.323 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -60.55 -32.33 71.39 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 125.689 1.596 . . . . 4.3499999999999996 110.338 -170.734 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 19.0 tt0 -56.8 -55.73 30.63 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.646 1.179 . . . . 2.3799999999999999 110.615 167.21 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.17 -48.52 73.66 Favored 'General case' 0 C--N 1.343 0.295 0 N-CA-C 108.184 -1.043 . . . . 3.9399999999999999 108.184 177.682 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -48.88 -51.01 32.17 Favored 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 123.576 0.75 . . . . 1.77 110.411 177.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 2.1 tptp -49.28 -46.76 46.8 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.379 0.671 . . . . 3.3999999999999999 111.494 177.035 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 10.0 t -71.16 -39.22 72.03 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 122.95 0.5 . . . . 2.1400000000000001 111.417 179.881 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 41.0 mt -68.63 -46.66 68.62 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 124.583 1.153 . . . . 1.6299999999999999 110.826 -174.897 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 26.0 t0 -61.46 -10.31 7.39 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.694 2.398 . . . . 1.6399999999999999 115.989 -173.985 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 1.1 p -33.49 -18.3 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.529 1 C-N-CA 132.607 4.363 . . . . 2.8199999999999998 119.956 -141.095 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -50.33 -38.3 41.14 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-N 120.053 1.297 . . . . 3.2400000000000002 109.476 156.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 8.6 tt0 70.94 67.68 0.17 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 126.626 1.97 . . . . 3.27 109.303 -177.888 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 16.5 p30 -126.97 -13.66 5.7 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.463 1.905 . . . . 1.97 113.525 -174.055 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 4.5 m 88.53 -10.0 0.48 Allowed 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 127.203 2.201 . . . . 2.2200000000000002 114.061 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -111.57 115.04 28.51 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-N 119.346 0.975 . . . . 3.3199999999999998 108.922 176.807 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -83.73 97.53 9.18 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 106.016 -1.846 . . . . 1.3500000000000001 106.016 173.241 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -82.95 178.28 8.23 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 118.71 0.686 . . . . 4.2800000000000002 110.67 -178.184 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 42.3 p90 -82.8 52.56 2.16 Favored 'General case' 0 CA--C 1.544 0.738 0 N-CA-C 114.066 1.136 . . . . 5.5599999999999996 114.066 -166.9 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -162.69 47.35 0.15 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.465 -1.309 . . . . 2.3700000000000001 107.465 126.578 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -96.18 -63.79 1.11 Allowed 'General case' 0 N--CA 1.447 -0.621 0 O-C-N 120.046 -1.658 . . . . 2.0699999999999998 109.057 153.681 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 7.9 t80 -50.12 -43.63 51.89 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 125.992 1.717 . . . . 3.48 110.543 -175.759 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 7.7 t-105 -41.78 -43.55 2.97 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.943 0.897 . . . . 4.5999999999999996 111.637 176.24 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 21.6 mtt180 -45.53 -44.57 12.76 Favored 'General case' 0 CA--C 1.535 0.374 0 CA-C-N 118.615 0.643 . . . . 4.1600000000000001 111.382 178.319 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.0 tp -53.72 -39.47 65.27 Favored 'General case' 0 N--CA 1.452 -0.369 0 C-N-CA 123.337 0.655 . . . . 0.87 111.39 179.833 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 62.5 mt -65.28 -32.73 59.52 Favored 'Isoleucine or valine' 0 N--CA 1.442 -0.872 0 N-CA-C 106.688 -1.597 . . . . 1.3600000000000001 106.688 -177.758 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.559 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -69.22 -44.95 63.47 Favored Glycine 0 CA--C 1.496 -1.152 0 N-CA-C 110.297 -1.121 . . . . 1.45 110.297 -178.747 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . 0.442 ' OE2' ' NZ ' ' B' ' 85' ' ' LYS . 3.2 mm-40 -66.17 -62.27 1.58 Allowed 'General case' 0 N--CA 1.431 -1.409 0 N-CA-C 106.867 -1.531 . . . . 2.1800000000000002 106.867 -179.382 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.525 ' HB2' HD23 ' B' ' 49' ' ' LEU . 3.7 pp -54.42 -37.06 64.66 Favored 'General case' 0 CA--C 1.531 0.238 0 CA-C-N 119.466 1.03 . . . . 1.76 112.452 -178.506 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.69 -61.44 2.62 Favored 'General case' 0 N--CA 1.452 -0.33 0 CA-C-N 118.549 0.613 . . . . 2.02 109.869 173.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . 0.442 ' NZ ' ' OE2' ' B' ' 82' ' ' GLU . 2.1 ptpp? -66.73 -23.76 66.14 Favored 'General case' 0 N--CA 1.45 -0.469 0 CA-C-O 118.037 -0.982 . . . . 1.45 111.789 -173.457 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 29.0 mm-40 -53.11 -25.67 13.88 Favored 'General case' 0 N--CA 1.465 0.302 0 C-N-CA 125.993 1.717 . . . . 3.0800000000000001 111.656 173.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 3.8 tt -59.57 -36.27 64.08 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.771 0 CA-C-N 118.709 0.686 . . . . 1.01 110.447 172.753 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 30.0 ttt-85 -82.91 -48.23 10.93 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 125.801 1.641 . . . . 4.0300000000000002 112.011 169.527 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 43.5 tttm -86.09 126.45 34.2 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.934 1.694 . . . . 6.5099999999999998 112.043 -159.341 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . 0.413 ' HG2' ' H ' ' B' ' 90' ' ' LYS . 40.8 pttt -82.85 -55.78 4.21 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 125.299 1.44 . . . . 6.3099999999999996 110.26 169.033 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 6.1 mmtp -163.71 18.34 0.07 Allowed 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 126.392 1.877 . . . . 6.21 110.529 -169.009 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -85.74 54.58 3.18 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 126.921 2.088 . . . . 4.4199999999999999 108.468 -163.974 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -99.86 -94.78 0.26 Allowed 'General case' 0 N--CA 1.455 -0.225 0 C-N-CA 124.613 1.165 . . . . 5.0700000000000003 108.653 175.377 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt 41.78 61.42 1.89 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 125.62 1.568 . . . . 7.2999999999999998 113.558 176.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 24.7 pt -132.0 155.56 41.69 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.164 0 C-N-CA 124.306 1.043 . . . . 8.2599999999999998 108.654 171.764 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -170.63 150.27 3.33 Favored 'General case' 0 N--CA 1.456 -0.142 0 C-N-CA 125.676 1.59 . . . . 8.1400000000000006 107.676 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -176.86 137.57 0.25 Allowed 'General case' 0 CA--C 1.532 0.287 0 N-CA-C 106.069 -1.826 . . . . 8.0 106.069 -172.895 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.251 1.142 0 N-CA-C 108.15 -1.056 . . . . 6.5099999999999998 108.15 177.488 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.7 mtt . . . . . 0 N--CA 1.47 0.541 0 CA-C-O 119.464 -0.303 . . . . 9.1699999999999999 111.301 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -178.69 158.62 1.03 Allowed 'General case' 0 N--CA 1.457 -0.114 0 C-N-CA 125.831 1.652 . . . . 3.8500000000000001 107.581 -174.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 56.66 58.63 4.01 Favored 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 124.119 0.968 . . . . 4.7000000000000002 110.752 -176.353 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.3 pt-20 -149.71 54.75 1.66 Allowed Pre-proline 0 CA--C 1.542 0.638 0 C-N-CA 125.615 1.566 . . . . 7.9400000000000004 109.955 -172.872 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -82.5 -13.93 9.47 Favored 'Trans proline' 0 N--CA 1.459 -0.538 0 C-N-CA 122.964 2.443 . . . . 7.4400000000000004 113.291 -173.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 58.5 mt -72.23 134.8 45.82 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 123.38 0.672 . . . . 2.2799999999999998 110.737 -162.255 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.6 t -63.52 -61.65 2.19 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.916 0.886 . . . . 3.6200000000000001 112.062 -170.317 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -177.97 -75.32 0.01 OUTLIER 'General case' 0 CA--C 1.53 0.189 0 C-N-CA 126.253 1.821 . . . . 3.3100000000000001 106.475 -175.438 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -49.06 -42.93 40.26 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.471 0.708 . . . . 1.25 111.154 171.88 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -49.64 -44.0 47.26 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.586 1.154 . . . . 2.2400000000000002 112.497 174.018 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -54.59 -49.55 70.14 Favored 'General case' 0 CA--C 1.533 0.307 0 CA-C-N 118.982 0.81 . . . . 3.8100000000000001 109.229 177.158 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 32.3 t -63.78 -54.2 38.94 Favored 'General case' 0 C--O 1.232 0.171 0 CA-C-N 115.762 -0.654 . . . . 2.2599999999999998 109.812 -176.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.515 HG21 HD12 ' B' ' 83' ' ' LEU 0.352 2.8 pp -62.81 -34.6 66.77 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.167 0 C-N-CA 118.503 -1.279 . . . . 0.79000000000000004 112.562 -178.042 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -61.06 -56.64 18.66 Favored 'General case' 0 N--CA 1.453 -0.303 0 CA-C-N 119.352 0.978 . . . . 2.8599999999999999 108.95 173.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -53.88 -39.31 65.6 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-O 121.878 0.847 . . . . 1.3899999999999999 111.556 -171.798 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 5.8 m -75.23 -37.43 39.4 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.516 0 O-C-N 120.798 -1.189 . . . . 0.90000000000000002 111.815 175.644 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 28.3 t -58.66 -48.68 85.08 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.4 0 CA-C-N 119.808 1.186 . . . . 0.88 110.803 174.225 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -59.52 -38.32 80.67 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 120.853 -1.154 . . . . 0.98999999999999999 110.347 175.351 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.0 m -56.14 -49.82 72.85 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 118.669 0.668 . . . . 1.02 110.115 171.482 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.3 m-30 -50.99 -52.7 40.11 Favored 'General case' 0 C--N 1.342 0.276 0 CA-C-N 118.613 0.642 . . . . 5.0099999999999998 109.805 176.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -55.94 -58.21 8.83 Favored 'General case' 0 CA--C 1.531 0.249 0 N-CA-C 112.199 0.444 . . . . 3.4900000000000002 112.199 -179.551 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -65.07 -24.31 67.42 Favored 'General case' 0 CA--C 1.537 0.468 0 CA-C-O 121.152 0.501 . . . . 2.3799999999999999 111.397 -175.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.512 ' CZ ' ' HB2' ' A' ' 41' ' ' LEU . 8.1 t80 -80.55 -51.77 8.38 Favored 'General case' 0 C--O 1.222 -0.391 0 C-N-CA 124.271 1.028 . . . . 4.5499999999999998 112.711 179.068 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.7 -22.89 65.73 Favored 'General case' 0 C--O 1.24 0.59 0 C-N-CA 126.352 1.861 . . . . 1.52 113.065 -166.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.3 ppt_? -69.12 -19.8 64.04 Favored 'General case' 0 N--CA 1.451 -0.416 0 C-N-CA 125.215 1.406 . . . . 4.6900000000000004 112.385 175.575 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -41.9 -62.19 0.96 Allowed 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.396 0.998 . . . . 2.8199999999999998 113.041 -172.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 57.7 mt-10 -127.37 106.8 9.45 Favored 'General case' 0 N--CA 1.451 -0.424 0 C-N-CA 126.495 1.918 . . . . 3.8599999999999999 105.93 -175.68 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 62.56 118.11 0.01 OUTLIER Glycine 0 CA--C 1.534 1.269 0 CA-C-N 118.822 0.737 . . . . 2.3999999999999999 113.763 169.654 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 30.0 ttm180 63.41 102.85 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.225 0 CA-C-O 121.794 0.806 . . . . 4.8899999999999997 113.006 162.63 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt -73.06 59.96 0.54 Allowed 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 124.219 1.007 . . . . 5.9299999999999997 112.845 -177.256 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -156.19 -62.76 0.11 Allowed 'General case' 0 C--O 1.231 0.091 0 C-N-CA 128.023 2.529 . . . . 3.6899999999999999 106.404 177.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.0 p -84.13 135.55 34.34 Favored 'General case' 0 N--CA 1.442 -0.851 0 C-N-CA 123.666 0.786 . . . . 2.1200000000000001 110.993 -174.071 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.2 mm? -88.93 143.6 26.76 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 108.418 -0.956 . . . . 2.4500000000000002 108.418 168.109 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 74.9 m -111.9 175.86 5.26 Favored 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 123.349 0.659 . . . . 2.0499999999999998 109.952 168.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.9 p -57.05 -50.22 77.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.447 0 N-CA-C 114.008 1.114 . . . . 3.0899999999999999 114.008 -164.327 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.2 t30 -64.94 -50.41 66.54 Favored 'General case' 0 N--CA 1.463 0.209 0 CA-C-N 118.697 0.68 . . . . 3.1899999999999999 109.184 -177.089 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.5 mt-10 -37.02 -57.85 0.81 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 125.149 1.38 . . . . 2.2799999999999998 110.097 166.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.1 OUTLIER -53.49 -55.6 23.99 Favored 'General case' 0 N--CA 1.452 -0.367 0 O-C-N 121.917 -0.489 . . . . 3.1200000000000001 110.75 178.906 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -55.84 -41.94 75.05 Favored 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 120.658 -0.417 . . . . 4.2199999999999998 111.505 -177.414 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -49.94 -44.09 50.34 Favored 'General case' 0 C--O 1.224 -0.256 0 CA-C-N 118.159 0.436 . . . . 2.8999999999999999 111.022 177.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.512 ' HB2' ' CZ ' ' A' ' 23' ' ' PHE . 9.6 tp -66.47 -47.58 72.63 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.831 0.741 . . . . 2.73 109.323 -173.195 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 23.3 m -74.12 -29.13 24.51 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 CA-C-N 115.041 -0.981 . . . . 1.6599999999999999 109.951 -171.58 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 84.8 m -78.05 -47.04 19.27 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 123.712 0.805 . . . . 2.3599999999999999 110.263 176.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -81.39 -59.95 2.44 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 124.373 1.069 . . . . 2.79 111.93 -171.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.459 HE21 HD12 ' A' ' 41' ' ' LEU . 3.3 mp0 -76.8 -51.8 10.69 Favored 'General case' 0 C--N 1.338 0.083 0 O-C-N 122.101 -0.375 . . . . 4.4100000000000001 110.206 -169.985 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 8.1 mp -81.69 114.44 50.04 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 124.846 1.258 . . . . 1.9299999999999999 110.033 -171.623 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 71.3 Cg_endo -84.79 -58.96 0.02 OUTLIER 'Trans proline' 0 N--CA 1.448 -1.195 0 C-N-CA 122.965 2.444 . . . . 2.1099999999999999 110.304 -174.34 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -141.26 9.03 2.06 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 124.068 0.947 . . . . 4.4900000000000002 113.442 -168.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 9.4 tp -55.68 -78.88 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 122.073 0.939 . . . . 1.8700000000000001 109.348 171.148 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 18.6 mt -79.4 -55.88 4.74 Favored 'General case' 0 N--CA 1.447 -0.609 0 N-CA-C 108.539 -0.912 . . . . 3.6899999999999999 108.539 178.75 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 39.79 38.14 0.41 Allowed 'General case' 0 N--CA 1.473 0.707 0 C-N-CA 126.467 1.907 . . . . 5.4900000000000002 112.331 -168.507 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 62.2 t0 -108.37 12.51 26.28 Favored 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 130.137 3.375 . . . . 6.1500000000000004 108.616 -175.769 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 18.8 m -66.25 -22.43 30.2 Favored 'Isoleucine or valine' 0 C--N 1.341 0.207 0 C-N-CA 124.738 1.215 . . . . 2.2799999999999998 112.172 -171.781 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -53.6 -32.55 46.63 Favored Glycine 0 CA--C 1.529 0.967 0 N-CA-C 111.009 -0.836 . . . . 3.3300000000000001 111.009 169.658 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 18.7 m -124.22 60.42 1.14 Allowed 'General case' 0 N--CA 1.451 -0.419 0 C-N-CA 124.186 0.994 . . . . 3.0600000000000001 108.928 178.591 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -74.37 -38.65 63.12 Favored 'General case' 0 N--CA 1.446 -0.668 0 C-N-CA 124.792 1.237 . . . . 1.77 110.172 176.096 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.4 p-10 -54.51 -50.84 66.88 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 123.406 0.682 . . . . 4.3700000000000001 111.415 -173.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 3.8 pt-20 -57.21 -41.44 79.42 Favored 'General case' 0 CA--C 1.531 0.247 0 O-C-N 121.897 -0.502 . . . . 2.7999999999999998 111.713 177.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.04 -59.33 5.44 Favored 'General case' 0 CA--C 1.532 0.278 0 N-CA-C 108.36 -0.978 . . . . 2.6099999999999999 108.36 173.122 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -46.84 -51.48 16.5 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 123.202 0.601 . . . . 1.52 111.001 -178.372 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 82.4 mttt -56.99 -47.6 80.42 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 123.665 0.786 . . . . 3.3300000000000001 110.72 177.6 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 45.6 m -59.62 -39.67 85.06 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 122.195 -0.316 . . . . 1.8500000000000001 111.419 179.169 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.2 mp -69.81 -49.43 52.83 Favored 'General case' 0 CA--C 1.53 0.18 0 O-C-N 121.933 -0.479 . . . . 1.79 110.812 176.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 44.1 t0 -76.85 62.28 2.04 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.661 0.784 . . . . 1.8200000000000001 110.043 -176.718 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.6 m -56.78 -31.32 35.12 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 C-N-CA 124.698 1.199 . . . . 1.78 112.194 -176.101 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -88.8 -3.0 58.87 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.558 1.543 . . . . 2.5800000000000001 112.057 178.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 29.9 mt-30 54.87 63.35 2.16 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 125.6 1.56 . . . . 4.21 111.982 165.042 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 20.3 p30 -130.41 -1.77 4.42 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.784 1.234 . . . . 2.2000000000000002 112.894 -173.979 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.2 p 64.3 12.67 7.39 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 126.231 1.812 . . . . 2.98 114.062 -175.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.2 mt-10 -113.37 106.47 14.63 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 125.614 1.565 . . . . 3.27 108.377 169.043 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -81.14 81.78 7.25 Favored 'General case' 0 N--CA 1.447 -0.577 0 N-CA-C 103.414 -2.81 . . . . 1.1100000000000001 103.414 167.201 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.3 ttmt -67.37 161.15 25.81 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 123.638 0.775 . . . . 4.4400000000000004 108.985 -179.829 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -38.65 -53.57 1.61 Allowed 'General case' 0 CA--C 1.543 0.703 0 N-CA-C 114.309 1.226 . . . . 5.79 114.309 -169.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -65.06 -40.22 94.4 Favored 'General case' 0 N--CA 1.466 0.347 0 O-C-N 121.53 -0.731 . . . . 2.2799999999999998 112.637 178.924 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 50.7 mt-10 -63.8 -52.73 58.92 Favored 'General case' 0 N--CA 1.448 -0.546 0 N-CA-C 107.805 -1.183 . . . . 1.99 107.805 178.631 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 1.6 t80 -52.13 -45.59 65.03 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 123.55 0.74 . . . . 3.1200000000000001 110.704 176.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.454 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.4 OUTLIER -40.29 -45.1 2.04 Favored 'General case' 0 C--N 1.347 0.468 0 CA-C-O 117.364 -1.303 . . . . 5.25 110.382 173.59 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 1.9 mmp_? -39.36 -46.34 1.59 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 120.753 1.615 . . . . 5.4500000000000002 111.776 -178.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.2 tp -56.25 -45.14 80.17 Favored 'General case' 0 CA--C 1.535 0.399 0 CA-C-N 119.016 0.826 . . . . 0.96999999999999997 112.989 178.764 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.1 mt -69.44 -40.78 80.29 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.19 0 C-N-CA 125.155 1.382 . . . . 2.29 108.18 178.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.437 ' HA3' ' CZ2' ' B' ' 77' ' ' TRP . . . -44.45 -57.99 4.82 Favored Glycine 0 N--CA 1.436 -1.337 0 N-CA-C 109.529 -1.428 . . . . 2.1400000000000001 109.529 172.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -66.57 -50.97 61.37 Favored 'General case' 0 N--CA 1.435 -1.213 0 CA-C-N 112.134 -2.033 . . . . 2.7999999999999998 107.751 -174.308 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.1 tp -37.26 -53.88 1.06 Allowed 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 126.297 1.839 . . . . 3.0600000000000001 111.747 -178.807 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.02 -34.02 65.46 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.976 0.911 . . . . 1.8300000000000001 112.802 -178.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.5 ttpp -81.84 -48.18 11.9 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.119 0.968 . . . . 2.1899999999999999 111.637 170.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -60.25 -26.52 66.5 Favored 'General case' 0 N--CA 1.448 -0.525 0 C-N-CA 123.743 0.817 . . . . 4.0800000000000001 112.909 -170.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.6 tp -36.79 -47.27 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.544 0.72 0 C-N-CA 123.5 0.72 . . . . 1.5600000000000001 111.046 165.44 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.52 -51.54 6.81 Favored 'General case' 0 C--N 1.345 0.382 0 O-C-N 121.472 -0.767 . . . . 5.0300000000000002 109.979 170.203 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -87.48 101.66 13.82 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 125.148 1.379 . . . . 3.6600000000000001 112.177 -170.341 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.419 ' H ' ' HD2' ' A' ' 90' ' ' LYS . 1.2 mptp? -80.38 -60.7 2.22 Favored 'General case' 0 CA--C 1.535 0.397 0 O-C-N 120.441 -1.412 . . . . 7.5099999999999998 109.786 -176.757 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -176.19 90.6 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.347 0 N-CA-C 103.679 -2.711 . . . . 10.35 103.679 169.363 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -66.74 80.03 0.11 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 124.024 0.93 . . . . 6.1299999999999999 113.001 -147.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 10.3 tp 174.97 -54.44 0.01 OUTLIER 'General case' 0 N--CA 1.449 -0.514 0 C-N-CA 128.466 2.706 . . . . 9.2100000000000009 105.184 -170.044 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 14.1 mptt -68.62 142.53 55.09 Favored 'General case' 0 CA--C 1.533 0.309 0 N-CA-C 108.275 -1.009 . . . . 11.949999999999999 108.275 170.001 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 2.28 1.3 mt 137.05 36.61 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.544 0.742 0 C-N-CA 123.717 0.807 . . . . 10.279999999999999 111.968 175.613 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 70.8 mtp180 -115.56 -13.93 11.52 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 115.758 1.762 . . . . 13.949999999999999 115.758 -144.896 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 14.2 tmtt? -175.35 -42.31 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.357 0 C-N-CA 124.456 1.102 . . . . 16.469999999999999 108.774 -171.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 87.8 tttt . . . . . 0 C--O 1.257 1.496 0 N-CA-C 102.551 -3.129 . . . . 17.120000000000001 102.551 127.862 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 81.4 mtp . . . . . 0 N--CA 1.476 0.859 0 CA-C-O 119.693 -0.194 . . . . 7.5999999999999996 111.365 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.337 . . -79.81 -136.11 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 126.21 1.804 . . . . 6.1900000000000004 114.555 -171.246 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 86.04 100.94 0.04 OUTLIER 'General case' 0 N--CA 1.467 0.415 0 C-N-CA 127.927 2.491 . . . . 6.7699999999999996 109.253 -171.306 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.434 ' HB3' ' CD ' ' B' ' 5' ' ' PRO . 31.0 tt0 -130.54 -81.7 0.0 OUTLIER Pre-proline 0 CA--C 1.548 0.903 0 C-N-CA 125.684 1.594 . . . . 6.0999999999999996 111.308 -163.805 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . 0.434 ' CD ' ' HB3' ' B' ' 4' ' ' GLU . 94.7 Cg_endo -72.09 147.36 48.47 Favored 'Trans proline' 0 C--N 1.352 0.757 0 CA-C-N 122.591 1.961 . . . . 3.0699999999999998 108.92 176.003 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.428 ' HB2' ' HB3' ' B' ' 10' ' ' GLU . 0.7 OUTLIER -148.89 149.99 32.21 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-N 118.695 0.68 . . . . 3.7599999999999998 109.723 -158.071 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.406 HG22 ' HB2' ' B' ' 10' ' ' GLU . 10.7 t -75.33 -166.24 0.5 Allowed 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 124.03 0.932 . . . . 2.0800000000000001 111.907 -172.391 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 12.8 tt0 -73.82 -60.17 2.38 Favored 'General case' 0 CA--C 1.535 0.377 0 O-C-N 122.049 -0.407 . . . . 2.8199999999999998 111.091 -171.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mt -47.59 -45.75 27.59 Favored 'General case' 0 CA--C 1.539 0.522 0 O-C-N 121.169 -0.957 . . . . 1.3300000000000001 110.363 172.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.428 ' HB3' ' HB2' ' B' ' 6' ' ' LEU . 2.0 tt0 -48.71 -58.78 4.23 Favored 'General case' 0 CA--C 1.538 0.504 0 C-N-CA 126.043 1.737 . . . . 3.2200000000000002 112.981 170.4 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -62.22 -36.9 83.38 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 120.863 -1.148 . . . . 5.1100000000000003 109.204 -176.917 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 15.8 m -63.17 -37.07 85.77 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 122.925 0.49 . . . . 2.2200000000000002 111.329 178.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.335 2.9 pp -70.51 -38.99 75.62 Favored 'Isoleucine or valine' 0 C--N 1.343 0.292 0 CA-C-N 118.691 0.678 . . . . 1.53 111.428 167.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -55.33 -52.18 64.34 Favored 'General case' 0 CA--C 1.532 0.279 0 CA-C-N 119.421 1.01 . . . . 3.6800000000000002 110.76 -179.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 11.9 t -55.02 -39.63 69.33 Favored 'General case' 0 CA--C 1.545 0.756 0 CA-C-O 121.42 0.629 . . . . 1.78 111.66 -176.532 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 25.6 m -77.61 -34.8 20.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 O-C-N 120.713 -1.242 . . . . 1.3899999999999999 110.781 177.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 45.3 t -59.22 -45.54 92.85 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.174 0 CA-C-N 119.167 0.894 . . . . 1.27 110.366 173.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.2 t -65.59 -42.41 91.73 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-N 118.711 0.687 . . . . 1.6000000000000001 110.412 177.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 34.9 m -55.46 -47.34 76.23 Favored 'General case' 0 CA--C 1.536 0.439 0 CA-C-N 119.089 0.859 . . . . 1.3 110.282 174.367 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 8.7 t80 -53.44 -56.43 16.93 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.157 -0.965 . . . . 3.7999999999999998 110.173 172.346 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 30.9 t80 -49.52 -51.07 38.98 Favored 'General case' 0 CA--C 1.533 0.321 0 C-N-CA 125.498 1.519 . . . . 3.6200000000000001 111.585 -177.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 32.5 p -64.07 -28.59 69.89 Favored 'General case' 0 CA--C 1.53 0.211 0 CA-C-O 119.184 -0.436 . . . . 2.2999999999999998 111.736 -176.815 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 22.3 m-85 -82.17 -34.5 29.04 Favored 'General case' 0 C--O 1.224 -0.284 0 CA-C-N 118.665 0.666 . . . . 2.98 111.791 170.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.54 -39.48 73.45 Favored 'General case' 0 C--O 1.239 0.531 0 O-C-N 120.949 -1.094 . . . . 1.03 110.475 -172.636 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 5.2 ptt180 -53.97 -44.09 70.5 Favored 'General case' 0 N--CA 1.453 -0.288 0 CA-C-N 115.626 -0.715 . . . . 4.2199999999999998 111.755 174.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.428 ' CB ' ' HG2' ' B' ' 37' ' ' GLU . 0.5 OUTLIER -41.62 -66.24 0.36 Allowed 'General case' 0 N--CA 1.443 -0.792 0 O-C-N 124.249 0.968 . . . . 2.0499999999999998 113.012 -126.572 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 90.4 mt-10 -96.92 -72.84 0.62 Allowed 'General case' 0 N--CA 1.452 -0.355 0 CA-C-O 124.13 1.919 . . . . 6.0899999999999999 112.385 179.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.44 80.63 1.51 Allowed Glycine 0 N--CA 1.439 -1.109 0 CA-C-N 112.076 -2.329 . . . . 2.6899999999999999 109.579 -171.525 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 15.2 ttt180 71.44 111.93 0.06 Allowed 'General case' 0 C--O 1.241 0.647 0 CA-C-N 120.725 2.262 . . . . 6.0899999999999999 114.026 159.733 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 20.9 ttpt -66.98 64.37 0.05 Allowed 'General case' 0 CA--C 1.542 0.663 0 O-C-N 120.886 -1.134 . . . . 4.0 111.727 172.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 11.3 t70 -132.48 -65.77 0.71 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 125.374 1.47 . . . . 4.96 107.261 172.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 50.0 m -113.93 159.83 19.46 Favored 'General case' 0 C--O 1.242 0.672 0 CA-C-N 115.18 -0.918 . . . . 2.2599999999999998 110.812 179.523 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 10.5 mp -98.73 123.27 42.85 Favored 'General case' 0 N--CA 1.453 -0.316 0 C-N-CA 124.518 1.127 . . . . 2.1600000000000001 109.036 179.073 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 1.1 t -94.87 176.77 6.13 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 124.509 1.123 . . . . 3.04 109.377 173.402 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 23.3 m -88.55 52.94 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.504 0 O-C-N 120.655 -1.278 . . . . 2.8900000000000001 112.012 -178.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 4.0 t30 -157.54 58.11 0.5 Allowed 'General case' 0 N--CA 1.464 0.268 0 N-CA-C 106.103 -1.814 . . . . 2.54 106.103 143.912 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.428 ' HG2' ' CB ' ' B' ' 26' ' ' GLN . 50.4 mt-10 -163.34 -57.21 0.04 OUTLIER 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 129.578 3.151 . . . . 2.21 103.167 -176.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.439 ' CZ ' HD13 ' B' ' 63' ' ' LEU . 4.2 t80 -62.01 -59.94 4.34 Favored 'General case' 0 N--CA 1.445 -0.71 0 CA-C-N 114.377 -1.283 . . . . 2.2599999999999998 109.456 171.426 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -56.82 -40.88 76.8 Favored 'General case' 0 C--N 1.341 0.22 0 C-N-CA 120.27 -0.572 . . . . 3.5699999999999998 110.749 -174.863 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 80.1 mt-10 -50.7 -41.27 55.85 Favored 'General case' 0 N--CA 1.452 -0.362 0 O-C-N 123.188 0.305 . . . . 2.6400000000000001 111.437 175.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -61.18 -55.96 26.26 Favored 'General case' 0 N--CA 1.454 -0.237 0 N-CA-C 107.674 -1.232 . . . . 2.4199999999999999 107.674 -175.818 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.2 m -67.94 -44.26 85.19 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 115.674 -0.693 . . . . 0.95999999999999996 109.574 -170.602 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 87.5 m -62.86 -47.61 82.63 Favored 'General case' 0 N--CA 1.446 -0.653 0 C-N-CA 124.061 0.945 . . . . 1.5800000000000001 110.243 -178.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 22.1 tt0 -80.62 -55.79 4.61 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 112.085 0.402 . . . . 2.9199999999999999 112.085 -173.428 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 27.3 mm100 -81.19 -41.83 21.74 Favored 'General case' 0 CA--C 1.529 0.163 0 N-CA-C 113.798 1.036 . . . . 2.9500000000000002 113.798 -158.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -62.03 -28.76 4.16 Favored Pre-proline 0 CA--C 1.536 0.415 0 N-CA-C 113.186 0.81 . . . . 1.8999999999999999 113.186 -156.509 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 41.3 Cg_endo -57.27 -24.55 60.27 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 121.132 -2.445 . . . . 2.1400000000000001 111.342 -78.21 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 1.9 t-80 -91.52 -33.24 15.25 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.899 1.679 . . . . 2.9300000000000002 110.653 -175.892 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 42.8 tp -58.61 -56.4 22.68 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.507 0.323 . . . . 1.3200000000000001 111.449 -165.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 30.2 mt -87.24 162.69 17.3 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 108.404 -0.962 . . . . 1.97 108.404 161.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.29 170.92 14.75 Favored 'General case' 0 N--CA 1.45 -0.454 0 N-CA-C 107.557 -1.275 . . . . 4.9400000000000004 107.557 165.373 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 18.7 t0 55.15 72.63 0.46 Allowed 'General case' 0 N--CA 1.45 -0.439 0 CA-C-O 123.393 1.568 . . . . 4.2000000000000002 109.25 -161.814 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 28.0 m -87.7 22.21 0.35 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.635 0 CA-C-N 112.643 -2.071 . . . . 1.9299999999999999 109.786 160.778 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -103.59 -70.74 0.84 Allowed Glycine 0 C--N 1.342 0.89 0 N-CA-C 108.81 -1.716 . . . . 2.6099999999999999 108.81 -177.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 46.7 t -79.02 50.2 1.01 Allowed 'General case' 0 C--O 1.236 0.353 0 C-N-CA 124.619 1.167 . . . . 3.2999999999999998 109.677 178.248 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -50.94 -41.65 59.16 Favored 'General case' 0 N--CA 1.444 -0.752 0 C-N-CA 125.679 1.592 . . . . 1.4399999999999999 109.066 179.38 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -30.47 -48.18 0.1 Allowed 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 127.743 2.417 . . . . 4.1399999999999997 113.526 170.739 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -60.35 -54.55 44.33 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 121.309 0.576 . . . . 2.8500000000000001 110.28 178.309 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . 0.422 ' HE3' ' H ' ' B' ' 59' ' ' LYS . 0.0 OUTLIER -58.3 -54.29 48.68 Favored 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 107.115 -1.439 . . . . 4.2400000000000002 107.115 -179.547 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -45.51 -55.05 6.64 Favored 'General case' 0 C--O 1.225 -0.231 0 C-N-CA 124.863 1.265 . . . . 1.76 110.635 178.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 35.1 ttmt -64.43 -39.82 94.56 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 118.268 0.485 . . . . 3.1400000000000001 110.855 -177.586 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.4 t -63.89 -30.23 71.33 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 122.833 0.453 . . . . 1.5700000000000001 111.791 175.549 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.439 HD13 ' CZ ' ' B' ' 38' ' ' PHE . 36.6 mt -80.13 -53.91 6.25 Favored 'General case' 0 N--CA 1.454 -0.238 0 C-N-CA 124.595 1.158 . . . . 1.3300000000000001 110.809 -178.97 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.261 16.8 t0 -54.63 -8.47 0.24 Allowed 'General case' 0 C--O 1.221 -0.422 0 C-N-CA 128.531 2.732 . . . . 1.75 117.324 -168.869 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.8 m -34.17 -20.14 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 C-N-CA 130.706 3.602 . . . . 1.9199999999999999 119.762 -134.95 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 7.0 p-10 -60.35 -25.16 65.64 Favored 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 121.281 1.855 . . . . 3.6899999999999999 111.043 161.804 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 11.7 tt0 62.33 64.12 0.98 Allowed 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.939 1.695 . . . . 3.4700000000000002 109.908 176.147 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 39.4 p30 -104.33 -27.42 11.99 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.029 1.332 . . . . 2.5600000000000001 111.546 176.363 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 35.0 m 111.35 -21.06 0.01 OUTLIER 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 129.337 3.055 . . . . 2.3100000000000001 111.926 -174.503 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.2 mp0 -113.18 114.8 27.27 Favored 'General case' 0 C--O 1.236 0.346 0 C-N-CA 125.882 1.673 . . . . 6.1399999999999997 108.566 -168.316 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -83.16 104.56 13.44 Favored 'General case' 0 N--CA 1.454 -0.255 0 C-N-CA 124.76 1.224 . . . . 1.4199999999999999 108.336 -176.171 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 44.2 tptt -84.28 174.32 10.25 Favored 'General case' 0 C--O 1.234 0.251 0 C-N-CA 127.462 2.305 . . . . 5.3600000000000003 112.339 -165.579 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 24.2 m-85 -80.42 55.2 2.21 Favored 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.512 0.725 . . . . 5.5 109.782 167.137 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -167.53 46.68 0.05 Allowed 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 120.316 -0.554 . . . . 4.7599999999999998 111.067 102.121 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 69.2 mt-10 -91.33 -60.09 1.98 Allowed 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 125.473 1.509 . . . . 2.1800000000000002 108.577 162.094 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 20.0 t80 -45.2 -41.48 8.31 Favored 'General case' 0 CA--C 1.517 -0.305 0 C-N-CA 125.011 1.324 . . . . 3.5600000000000001 111.707 -175.688 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.461 ' C ' ' CD1' ' B' ' 77' ' ' TRP . 1.4 t90 -39.5 -48.93 2.07 Favored 'General case' 0 N--CA 1.451 -0.377 0 O-C-N 124.527 1.142 . . . . 4.5199999999999996 109.312 178.632 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 48.6 mtp85 -42.58 -36.93 1.51 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 119.197 0.908 . . . . 4.3200000000000003 113.15 -176.153 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.1 tp -63.69 -45.26 90.83 Favored 'General case' 0 N--CA 1.451 -0.412 0 CA-C-N 119.829 1.195 . . . . 0.93000000000000005 111.177 179.645 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 8.2 pt -77.74 -31.52 17.32 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 C-N-CA 124.216 1.006 . . . . 3.6299999999999999 108.664 -177.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -46.83 -59.27 5.62 Favored Glycine 0 N--CA 1.433 -1.563 0 N-CA-C 108.461 -1.856 . . . . 1.78 108.461 165.704 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.5 mm-40 -74.51 -53.97 8.43 Favored 'General case' 0 N--CA 1.44 -0.969 0 CA-C-N 113.531 -1.334 . . . . 2.8700000000000001 110.916 -169.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.515 HD12 HG21 ' A' ' 13' ' ' ILE 0.292 4.5 pp -50.6 -29.28 10.5 Favored 'General case' 0 CA--C 1.539 0.538 0 CA-C-N 121.116 1.78 . . . . 1.8500000000000001 113.157 -175.892 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.63 -46.63 77.39 Favored 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 112.761 0.652 . . . . 1.1399999999999999 112.761 168.263 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 2.1 ptpt -77.45 -35.21 54.13 Favored 'General case' 0 CA--C 1.538 0.497 0 CA-C-O 117.871 -1.062 . . . . 2.04 112.281 172.415 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 5.5 mm-40 -52.99 -31.92 43.47 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 120.753 1.615 . . . . 3.2200000000000002 112.17 -172.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 9.2 tt -43.34 -46.44 1.55 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.817 0 C-N-CA 123.16 0.584 . . . . 1.52 111.61 170.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 9.5 ptm85 -85.55 -49.51 7.98 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 125.326 1.45 . . . . 3.8100000000000001 113.699 168.574 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 23.4 tttm -69.67 95.41 0.87 Allowed 'General case' 0 CA--C 1.531 0.247 0 O-C-N 121.128 -0.983 . . . . 6.9100000000000001 111.659 -174.558 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . 0.406 ' NZ ' ' OD2' ' B' ' 92' ' ' ASP . 4.5 ttpm? -57.82 -60.24 4.01 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 108.718 -0.845 . . . . 5.5199999999999996 108.718 157.941 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 20.4 tptp -153.89 -14.45 0.14 Allowed 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 112.666 0.617 . . . . 6.9500000000000002 112.666 176.677 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . 0.406 ' OD2' ' NZ ' ' B' ' 90' ' ' LYS . 0.9 OUTLIER -91.64 48.81 1.5 Allowed 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 123.706 0.802 . . . . 4.9299999999999997 111.22 -140.345 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 36.8 tp -97.9 -69.07 0.77 Allowed 'General case' 0 N--CA 1.445 -0.685 0 N-CA-C 108.563 -0.902 . . . . 6.5800000000000001 108.563 -178.236 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -172.93 154.67 2.92 Favored 'General case' 0 C--N 1.338 0.091 0 C-N-CA 124.46 1.104 . . . . 10.390000000000001 108.495 175.888 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 17.1 mm -133.23 59.44 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 N-CA-C 106.469 -1.678 . . . . 6.9299999999999997 106.469 172.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 9.6 tpt180 -163.92 149.69 11.05 Favored 'General case' 0 N--CA 1.455 -0.218 0 N-CA-C 109.016 -0.735 . . . . 6.6200000000000001 109.016 -178.252 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -177.56 116.89 0.09 Allowed 'General case' 0 N--CA 1.456 -0.146 0 C-N-CA 128.169 2.588 . . . . 7.0800000000000001 104.596 178.358 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 6.0 tmtt? . . . . . 0 C--O 1.25 1.117 0 CA-C-O 117.36 -1.305 . . . . 7.54 108.672 -161.397 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.6 mtt . . . . . 0 N--CA 1.471 0.585 0 N-CA-C 105.188 -2.152 . . . . 6.5099999999999998 105.188 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.77 174.3 0.84 Allowed 'General case' 0 CA--C 1.529 0.136 0 CA-C-N 119.292 0.951 . . . . 3.3599999999999999 110.466 161.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.0 89.83 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.187 0 C-N-CA 129.057 2.943 . . . . 3.1299999999999999 109.735 -173.872 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 3.7 pt-20 -93.76 121.9 63.49 Favored Pre-proline 0 N--CA 1.451 -0.385 0 C-N-CA 125.019 1.327 . . . . 4.9299999999999997 109.031 -178.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 83.1 Cg_endo -72.06 154.46 57.56 Favored 'Trans proline' 0 N--CA 1.452 -0.944 0 C-N-CA 122.174 1.916 . . . . 2.1299999999999999 108.754 175.202 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 73.6 mt -109.33 169.68 8.54 Favored 'General case' 0 CA--C 1.534 0.36 0 C-N-CA 124.187 0.995 . . . . 1.3200000000000001 108.577 -174.459 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.5 t -75.18 159.97 30.97 Favored 'General case' 0 N--CA 1.468 0.445 0 O-C-N 120.885 -1.134 . . . . 1.75 110.504 -176.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 22.2 mt-10 -46.45 -56.85 5.32 Favored 'General case' 0 N--CA 1.463 0.181 0 O-C-N 121.193 -0.942 . . . . 2.79 113.164 -175.811 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.3 mt -61.08 -44.44 97.37 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-O 118.532 -0.747 . . . . 1.5700000000000001 111.085 -178.307 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -54.36 -53.14 57.9 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 127.536 2.334 . . . . 2.6600000000000001 112.208 173.65 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 56.0 mm-40 -53.26 -55.7 22.43 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.406 1.082 . . . . 3.5800000000000001 109.274 172.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.0 t -53.08 -51.84 60.54 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.581 0.752 . . . . 1.72 112.076 -178.768 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.4 pp -65.56 -39.32 84.7 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.343 0 CA-C-O 118.472 -0.775 . . . . 0.68000000000000005 110.155 -179.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 7.1 tm-20 -56.06 -58.08 9.42 Favored 'General case' 0 N--CA 1.453 -0.304 0 CA-C-N 119.138 0.881 . . . . 2.4500000000000002 109.653 177.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.2 t -54.7 -40.86 69.59 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-O 121.351 0.596 . . . . 1.25 111.726 -172.219 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 12.4 m -74.28 -35.54 40.36 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 O-C-N 120.929 -1.107 . . . . 0.60999999999999999 111.401 177.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 37.4 t -60.6 -48.4 88.75 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 119.285 0.948 . . . . 0.52000000000000002 110.114 175.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.1 t -62.52 -42.08 99.27 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 119.077 0.853 . . . . 0.68000000000000005 110.623 177.104 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 48.4 m -57.52 -53.45 57.98 Favored 'General case' 0 CA--C 1.538 0.512 0 CA-C-N 118.736 0.698 . . . . 0.72999999999999998 110.226 176.125 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -45.61 -54.1 8.18 Favored 'General case' 0 C--O 1.224 -0.24 0 C-N-CA 124.109 0.964 . . . . 3.02 109.98 171.535 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 54.6 t80 -60.93 -50.19 74.39 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 123.578 0.751 . . . . 3.21 111.772 -173.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.0 t -63.94 -30.8 71.85 Favored 'General case' 0 CA--C 1.536 0.406 0 O-C-N 121.95 -0.469 . . . . 1.9399999999999999 110.836 -178.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 18.4 m-85 -69.71 -42.64 73.75 Favored 'General case' 0 C--O 1.221 -0.406 0 O-C-N 121.631 -0.668 . . . . 2.8100000000000001 111.13 166.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.81 -22.48 66.93 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 125.259 1.423 . . . . 0.76000000000000001 112.747 -170.283 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.253 0.0 OUTLIER -80.66 -15.73 55.82 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 117.112 -1.423 . . . . 4.0800000000000001 113.543 175.046 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.69 -66.09 0.33 Allowed 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 120.071 1.305 . . . . 2.21 112.595 178.182 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -117.44 172.73 7.14 Favored 'General case' 0 C--O 1.239 0.502 0 C-N-CA 126.621 1.968 . . . . 2.4700000000000002 107.219 -173.972 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -3.52 112.5 0.01 OUTLIER Glycine 0 CA--C 1.531 1.059 0 C-N-CA 127.906 2.67 . . . . 1.6200000000000001 114.454 172.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 5.5 mtp180 62.99 106.54 0.03 OUTLIER 'General case' 0 C--O 1.236 0.387 0 N-CA-C 114.309 1.226 . . . . 6.0899999999999999 114.309 175.618 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.19 51.56 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 125.835 1.654 . . . . 4.6699999999999999 112.263 157.099 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.8 m-20 -148.14 -53.13 0.19 Allowed 'General case' 0 C--O 1.225 -0.186 0 C-N-CA 125.746 1.618 . . . . 3.9900000000000002 107.505 -177.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -118.96 162.71 18.07 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 124.533 1.133 . . . . 1.6499999999999999 111.339 -175.727 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.2 mp -112.92 170.17 8.39 Favored 'General case' 0 CA--C 1.528 0.098 0 C-N-CA 124.547 1.139 . . . . 2.3599999999999999 110.461 175.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 12.6 t -153.77 179.48 8.82 Favored 'General case' 0 N--CA 1.455 -0.183 0 C-N-CA 125.991 1.716 . . . . 3.3300000000000001 106.794 175.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 42.7 t -37.28 -62.85 0.1 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 125.768 1.627 . . . . 2.46 113.619 -166.349 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -66.2 -56.29 12.05 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-N 118.647 0.658 . . . . 2.1800000000000002 109.951 -174.52 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -38.84 -45.89 1.22 Allowed 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 125.238 1.415 . . . . 1.72 112.704 171.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 5.1 t80 -67.53 -58.02 5.45 Favored 'General case' 0 N--CA 1.448 -0.532 0 C-N-CA 122.996 0.519 . . . . 2.7599999999999998 110.304 176.824 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 47.3 tttt -54.17 -39.98 67.1 Favored 'General case' 0 CA--C 1.532 0.276 0 CA-C-N 118.071 0.396 . . . . 2.8399999999999999 111.11 -174.215 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 48.8 mt-10 -47.76 -40.43 20.65 Favored 'General case' 0 N--CA 1.452 -0.33 0 N-CA-C 112.741 0.645 . . . . 3.0299999999999998 112.741 174.476 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 4.4 tp -66.22 -45.92 79.01 Favored 'General case' 0 CA--C 1.522 -0.13 0 CA-C-N 119.404 1.002 . . . . 2.6299999999999999 108.787 -175.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.8 m -68.15 -53.6 28.14 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.468 0 N-CA-C 108.66 -0.867 . . . . 1.3500000000000001 108.66 -176.538 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 93.9 m -53.08 -48.9 67.39 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.983 0.913 . . . . 1.23 111.983 179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.7 tt0 -80.39 -52.88 7.16 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 122.751 0.42 . . . . 2.0299999999999998 111.433 -174.663 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.8 mm-40 -106.0 6.55 31.36 Favored 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 124.523 1.129 . . . . 3.3900000000000001 113.087 -162.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.9 tp -136.28 84.03 30.7 Favored Pre-proline 0 CA--C 1.537 0.457 0 O-C-N 121.079 -1.013 . . . . 1.96 108.36 179.494 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -66.07 -29.23 48.49 Favored 'Trans proline' 0 N--CA 1.454 -0.848 0 C-N-CA 122.431 2.088 . . . . 2.3500000000000001 111.696 -170.554 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.0 t-80 -141.22 -99.52 0.14 Allowed 'General case' 0 CA--C 1.537 0.461 0 CA-C-O 118.901 -0.571 . . . . 3.8599999999999999 109.556 173.347 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.466 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 5.8 tp 51.39 -87.99 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.785 1.634 . . . . 1.5 113.127 -179.979 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.4 mt -73.62 -29.52 62.41 Favored 'General case' 0 N--CA 1.458 -0.034 0 C-N-CA 125.743 1.617 . . . . 3.1000000000000001 110.66 177.373 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 49.4 -173.26 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 126.948 2.099 . . . . 6.6399999999999997 113.057 -179.097 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 55.3 m-20 46.64 42.59 11.6 Favored 'General case' 0 N--CA 1.454 -0.229 0 C-N-CA 125.958 1.703 . . . . 6.4100000000000001 111.482 170.106 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -61.74 2.08 0.24 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.352 0 C-N-CA 127.985 2.514 . . . . 2.54 113.613 -177.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.17 -70.15 0.97 Allowed Glycine 0 CA--C 1.53 1.0 0 N-CA-C 109.502 -1.439 . . . . 1.74 109.502 164.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -81.9 63.81 6.31 Favored 'General case' 0 CA--C 1.531 0.236 0 CA-C-O 122.664 1.221 . . . . 1.97 110.156 -174.855 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -73.23 -28.93 62.44 Favored 'General case' 0 N--CA 1.443 -0.809 0 C-N-CA 124.553 1.141 . . . . 1.6200000000000001 109.706 175.85 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 29.7 p-10 -42.02 -52.89 4.08 Favored 'General case' 0 CA--C 1.53 0.207 0 C-N-CA 125.537 1.535 . . . . 4.7599999999999998 112.371 173.229 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -49.2 -50.75 36.81 Favored 'General case' 0 CA--C 1.529 0.169 0 C-N-CA 123.647 0.779 . . . . 4.2699999999999996 110.082 176.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.45 -47.53 75.84 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 109.8 -0.444 . . . . 3.1200000000000001 109.8 -177.259 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 16.2 tmm? -52.41 -43.69 64.95 Favored 'General case' 0 C--O 1.226 -0.178 0 C-N-CA 123.284 0.634 . . . . 3.2799999999999998 109.466 176.625 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 8.6 tptt -70.17 -38.32 75.38 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 122.663 0.385 . . . . 4.8899999999999997 111.658 178.569 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.2 m -58.97 -34.87 72.3 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 122.807 0.443 . . . . 2.4399999999999999 110.443 172.691 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 83.8 mt -69.37 -78.27 0.07 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 109.433 -0.58 . . . . 2.3999999999999999 109.433 168.553 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.8 t70 -77.62 80.13 4.1 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 122.012 0.91 . . . . 2.5499999999999998 110.443 -178.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 29.2 m -65.19 -19.16 25.15 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 CA-C-N 115.617 -0.72 . . . . 3.5899999999999999 111.318 165.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.1 m120 -69.42 -58.36 4.09 Favored 'General case' 0 CA--C 1.529 0.161 0 CA-C-O 118.92 -0.562 . . . . 4.0199999999999996 112.232 -168.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 38.2 tp60 121.85 -35.39 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.544 0 C-N-CA 130.503 3.521 . . . . 3.9900000000000002 110.322 -167.653 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . 0.434 ' C ' ' H ' ' A' ' 70' ' ' GLU . 4.0 p-10 -62.54 99.99 0.17 Allowed 'General case' 0 C--N 1.347 0.464 0 N-CA-C 105.711 -1.959 . . . . 4.2199999999999998 105.711 169.852 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 47.0 m -78.94 36.15 0.27 Allowed 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 125.222 1.409 . . . . 2.8300000000000001 111.664 -166.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . 0.434 ' H ' ' C ' ' A' ' 68' ' ' ASP . 12.1 mp0 -121.27 121.11 37.0 Favored 'General case' 0 N--CA 1.426 -1.656 0 C-N-CA 131.647 3.979 . . . . 5.9199999999999999 102.898 -178.544 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -93.15 101.25 13.54 Favored 'General case' 0 N--CA 1.442 -0.866 0 N-CA-C 106.734 -1.58 . . . . 0.97999999999999998 106.734 -177.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.95 160.05 15.67 Favored 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.51 1.124 . . . . 3.7200000000000002 108.575 169.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.3 m-85 -40.45 -60.02 1.2 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.587 1.155 . . . . 5.2699999999999996 111.667 179.322 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 4.5 t30 -69.14 -25.7 64.51 Favored 'General case' 0 CA--C 1.535 0.393 0 C-N-CA 123.565 0.746 . . . . 1.74 112.036 -176.679 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 51.7 mt-10 -68.04 -59.61 3.12 Favored 'General case' 0 C--N 1.34 0.158 0 N-CA-C 108.497 -0.927 . . . . 1.9299999999999999 108.497 172.547 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 31.3 t80 -55.44 -43.11 75.09 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 122.643 0.377 . . . . 3.1800000000000002 110.496 -175.695 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 8.2 t-105 -39.97 -37.2 0.55 Allowed 'General case' 0 CA--C 1.54 0.57 0 C-N-CA 124.688 1.195 . . . . 4.1699999999999999 112.171 173.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 44.2 mtt180 -39.49 -48.0 1.93 Allowed 'General case' 0 N--CA 1.473 0.696 0 CA-C-N 120.302 1.41 . . . . 3.8399999999999999 112.12 173.191 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 15.7 tp -51.52 -38.85 56.08 Favored 'General case' 0 N--CA 1.451 -0.414 0 C-N-CA 123.703 0.801 . . . . 0.96999999999999997 111.492 -178.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 84.5 mt -67.05 -32.19 56.76 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.255 0 N-CA-C 108.269 -1.011 . . . . 1.9399999999999999 108.269 -176.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.556 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -69.61 -46.19 55.76 Favored Glycine 0 CA--C 1.485 -1.822 0 N-CA-C 110.025 -1.23 . . . . 1.24 110.025 179.649 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -61.79 -57.2 12.77 Favored 'General case' 0 N--CA 1.433 -1.293 0 N-CA-C 105.716 -1.957 . . . . 2.4100000000000001 105.716 179.167 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.466 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 4.4 mp -38.39 -59.99 0.84 Allowed 'General case' 0 CA--C 1.543 0.706 0 CA-C-N 120.074 1.307 . . . . 2.75 112.339 172.476 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.46 -28.13 69.6 Favored 'General case' 0 C--O 1.225 -0.231 0 N-CA-C 113.153 0.798 . . . . 1.28 113.153 -178.559 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 22.0 ttmt -81.45 -62.4 1.66 Allowed 'General case' 0 N--CA 1.449 -0.518 0 C-N-CA 124.814 1.246 . . . . 1.5600000000000001 110.522 178.181 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 58.7 mm-40 -39.85 -49.5 2.39 Favored 'General case' 0 C--N 1.343 0.298 0 C-N-CA 126.489 1.915 . . . . 2.4399999999999999 110.536 -174.007 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.513 HG21 HG21 ' B' ' 17' ' ' VAL . 12.2 tt -37.12 -43.71 0.23 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.677 0 C-N-CA 125.513 1.525 . . . . 1.1899999999999999 113.128 177.074 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -148.31 67.36 1.08 Allowed 'General case' 0 CA--C 1.534 0.343 0 C-N-CA 124.392 1.077 . . . . 6.6600000000000001 109.86 165.457 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -75.42 158.57 32.49 Favored 'General case' 0 C--N 1.327 -0.384 0 C-N-CA 124.389 1.075 . . . . 4.25 109.252 170.753 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 31.5 ttpt -79.04 -52.98 7.49 Favored 'General case' 0 CA--C 1.529 0.139 0 N-CA-C 109.408 -0.59 . . . . 16.800000000000001 109.408 177.471 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 24.2 ttpt -73.65 -5.49 40.81 Favored 'General case' 0 CA--C 1.535 0.384 0 CA-C-O 119.011 -0.519 . . . . 12.93 112.341 -177.792 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 24.6 t70 -72.56 69.67 0.88 Allowed 'General case' 0 C--N 1.343 0.291 0 N-CA-C 106.999 -1.482 . . . . 6.9100000000000001 106.999 160.769 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 33.5 tp -90.41 -76.33 0.43 Allowed 'General case' 0 N--CA 1.431 -1.392 0 N-CA-C 105.241 -2.133 . . . . 8.3399999999999999 105.241 -171.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 49.6 pttt -139.46 131.32 27.61 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 105.907 -1.886 . . . . 11.01 105.907 176.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 17.6 tt -140.45 -57.83 0.27 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.247 0 CA-C-O 118.568 -0.73 . . . . 11.82 111.224 -178.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.6 ppt_? -161.96 14.49 0.09 Allowed 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 115.114 1.524 . . . . 16.039999999999999 115.114 -178.894 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 6.5 mmtm -178.27 59.37 0.01 OUTLIER 'General case' 0 N--CA 1.465 0.302 0 N-CA-C 105.351 -2.092 . . . . 14.390000000000001 105.351 173.24 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 48.3 mttm . . . . . 0 C--O 1.258 1.552 0 CA-C-O 116.558 -1.686 . . . . 12.1 107.402 -141.608 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.387 2.6 ttp . . . . . 0 N--CA 1.476 0.841 0 N-CA-C 115.891 1.812 . . . . 6.46 115.891 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 65.61 176.16 0.21 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 115.571 1.693 . . . . 5.1600000000000001 115.571 160.173 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 66.39 100.13 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 126.234 1.814 . . . . 4.2300000000000004 115.837 161.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 16.9 pt-20 -156.87 161.76 28.9 Favored Pre-proline 0 CA--C 1.544 0.734 0 C-N-CA 125.061 1.345 . . . . 8.8000000000000007 107.962 171.134 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -74.49 170.6 19.9 Favored 'Trans proline' 0 C--N 1.35 0.61 0 C-N-CA 122.77 2.313 . . . . 3.3199999999999998 112.427 -171.422 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 46.7 mt -132.02 140.2 48.84 Favored 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 124.114 0.966 . . . . 2.9199999999999999 111.536 -153.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.494 HG23 ' N ' ' B' ' 8' ' ' GLU . 6.1 t -76.27 -68.52 0.58 Allowed 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.38 1.472 . . . . 2.7200000000000002 114.276 178.431 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.494 ' N ' HG23 ' B' ' 7' ' ' THR . 43.6 tt0 -169.57 -71.69 0.02 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.09 1.356 . . . . 2.1899999999999999 108.702 -164.238 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.1 mt -51.58 -45.32 63.07 Favored 'General case' 0 C--N 1.341 0.199 0 O-C-N 121.37 -0.831 . . . . 1.1399999999999999 109.243 166.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.463 ' OE1' HG22 ' B' ' 7' ' ' THR . 47.0 mt-10 -51.55 -47.27 63.49 Favored 'General case' 0 CA--C 1.546 0.814 0 C-N-CA 125.514 1.526 . . . . 3.1699999999999999 111.621 172.318 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.8 mm-40 -59.4 -48.46 81.56 Favored 'General case' 0 CA--C 1.535 0.399 0 O-C-N 121.224 -0.923 . . . . 3.6899999999999999 110.072 176.504 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 14.4 p -62.93 -40.79 98.71 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 121.284 -0.885 . . . . 1.25 111.282 -178.595 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.617 ' O ' HG23 ' B' ' 17' ' ' VAL 0.358 2.9 pp -62.15 -37.87 79.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 O-C-N 121.159 -0.963 . . . . 1.0 110.525 174.15 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -59.04 -46.07 89.16 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 119.189 -1.004 . . . . 3.2999999999999998 111.961 170.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . 0.29 1.3 t -56.03 -36.7 68.27 Favored 'General case' 0 CA--C 1.545 0.752 0 CA-C-N 120.2 1.363 . . . . 1.3799999999999999 112.002 -177.056 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 8.8 m -76.17 -35.82 29.18 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 O-C-N 120.414 -1.429 . . . . 0.81000000000000005 111.578 174.464 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.617 HG23 ' O ' ' B' ' 13' ' ' ILE . 94.1 t -57.63 -46.69 86.45 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.32 0 CA-C-N 119.188 0.903 . . . . 1.29 110.254 174.653 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.8 t -64.54 -40.84 96.32 Favored 'General case' 0 CA--C 1.531 0.242 0 O-C-N 121.411 -0.805 . . . . 1.5800000000000001 110.474 177.908 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 27.6 m -57.25 -54.87 41.89 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.478 1.036 . . . . 1.21 109.355 175.615 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -42.15 -60.79 1.33 Allowed 'General case' 0 C--O 1.225 -0.215 0 C-N-CA 124.799 1.239 . . . . 4.4299999999999997 110.582 171.877 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 75.4 t80 -57.78 -54.18 49.79 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 124.035 0.934 . . . . 3.7200000000000002 111.683 -175.228 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 36.9 p -57.33 -43.34 83.29 Favored 'General case' 0 CA--C 1.528 0.128 0 C-N-CA 122.842 0.457 . . . . 2.3700000000000001 110.908 -177.639 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 23.9 m-85 -68.49 -43.64 76.46 Favored 'General case' 0 C--O 1.222 -0.375 0 CA-C-N 118.565 0.62 . . . . 2.8799999999999999 111.591 173.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.87 -32.77 63.96 Favored 'General case' 0 CA--C 1.514 -0.413 0 C-N-CA 125.48 1.512 . . . . 1.01 110.33 -173.126 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -60.14 -26.34 66.2 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 117.781 -1.104 . . . . 4.2000000000000002 112.581 179.607 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.484 ' CB ' ' HG2' ' B' ' 37' ' ' GLU . 1.1 tp60 -52.96 -64.15 0.91 Allowed 'General case' 0 C--N 1.343 0.323 0 N-CA-C 114.799 1.407 . . . . 2.2599999999999998 114.799 -153.783 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 56.4 mt-10 -89.43 -72.86 0.53 Allowed 'General case' 0 N--CA 1.452 -0.343 0 CA-C-O 121.891 0.853 . . . . 2.8900000000000001 110.535 -170.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.88 155.74 22.64 Favored Glycine 0 C--N 1.336 0.54 0 C-N-CA 126.634 2.064 . . . . 1.8300000000000001 110.594 164.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.2 ttm180 39.06 105.23 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.824 0 N-CA-C 116.367 1.988 . . . . 4.5899999999999999 116.367 131.891 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 14.7 ptpt -72.74 15.33 0.2 Allowed 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 115.816 1.784 . . . . 4.7300000000000004 115.816 -171.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 27.7 p-10 -90.99 -39.9 11.96 Favored 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 126.238 1.815 . . . . 4.6399999999999997 110.205 175.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 11.6 p -99.67 141.33 32.62 Favored 'General case' 0 N--CA 1.441 -0.887 0 C-N-CA 127.889 2.475 . . . . 2.52 108.951 -164.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 mm? -89.25 179.62 6.07 Favored 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 107.779 -1.193 . . . . 2.1000000000000001 107.779 147.091 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 17.0 t -155.66 -168.32 2.77 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-O 123.279 1.514 . . . . 2.3500000000000001 112.191 -144.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 5.2 t -69.36 -157.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.545 0.785 0 N-CA-C 100.807 -3.775 . . . . 3.0800000000000001 100.807 135.936 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 10.5 t30 -76.66 57.74 1.3 Allowed 'General case' 0 CA--C 1.549 0.915 1 O-C-N 116.153 -4.092 . . . . 2.9300000000000002 112.866 -136.181 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.484 ' HG2' ' CB ' ' B' ' 26' ' ' GLN . 36.9 mt-10 -80.21 -44.53 19.6 Favored 'General case' 0 N--CA 1.452 -0.339 0 C-N-CA 127.504 2.322 . . . . 2.0699999999999998 108.259 125.359 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.413 ' CZ ' HD13 ' B' ' 63' ' ' LEU . 0.2 OUTLIER -65.33 -54.35 30.2 Favored 'General case' 0 N--CA 1.453 -0.277 0 O-C-N 122.071 -0.393 . . . . 2.4500000000000002 111.756 -170.041 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 28.6 tttt -59.69 -32.5 70.55 Favored 'General case' 0 N--CA 1.455 -0.217 0 C-N-CA 118.706 -1.198 . . . . 3.25 110.367 -178.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -57.56 -33.48 68.18 Favored 'General case' 0 N--CA 1.452 -0.353 0 N-CA-C 112.59 0.589 . . . . 2.79 112.59 172.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.4 tm? -63.46 -55.5 23.71 Favored 'General case' 0 C--O 1.232 0.137 0 N-CA-C 107.836 -1.172 . . . . 2.8100000000000001 107.836 179.253 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -69.66 -38.91 77.44 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.119 0 CA-C-N 116.028 -0.533 . . . . 0.84999999999999998 110.1 -171.988 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 98.1 m -62.57 -54.57 37.74 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 123.77 0.828 . . . . 0.83999999999999997 110.684 175.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.3 tt0 -72.36 -60.07 2.42 Favored 'General case' 0 N--CA 1.455 -0.196 0 O-C-N 122.107 -0.371 . . . . 3.02 110.755 -172.655 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -80.02 -58.41 3.17 Favored 'General case' 0 N--CA 1.454 -0.239 0 O-C-N 122.301 -0.249 . . . . 3.3700000000000001 111.38 -159.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . 0.441 HD11 HD22 ' B' ' 83' ' ' LEU . 2.0 mm? -50.53 -38.57 42.16 Favored Pre-proline 0 CA--C 1.538 0.486 0 C-N-CA 124.729 1.211 . . . . 2.02 114.242 -155.422 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 90.4 Cg_endo -52.54 -49.15 18.45 Favored 'Trans proline' 0 N--CA 1.452 -0.914 0 C-N-CA 119.783 -3.007 . . . . 2.0899999999999999 109.021 -76.745 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 12.3 t-80 -51.34 -52.6 44.02 Favored 'General case' 0 N--CA 1.452 -0.338 0 C-N-CA 126.915 2.086 . . . . 3.2200000000000002 112.129 179.273 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.412 HD23 ' HB2' ' B' ' 83' ' ' LEU . 21.6 tp -54.52 -46.9 73.6 Favored 'General case' 0 CA--C 1.538 0.505 0 CA-C-O 120.607 0.242 . . . . 1.02 110.941 -163.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 91.9 mt -106.16 68.03 0.76 Allowed 'General case' 0 C--O 1.226 -0.141 0 C-N-CA 124.913 1.285 . . . . 1.6200000000000001 110.046 165.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.29 0.49 0.0 OUTLIER 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 129.084 2.954 . . . . 6.1500000000000004 117.715 158.108 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 9.1 t0 -107.15 90.88 3.44 Favored 'General case' 0 N--CA 1.452 -0.369 0 N-CA-C 105.233 -2.136 . . . . 3.5499999999999998 105.233 162.406 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 30.2 m -97.38 21.0 1.37 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.436 0 CA-C-N 115.391 -0.822 . . . . 2.23 109.133 164.468 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -95.17 -76.12 1.31 Allowed Glycine 0 N--CA 1.445 -0.707 0 N-CA-C 108.239 -1.944 . . . . 2.5099999999999998 108.239 178.146 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 11.5 m -79.4 52.25 1.34 Allowed 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 126.637 1.975 . . . . 2.4199999999999999 111.465 -164.736 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -67.98 -28.48 67.47 Favored 'General case' 0 N--CA 1.436 -1.149 0 C-N-CA 124.129 0.972 . . . . 1.28 109.4 178.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 5.7 p-10 -65.12 -48.12 74.75 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.023 0.829 . . . . 4.0099999999999998 109.993 173.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 84.3 tt0 -53.66 -53.0 58.15 Favored 'General case' 0 C--O 1.236 0.353 0 C-N-CA 123.673 0.789 . . . . 2.8700000000000001 109.126 173.829 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 6.8 mmpt? -57.75 -46.26 84.74 Favored 'General case' 0 N--CA 1.45 -0.43 0 CA-C-O 118.849 -0.596 . . . . 3.9900000000000002 110.231 178.344 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -53.07 -52.72 57.64 Favored 'General case' 0 N--CA 1.462 0.137 0 C-N-CA 124.215 1.006 . . . . 1.8999999999999999 109.604 178.941 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 69.1 mttt -55.73 -44.2 77.32 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.004 0.522 . . . . 3.5099999999999998 110.119 176.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 16.1 m -66.89 -30.78 71.03 Favored 'General case' 0 CA--C 1.537 0.455 0 N-CA-C 113.028 0.751 . . . . 1.8700000000000001 113.028 178.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.413 HD13 ' CZ ' ' B' ' 38' ' ' PHE . 37.4 mt -80.47 -56.41 4.2 Favored 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 125.307 1.443 . . . . 1.4299999999999999 109.641 -177.248 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 20.6 t0 -67.24 -10.18 48.03 Favored 'General case' 0 C--O 1.222 -0.368 0 C-N-CA 127.626 2.37 . . . . 1.5800000000000001 115.607 -167.345 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 21.4 m -33.01 -20.79 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 C-N-CA 130.349 3.46 . . . . 1.3999999999999999 119.613 -133.713 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -57.35 -27.86 62.64 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 121.117 1.78 . . . . 2.7599999999999998 110.978 160.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 64.88 60.93 0.81 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 125.397 1.479 . . . . 3.0800000000000001 110.589 171.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 44.6 p30 -107.22 -13.21 15.2 Favored 'General case' 0 CA--C 1.539 0.523 0 C-N-CA 126.064 1.746 . . . . 1.98 111.656 177.773 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 14.3 m 69.41 15.14 8.42 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 125.412 1.485 . . . . 1.77 113.526 -173.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -114.48 101.12 8.83 Favored 'General case' 0 C--O 1.237 0.426 0 N-CA-C 106.185 -1.783 . . . . 3.1099999999999999 106.185 160.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.1 mm? -78.11 104.16 8.5 Favored 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.975 -1.861 . . . . 1.05 105.975 176.722 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -81.43 176.8 9.4 Favored 'General case' 0 C--O 1.239 0.51 0 CA-C-O 121.476 0.655 . . . . 4.6900000000000004 109.742 -171.452 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 10.5 t80 -80.57 82.71 6.52 Favored 'General case' 0 N--CA 1.453 -0.316 0 N-CA-C 107.809 -1.182 . . . . 5.1399999999999997 107.809 -174.854 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 97.68 50.21 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.325 1 C-N-CA 133.666 4.786 . . . . 2.4399999999999999 108.126 -172.593 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -89.05 -59.48 2.21 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 120.698 -1.251 . . . . 2.1600000000000001 108.521 107.168 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 6.3 t80 -38.49 -51.75 1.58 Allowed 'General case' 0 C--N 1.345 0.384 0 C-N-CA 126.525 1.93 . . . . 3.52 112.338 -172.296 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 46.2 t90 -44.61 -34.33 2.12 Favored 'General case' 0 N--CA 1.447 -0.58 0 C-N-CA 125.737 1.615 . . . . 3.6200000000000001 112.807 -176.083 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . 0.404 ' HB2' HD23 ' B' ' 63' ' ' LEU . 7.8 mmm180 -40.8 -45.51 2.48 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 123.947 0.899 . . . . 4.0899999999999999 111.7 172.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 6.1 tp -54.58 -44.49 73.03 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 118.547 0.612 . . . . 0.88 111.402 178.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 34.5 mt -64.08 -30.26 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.806 0 N-CA-C 107.302 -1.37 . . . . 1.49 107.302 -178.034 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.577 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -68.07 -44.43 77.35 Favored Glycine 0 CA--C 1.497 -1.057 0 C-N-CA 124.765 1.174 . . . . 1.5 112.088 178.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . 0.41 ' OE2' ' NZ ' ' B' ' 85' ' ' LYS . 2.3 mm-40 -65.57 -61.89 1.83 Allowed 'General case' 0 N--CA 1.433 -1.324 0 N-CA-C 107.203 -1.406 . . . . 2.7000000000000002 107.203 178.257 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.441 HD22 HD11 ' B' ' 46' ' ' LEU . 3.8 pp -56.85 -34.64 68.0 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.038 0.835 . . . . 1.8799999999999999 112.062 -178.016 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.67 -61.49 2.55 Favored 'General case' 0 C--N 1.34 0.188 0 O-C-N 121.611 -0.681 . . . . 1.53 110.315 172.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . 0.41 ' NZ ' ' OE2' ' B' ' 82' ' ' GLU . 0.1 OUTLIER -60.66 -33.85 73.43 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-O 118.291 -0.862 . . . . 1.73 110.138 -175.316 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 17.8 mm-40 -50.67 -33.75 23.83 Favored 'General case' 0 CA--C 1.53 0.204 0 C-N-CA 125.457 1.503 . . . . 2.98 112.046 179.865 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 4.3 tt -56.95 -38.66 60.82 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 119.091 0.859 . . . . 1.1599999999999999 110.634 175.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -82.19 -41.59 20.12 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 125.779 1.632 . . . . 4.2199999999999998 110.225 175.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -108.48 101.58 10.74 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 125.018 1.327 . . . . 4.8099999999999996 111.254 -166.057 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 64.7 pttt -39.65 -14.94 0.01 OUTLIER 'General case' 0 CA--C 1.553 1.081 0 N-CA-C 117.432 2.382 . . . . 6.6600000000000001 117.432 166.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? 86.74 59.91 0.01 OUTLIER 'General case' 0 C--N 1.341 0.221 0 C-N-CA 128.983 2.913 . . . . 5.5099999999999998 109.001 -161.629 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 7.2 t70 -76.36 -144.64 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 124.49 1.116 . . . . 5.0899999999999999 108.64 166.981 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 5.3 tp -52.88 114.15 1.33 Allowed 'General case' 0 N--CA 1.434 -1.248 0 C-N-CA 125.746 1.618 . . . . 8.7400000000000002 111.904 -176.764 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -37.22 137.13 0.39 Allowed 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 125.494 1.518 . . . . 6.9800000000000004 112.578 159.244 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 5.7 pt -125.18 89.42 1.43 Allowed 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 C-N-CA 125.243 1.417 . . . . 9.1600000000000001 109.504 -177.17 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 5.5 ttp180 -155.92 153.38 29.53 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 107.527 -1.286 . . . . 8.8000000000000007 107.527 173.576 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -177.09 137.8 0.23 Allowed 'General case' 0 N--CA 1.455 -0.19 0 N-CA-C 105.844 -1.91 . . . . 6.7199999999999998 105.844 -178.14 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 10.7 tptp . . . . . 0 C--O 1.257 1.474 0 N-CA-C 103.617 -2.735 . . . . 7.5199999999999996 103.617 169.689 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.9 mtp . . . . . 0 N--CA 1.472 0.67 0 N-CA-C 105.251 -2.129 . . . . 7.2999999999999998 105.251 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -74.07 -153.77 0.03 OUTLIER 'General case' 0 N--CA 1.454 -0.229 0 O-C-N 124.072 0.857 . . . . 3.9199999999999999 110.274 165.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.16 57.97 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 C-N-CA 125.132 1.373 . . . . 5.3899999999999997 108.484 -129.049 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.5 pm0 -75.4 116.36 54.0 Favored Pre-proline 0 CA--C 1.54 0.574 0 C-N-CA 126.638 1.975 . . . . 5.6600000000000001 109.68 -176.66 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 92.4 Cg_endo -76.97 101.32 1.5 Allowed 'Trans proline' 0 N--CA 1.453 -0.88 0 C-N-CA 122.507 2.138 . . . . 3.23 109.853 -178.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 94.7 mt -70.54 157.75 37.34 Favored 'General case' 0 CA--C 1.535 0.373 0 CA-C-O 121.66 0.743 . . . . 2.04 110.742 175.456 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 20.1 m -48.44 136.89 12.11 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 126.307 1.843 . . . . 2.2599999999999998 111.47 172.042 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.3 mt-10 -45.31 -54.17 7.49 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 119.027 0.83 . . . . 2.79 112.59 174.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 12.1 mt -57.67 -43.95 85.37 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 119.534 -0.867 . . . . 1.6599999999999999 111.167 179.392 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 52.7 mt-10 -58.96 -51.31 70.62 Favored 'General case' 0 CA--C 1.533 0.294 0 CA-C-N 118.928 0.785 . . . . 2.5 112.132 175.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -50.36 -55.7 14.52 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-O 121.703 0.764 . . . . 3.1499999999999999 109.608 176.104 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 23.5 p -62.94 -42.22 99.74 Favored 'General case' 0 CA--C 1.536 0.431 0 CA-C-N 115.625 -0.716 . . . . 1.4399999999999999 112.395 -175.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.5 pp -71.54 -33.28 48.86 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 CA-C-N 119.651 1.114 . . . . 1.01 111.006 177.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.6 tm-20 -61.3 -57.24 13.16 Favored 'General case' 0 N--CA 1.455 -0.22 0 CA-C-O 118.196 -0.907 . . . . 3.23 109.86 176.673 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.1 t -51.13 -41.29 59.98 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 119.712 1.142 . . . . 2.3599999999999999 111.876 -173.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.9 m -71.78 -37.35 61.98 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 O-C-N 120.945 -1.097 . . . . 0.98999999999999999 111.317 178.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 40.3 t -60.25 -52.29 62.98 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 119.542 1.064 . . . . 0.71999999999999997 110.693 172.69 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.1 t -59.53 -45.13 92.66 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.182 -0.949 . . . . 0.90000000000000002 110.376 178.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 88.5 m -57.44 -46.91 83.05 Favored 'General case' 0 CA--C 1.536 0.417 0 CA-C-N 118.877 0.762 . . . . 1.1699999999999999 111.041 176.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 1.1 t80 -49.63 -56.69 9.15 Favored 'General case' 0 CA--C 1.531 0.216 0 N-CA-C 109.232 -0.655 . . . . 3.5499999999999998 109.232 171.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 1.3 m-85 -57.43 -48.43 79.15 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 122.976 0.51 . . . . 3.8399999999999999 111.478 -175.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 39.6 p -60.47 -56.54 20.16 Favored 'General case' 0 N--CA 1.452 -0.335 0 N-CA-C 109.451 -0.574 . . . . 2.3300000000000001 109.451 -179.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 19.4 m-85 -55.03 -39.15 68.82 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-N 118.729 0.695 . . . . 2.6299999999999999 111.469 178.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.52 -19.32 61.96 Favored 'General case' 0 N--CA 1.453 -0.306 0 C-N-CA 125.47 1.508 . . . . 0.95999999999999996 111.878 -177.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -68.05 -30.74 70.02 Favored 'General case' 0 N--CA 1.454 -0.273 0 CA-C-O 118.308 -0.854 . . . . 4.3099999999999996 111.618 175.836 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -45.73 -63.98 0.84 Allowed 'General case' 0 C--N 1.346 0.439 0 N-CA-C 113.493 0.923 . . . . 2.0499999999999998 113.493 -159.996 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -98.97 80.17 2.45 Favored 'General case' 0 N--CA 1.44 -0.949 0 N-CA-C 104.155 -2.535 . . . . 3.0800000000000001 104.155 177.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 34.96 -150.62 0.01 OUTLIER Glycine 0 CA--C 1.525 0.678 0 C-N-CA 127.746 2.593 . . . . 2.21 112.866 -177.505 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 72.2 mtp85 34.16 81.91 0.02 OUTLIER 'General case' 0 C--O 1.24 0.577 0 C-N-CA 126.122 1.769 . . . . 4.9000000000000004 110.513 164.487 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -74.23 29.64 0.08 Allowed 'General case' 0 CA--C 1.532 0.283 0 C-N-CA 126.703 2.001 . . . . 3.6499999999999999 113.681 -163.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 7.4 m-20 -145.0 -45.77 0.23 Allowed 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.068 1.347 . . . . 3.6299999999999999 107.624 -170.341 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.7 p -84.7 134.04 34.36 Favored 'General case' 0 C--O 1.244 0.798 0 O-C-N 121.366 -0.833 . . . . 1.8400000000000001 111.15 171.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.418 ' HB2' ' HB2' ' A' ' 71' ' ' LEU . 2.3 mm? -90.61 120.73 31.93 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 125.181 1.392 . . . . 2.21 107.896 171.464 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 42.3 t -85.55 -179.94 7.0 Favored 'General case' 0 CA--C 1.54 0.566 0 C-N-CA 126.283 1.833 . . . . 2.1800000000000002 110.921 170.267 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 86.3 t -57.29 -58.17 7.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.317 0 C-N-CA 124.925 1.29 . . . . 2.4700000000000002 111.532 -176.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -63.26 -48.3 78.77 Favored 'General case' 0 C--O 1.219 -0.543 0 N-CA-C 108.138 -1.06 . . . . 3.2400000000000002 108.138 -179.339 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -39.15 -52.44 1.91 Allowed 'General case' 0 C--N 1.332 -0.184 0 C-N-CA 124.965 1.306 . . . . 2.0 112.921 172.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.417 ' CZ ' HD21 ' A' ' 56' ' ' LEU . 2.3 t80 -61.98 -53.82 50.23 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 120.941 -0.304 . . . . 2.8500000000000001 110.215 175.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 31.3 tttt -58.23 -36.99 74.01 Favored 'General case' 0 CA--C 1.537 0.471 0 O-C-N 122.047 -0.408 . . . . 3.5600000000000001 111.337 -172.877 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 73.9 mm-40 -53.72 -40.59 66.21 Favored 'General case' 0 N--CA 1.45 -0.439 0 C-N-CA 125.497 1.519 . . . . 2.3900000000000001 110.887 173.482 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 tp -66.83 -44.02 82.2 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 119.35 0.977 . . . . 2.6699999999999999 109.51 -176.771 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.424 ' HB ' HG12 ' A' ' 53' ' ' VAL . 5.8 m -76.79 -27.27 16.64 Favored 'Isoleucine or valine' 0 C--O 1.225 -0.193 0 CA-C-N 115.914 -0.585 . . . . 1.4299999999999999 111.264 -174.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 94.3 m -73.37 -54.85 7.33 Favored 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 123.158 0.583 . . . . 1.77 110.013 172.331 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 11.0 tt0 -82.68 -58.78 2.75 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.232 1.413 . . . . 2.7000000000000002 112.778 -167.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.2 mm-40 -83.57 -49.65 9.01 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.583 0.753 . . . . 3.2999999999999998 110.901 -167.186 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -75.68 121.58 85.39 Favored Pre-proline 0 CA--C 1.541 0.611 0 N-CA-C 109.089 -0.708 . . . . 3.3799999999999999 109.089 175.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.475 ' HD3' HG21 ' B' ' 7' ' ' THR . 97.9 Cg_endo -84.25 -37.4 0.14 Allowed 'Trans proline' 0 N--CA 1.455 -0.774 0 C-N-CA 122.784 2.322 . . . . 3.3100000000000001 111.627 179.707 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.8 OUTLIER -151.74 -47.94 0.11 Allowed 'General case' 0 C--N 1.34 0.166 0 CA-C-O 118.335 -0.84 . . . . 4.5 111.863 -166.073 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.467 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 9.6 tp -20.76 -78.26 0.01 OUTLIER 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 127.43 2.292 . . . . 1.8899999999999999 113.409 -178.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.645 ' O ' HG13 ' A' ' 53' ' ' VAL . 49.8 mt -77.82 69.1 4.01 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 123.444 0.698 . . . . 2.6000000000000001 109.489 -179.834 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.38 -8.68 0.14 Allowed 'General case' 0 CA--C 1.543 0.684 0 C-N-CA 125.084 1.354 . . . . 5.4699999999999998 114.091 175.691 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -71.4 -8.92 56.94 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 128.09 2.556 . . . . 5.2000000000000002 110.679 176.097 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . 0.645 HG13 ' O ' ' A' ' 50' ' ' LEU . 33.4 m -39.74 -37.24 0.36 Allowed 'Isoleucine or valine' 0 C--N 1.345 0.404 0 C-N-CA 124.395 1.078 . . . . 1.99 113.44 179.496 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -46.53 -39.64 10.54 Favored Glycine 0 CA--C 1.532 1.151 0 C-N-CA 124.087 0.851 . . . . 2.1000000000000001 112.728 176.781 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.1 t -120.39 43.92 2.59 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.771 1.228 . . . . 2.5299999999999998 109.374 174.164 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.481 ' C ' HD13 ' A' ' 56' ' ' LEU . 2.1 tm? -43.55 -44.98 6.4 Favored 'General case' 0 C--N 1.339 0.111 0 CA-C-O 122.144 0.973 . . . . 1.03 110.052 173.59 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -59.65 -26.04 65.2 Favored 'General case' 0 N--CA 1.443 -0.787 0 C-N-CA 125.751 1.62 . . . . 4.7999999999999998 111.805 -172.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -73.02 -43.73 61.72 Favored 'General case' 0 CA--C 1.534 0.361 0 CA-C-N 119.742 1.156 . . . . 3.5600000000000001 108.934 171.842 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.06 -41.69 79.19 Favored 'General case' 0 N--CA 1.45 -0.446 0 N-CA-C 108.605 -0.887 . . . . 2.6099999999999999 108.605 176.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -52.09 -50.28 61.91 Favored 'General case' 0 C--O 1.226 -0.152 0 C-N-CA 123.038 0.535 . . . . 1.72 110.775 175.246 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.85 -43.21 94.75 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-N 118.427 0.558 . . . . 4.21 110.768 178.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.0 t -58.96 -40.09 83.67 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-O 120.938 0.399 . . . . 1.8600000000000001 110.929 174.656 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.844 ' HB3' HD11 ' A' ' 71' ' ' LEU . 1.4 tp -65.5 -56.45 12.32 Favored 'General case' 0 N--CA 1.453 -0.32 0 C-N-CA 123.635 0.774 . . . . 2.7400000000000002 109.884 -178.648 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 52.3 t0 -79.09 75.0 5.63 Favored 'General case' 0 N--CA 1.452 -0.333 0 CA-C-O 121.256 0.55 . . . . 1.8899999999999999 110.576 -177.907 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 30.7 m -52.48 -25.59 8.04 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 C-N-CA 123.293 0.637 . . . . 1.76 112.616 177.233 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 20.2 m120 -79.23 -29.16 42.59 Favored 'General case' 0 C--N 1.34 0.159 0 CA-C-N 118.625 0.648 . . . . 2.4900000000000002 112.003 178.944 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 54.98 55.1 8.11 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 123.692 0.797 . . . . 3.6800000000000002 110.114 -160.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 56.4 p30 -110.28 -8.26 14.75 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 126.229 1.811 . . . . 2.3399999999999999 112.353 177.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.5 m 67.16 18.23 10.39 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 125.227 1.411 . . . . 2.1499999999999999 112.86 -175.685 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 22.9 mt-10 -123.53 118.58 27.69 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 124.877 1.271 . . . . 3.3199999999999998 108.023 166.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.844 HD11 ' HB3' ' A' ' 63' ' ' LEU . 4.1 mm? -83.22 100.94 10.9 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 106.194 -1.78 . . . . 1.24 106.194 165.203 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.3 mptp? -62.79 164.99 7.11 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 109.19 -0.671 . . . . 3.2400000000000002 109.19 169.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 3.7 m-85 -39.5 -58.96 1.17 Allowed 'General case' 0 N--CA 1.464 0.263 0 C-N-CA 124.913 1.285 . . . . 4.7599999999999998 111.218 176.565 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.2 t30 -70.4 -31.32 68.49 Favored 'General case' 0 N--CA 1.452 -0.329 0 C-N-CA 124.156 0.982 . . . . 1.6899999999999999 111.357 -170.434 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 49.4 mt-10 -69.07 -56.77 6.71 Favored 'General case' 0 N--CA 1.452 -0.37 0 N-CA-C 108.876 -0.787 . . . . 1.96 108.876 173.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 15.6 t80 -55.04 -42.22 72.4 Favored 'General case' 0 CA--C 1.516 -0.328 0 N-CA-C 110.058 -0.349 . . . . 3.6499999999999999 110.058 -178.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.658 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 37.3 t90 -46.18 -36.55 6.11 Favored 'General case' 0 N--CA 1.44 -0.949 0 C-N-CA 124.325 1.05 . . . . 4.5999999999999996 112.286 176.186 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 8.5 mtm180 -45.71 -42.94 12.33 Favored 'General case' 0 C--N 1.346 0.427 0 CA-C-N 119.129 0.877 . . . . 4.2800000000000002 111.023 174.48 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 16.4 tp -48.07 -50.09 29.3 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 123.398 0.679 . . . . 0.81999999999999995 111.045 176.76 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 19.5 mm -65.25 -27.85 43.06 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.454 0 N-CA-C 108.091 -1.077 . . . . 2.1800000000000002 108.091 -175.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.538 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -61.13 -50.88 62.46 Favored Glycine 0 CA--C 1.494 -1.23 0 N-CA-C 109.429 -1.469 . . . . 1.5600000000000001 109.429 173.345 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 6.6 mm-40 -76.95 -32.31 57.22 Favored 'General case' 0 N--CA 1.428 -1.571 0 CA-C-O 117.8 -1.095 . . . . 2.2999999999999998 109.028 -171.254 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.467 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 7.0 mp -51.67 -58.02 7.56 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 120.297 1.408 . . . . 2.3399999999999999 109.9 161.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.46 -29.62 67.93 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.792 0.837 . . . . 1.55 112.032 -176.588 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.11 -60.09 2.42 Favored 'General case' 0 C--O 1.216 -0.69 0 CA-C-O 118.587 -0.72 . . . . 1.8899999999999999 110.022 167.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 6.7 mm-40 -47.12 -48.63 23.06 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 127.103 2.161 . . . . 3.2000000000000002 111.41 -168.97 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 12.5 tt -51.24 -33.54 13.83 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 112.477 0.547 . . . . 1.6000000000000001 112.477 175.843 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -95.05 -46.44 6.81 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.597 2.359 . . . . 5.5300000000000002 111.603 -174.452 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 64.0 tttp -81.91 -49.49 10.26 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 128.035 2.534 . . . . 3.3799999999999999 112.959 -177.961 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 12.1 tptm -65.48 -24.47 67.16 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.186 -0.946 . . . . 9.2599999999999998 112.423 -158.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 94.5 mttt -118.9 31.53 6.6 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 124.806 1.242 . . . . 11.17 110.74 178.354 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 27.9 t0 -53.92 -53.75 48.31 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 115.809 1.781 . . . . 6.9400000000000004 115.809 -154.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 19.0 tp -29.74 -52.48 0.13 Allowed 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 130.809 3.643 . . . . 10.4 115.952 -160.594 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 14.6 mptt -55.15 121.27 8.43 Favored 'General case' 0 CA--C 1.538 0.482 0 O-C-N 121.878 -0.514 . . . . 12.640000000000001 111.616 -169.42 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 48.6 pt -67.2 171.28 0.84 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 C-N-CA 124.101 0.96 . . . . 15.130000000000001 111.161 177.77 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.3 mmp_? 66.88 -139.83 0.14 Allowed 'General case' 0 CA--C 1.535 0.371 0 N-CA-C 105.812 -1.921 . . . . 19.510000000000002 105.812 -154.831 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.405 ' NZ ' ' O ' ' B' ' 2' ' ' ALA 2.343 0.0 OUTLIER 152.09 -18.28 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.762 0 N-CA-C 119.327 3.084 . . . . 11.550000000000001 119.327 159.23 . . . . . . . . 4 4 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.402 ' C ' ' H ' ' A' ' 97' ' ' LYS . 5.5 mtpm? . . . . . 0 C--O 1.247 0.966 0 CA-C-N 125.197 3.635 . . . . 14.859999999999999 110.942 54.11 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 87.1 mtp . . . . . 0 N--CA 1.472 0.661 0 CA-C-O 117.321 -1.323 . . . . 8.3499999999999996 108.76 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . 0.405 ' O ' ' NZ ' ' A' ' 97' ' ' LYS . . . -126.07 -177.82 4.09 Favored 'General case' 0 N--CA 1.47 0.531 0 CA-C-N 119.68 1.127 . . . . 5.9299999999999997 113.869 -145.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 86.38 101.16 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 126.738 2.015 . . . . 5.1100000000000003 113.681 167.837 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 32.7 mt-10 -138.38 174.89 3.77 Favored Pre-proline 0 CA--C 1.55 0.977 0 C-N-CA 129.403 3.081 . . . . 6.7599999999999998 104.796 172.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 94.8 Cg_endo -88.02 133.23 2.9 Favored 'Trans proline' 0 CA--C 1.541 0.857 0 C-N-CA 123.348 2.699 . . . . 2.7799999999999998 110.521 173.085 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.43 HD13 ' HB3' ' B' ' 10' ' ' GLU . 2.1 mt -139.21 -177.63 5.0 Favored 'General case' 0 CA--C 1.542 0.655 0 N-CA-C 113.594 0.961 . . . . 2.2999999999999998 113.594 -154.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.475 HG21 ' HD3' ' A' ' 47' ' ' PRO . 10.0 t -81.03 -173.25 4.18 Favored 'General case' 0 N--CA 1.471 0.596 0 C-N-CA 124.758 1.223 . . . . 2.1899999999999999 110.088 166.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 73.8 tt0 -73.11 -54.66 7.93 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.256 0.622 . . . . 3.6800000000000002 111.875 -173.263 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 2.9 mt -53.28 -46.66 69.39 Favored 'General case' 0 CA--C 1.53 0.203 0 O-C-N 121.199 -0.938 . . . . 1.6799999999999999 109.64 177.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.445 ' OE1' HD13 ' A' ' 49' ' ' LEU . 15.7 mt-10 -51.8 -54.99 22.63 Favored 'General case' 0 N--CA 1.447 -0.625 0 N-CA-C 113.917 1.08 . . . . 2.9399999999999999 113.917 169.478 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 4.9 pt-20 -60.96 -33.97 74.03 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 119.882 1.219 . . . . 4.1600000000000001 110.331 -177.986 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 13.4 m -60.94 -55.74 29.39 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 123.213 0.605 . . . . 1.3200000000000001 110.891 173.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.28 2.3 pp -60.49 -39.23 80.57 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.366 0 O-C-N 121.505 -0.747 . . . . 1.3100000000000001 110.87 179.58 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -61.12 -55.94 26.59 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.75 0.704 . . . . 2.5899999999999999 110.241 175.269 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.1 t -54.54 -38.53 66.69 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 119.194 0.906 . . . . 1.4299999999999999 111.214 -173.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 12.8 m -75.41 -37.42 38.06 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.311 0 O-C-N 121.356 -0.84 . . . . 1.24 111.494 176.531 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 25.0 t -58.6 -46.68 90.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 119.759 1.163 . . . . 1.3300000000000001 110.785 173.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 15.0 t -65.83 -46.87 76.92 Favored 'General case' 0 CA--C 1.537 0.463 0 O-C-N 121.353 -0.842 . . . . 1.5600000000000001 110.516 179.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 86.1 m -59.21 -45.53 90.86 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 120.081 1.309 . . . . 1.3 110.861 176.428 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -47.07 -54.94 9.22 Favored 'General case' 0 C--O 1.225 -0.196 0 N-CA-C 109.231 -0.655 . . . . 4.2999999999999998 109.231 170.03 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -58.89 -51.66 69.07 Favored 'General case' 0 CA--C 1.534 0.363 0 C-N-CA 122.977 0.511 . . . . 2.6699999999999999 111.697 -176.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 41.5 p -62.15 -35.18 77.99 Favored 'General case' 0 CA--C 1.531 0.215 0 O-C-N 121.556 -0.715 . . . . 2.23 111.229 -177.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -70.03 -44.11 69.93 Favored 'General case' 0 CA--C 1.532 0.265 0 CA-C-N 118.468 0.576 . . . . 2.98 111.016 170.376 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.93 -27.13 68.63 Favored 'General case' 0 N--CA 1.449 -0.485 0 C-N-CA 125.356 1.463 . . . . 1.1100000000000001 111.0 -173.045 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 2.2 ppt_? -55.72 -26.37 44.93 Favored 'General case' 0 N--CA 1.454 -0.233 0 CA-C-O 118.926 -0.559 . . . . 3.9900000000000002 110.957 179.26 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.61 -70.9 0.14 Allowed 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 116.085 1.883 . . . . 3.3700000000000001 116.085 -147.542 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 63.7 mt-10 -95.14 -76.92 0.48 Allowed 'General case' 0 CA--C 1.53 0.18 0 CA-C-O 122.328 1.061 . . . . 3.0800000000000001 113.257 -169.421 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.43 112.38 4.22 Favored Glycine 0 N--CA 1.445 -0.732 0 C-N-CA 127.447 2.451 . . . . 2.3300000000000001 109.557 168.079 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 28.6 ttt85 66.85 109.07 0.04 OUTLIER 'General case' 0 CA--C 1.531 0.241 0 CA-C-N 121.027 2.413 . . . . 4.4299999999999997 115.845 149.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 21.1 pttt -53.35 -13.64 0.6 Allowed 'General case' 0 CA--C 1.541 0.61 0 N-CA-C 116.565 2.061 . . . . 4.1500000000000004 116.565 177.272 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 40.4 m-20 -88.46 -46.41 9.15 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.761 0.824 . . . . 3.8700000000000001 110.494 -170.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 5.4 p -107.28 163.27 13.17 Favored 'General case' 0 C--O 1.237 0.413 0 C-N-CA 126.69 1.996 . . . . 1.8999999999999999 109.512 -175.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.4 mp -120.78 140.75 51.26 Favored 'General case' 0 C--O 1.224 -0.257 0 CA-C-O 121.718 0.771 . . . . 2.7799999999999998 112.743 170.183 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 5.1 t -86.33 -170.06 2.92 Favored 'General case' 0 N--CA 1.451 -0.421 0 C-N-CA 128.473 2.709 . . . . 2.7000000000000002 110.427 174.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 67.7 t -66.65 -108.27 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.327 -0.384 1 C-N-CA 132.056 4.142 . . . . 2.6600000000000001 100.215 177.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -75.42 58.01 0.96 Allowed 'General case' 0 CA--C 1.549 0.942 0 CA-C-N 124.068 3.122 . . . . 2.6200000000000001 112.511 -175.154 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 4.7 tt0 -123.97 -47.5 1.92 Allowed 'General case' 0 CA--C 1.542 0.639 1 C-N-CA 131.897 4.079 . . . . 2.1099999999999999 106.301 154.114 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -60.7 -48.02 83.65 Favored 'General case' 0 C--N 1.344 0.336 0 O-C-N 121.282 -0.886 . . . . 2.8399999999999999 109.925 166.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 13.7 ttmt -59.57 -31.84 69.82 Favored 'General case' 0 CA--C 1.533 0.327 0 CA-C-O 121.217 0.532 . . . . 2.9900000000000002 110.121 -171.513 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 78.6 mm-40 -54.73 -41.37 70.29 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 123.461 0.705 . . . . 2.9300000000000002 112.241 173.901 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.1 tp -63.89 -47.24 81.41 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-N 120.391 1.45 . . . . 2.0699999999999998 109.403 -176.158 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 16.9 m -69.66 -41.0 80.03 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.327 0 CA-C-N 115.346 -0.843 . . . . 0.90000000000000002 109.477 -172.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 85.4 m -68.13 -55.55 11.99 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 123.401 0.68 . . . . 1.1200000000000001 110.519 177.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 -81.84 -58.84 2.81 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 125.627 1.571 . . . . 2.4500000000000002 111.635 -163.941 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -80.33 -41.23 25.19 Favored 'General case' 0 N--CA 1.466 0.353 0 O-C-N 122.017 -0.427 . . . . 3.9100000000000001 111.093 -172.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.9 tp -82.59 -14.55 0.21 Allowed Pre-proline 0 CA--C 1.546 0.819 0 N-CA-C 119.129 3.011 . . . . 2.0899999999999999 119.129 -158.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -38.96 -56.73 1.1 Allowed 'Trans proline' 0 CA--C 1.535 0.572 1 C-N-CA 125.601 4.201 . . . . 2.3300000000000001 116.274 -133.725 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 3.8 t-80 -71.44 -26.58 62.79 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 121.741 -0.6 . . . . 3.4100000000000001 112.439 -169.013 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 39.0 tp -62.33 -77.01 0.05 Allowed 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 123.081 0.552 . . . . 1.4399999999999999 111.402 -166.144 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -82.81 97.68 8.75 Favored 'General case' 0 N--CA 1.452 -0.329 0 N-CA-C 108.293 -1.003 . . . . 1.6299999999999999 108.293 168.695 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 15.6 pttp -63.54 179.33 0.47 Allowed 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 121.007 0.432 . . . . 5.2699999999999996 110.209 167.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 14.2 m-20 57.65 34.98 25.18 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.248 1.019 . . . . 5.7699999999999996 109.882 177.347 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -55.55 -22.08 11.3 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.386 0 C-N-CA 125.933 1.693 . . . . 3.1000000000000001 112.999 -173.823 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -46.01 -41.95 11.35 Favored Glycine 0 CA--C 1.531 1.075 0 N-CA-C 111.316 -0.714 . . . . 2.3399999999999999 111.316 168.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 82.5 p -76.28 43.11 0.29 Allowed 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 117.723 0.761 . . . . 4.2300000000000004 112.179 -178.993 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.426 HD13 ' C ' ' B' ' 56' ' ' LEU . 3.2 tm? -74.94 -50.16 17.7 Favored 'General case' 0 N--CA 1.445 -0.697 0 O-C-N 120.98 -1.075 . . . . 1.1599999999999999 109.055 -179.816 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -69.46 -14.17 62.74 Favored 'General case' 0 CA--C 1.542 0.639 0 O-C-N 121.91 -0.494 . . . . 4.3600000000000003 112.327 -161.003 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 4.0 pt-20 -80.54 -41.42 24.17 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.702 0.801 . . . . 2.9100000000000001 111.517 165.288 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . 0.422 ' O ' HD12 ' B' ' 63' ' ' LEU . 0.0 OUTLIER -55.37 -49.64 71.77 Favored 'General case' 0 C--N 1.342 0.267 0 N-CA-C 107.584 -1.265 . . . . 3.54 107.584 171.238 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -39.62 -53.83 2.09 Favored 'General case' 0 C--O 1.222 -0.357 0 C-N-CA 124.033 0.933 . . . . 1.96 110.978 176.846 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -60.74 -37.61 82.34 Favored 'General case' 0 CA--C 1.541 0.597 0 N-CA-C 112.361 0.504 . . . . 2.7799999999999998 112.361 179.727 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.0 t -67.18 -30.44 70.39 Favored 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 112.844 0.683 . . . . 2.4199999999999999 112.844 175.251 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.422 HD12 ' O ' ' B' ' 59' ' ' LYS . 5.9 mp -80.32 -54.52 5.64 Favored 'General case' 0 CA--C 1.531 0.232 0 O-C-N 121.455 -0.778 . . . . 1.53 110.385 176.046 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 24.7 t0 -54.31 -12.04 0.6 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 128.562 2.745 . . . . 1.51 116.051 -170.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -35.66 -21.99 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.408 1 C-N-CA 132.404 4.281 . . . . 2.6800000000000002 119.681 -130.367 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 16.8 p30 -64.82 -19.1 65.67 Favored 'General case' 0 N--CA 1.467 0.384 0 CA-C-N 120.198 1.363 . . . . 2.3700000000000001 110.949 163.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 65.13 58.8 0.87 Allowed 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.323 1.049 . . . . 2.8999999999999999 110.041 169.526 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 57.0 p30 -108.24 -6.54 16.3 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 126.395 1.878 . . . . 1.8300000000000001 110.839 -178.397 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m 67.97 12.66 8.9 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.448 1.499 . . . . 2.1600000000000001 113.753 -173.515 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 17.1 mt-10 -114.93 100.88 8.53 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 125.372 1.469 . . . . 3.02 107.106 162.249 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -62.92 100.55 0.21 Allowed 'General case' 0 N--CA 1.448 -0.553 0 N-CA-C 106.038 -1.838 . . . . 1.0800000000000001 106.038 166.992 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.8 tppt? -84.22 167.63 16.48 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 125.729 1.612 . . . . 4.21 110.199 -167.821 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -92.1 52.44 1.97 Allowed 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 121.646 0.736 . . . . 4.3499999999999996 110.951 -179.414 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.5 t30 -162.28 49.74 0.19 Allowed 'General case' 0 CA--C 1.541 0.603 0 N-CA-C 105.925 -1.88 . . . . 2.1099999999999999 105.925 113.782 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 85.4 mt-10 -95.68 -61.08 1.52 Allowed 'General case' 0 N--CA 1.447 -0.583 0 O-C-N 119.914 -1.741 . . . . 2.0499999999999998 109.097 148.34 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 51.5 t80 -53.23 -37.73 62.31 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 124.567 1.147 . . . . 4.2699999999999996 110.786 -170.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.658 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 17.7 t-105 -39.35 -37.77 0.47 Allowed 'General case' 0 CA--C 1.541 0.61 0 C-N-CA 125.129 1.372 . . . . 4.4100000000000001 111.535 172.608 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 3.4 mmm180 -37.77 -49.39 1.16 Allowed 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.595 1.558 . . . . 5.4699999999999998 111.605 173.302 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.8 tp -53.4 -40.79 65.34 Favored 'General case' 0 C--N 1.341 0.222 0 CA-C-O 119.741 -0.171 . . . . 0.88 110.582 -176.241 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 76.4 mt -63.75 -28.15 44.37 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 N-CA-C 108.602 -0.888 . . . . 1.73 108.602 -173.1 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.58 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -76.01 -45.8 15.13 Favored Glycine 0 CA--C 1.487 -1.671 0 N-CA-C 109.857 -1.297 . . . . 1.3 109.857 178.343 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -68.2 -34.63 76.62 Favored 'General case' 0 N--CA 1.432 -1.363 0 N-CA-C 107.823 -1.177 . . . . 2.2799999999999998 107.823 -175.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 5.4 mt -49.23 -60.16 3.05 Favored 'General case' 0 CA--C 1.539 0.549 0 CA-C-N 120.642 1.565 . . . . 2.1400000000000001 111.087 169.388 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.46 -50.83 68.83 Favored 'General case' 0 CA--C 1.531 0.216 0 CA-C-O 122.092 0.949 . . . . 1.1799999999999999 110.127 -179.355 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 12.7 ttpp -60.18 -40.15 89.01 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 123.769 0.828 . . . . 1.5700000000000001 110.329 -177.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 22.7 mm-40 -64.37 -43.11 95.54 Favored 'General case' 0 C--O 1.226 -0.144 0 C-N-CA 125.716 1.606 . . . . 2.77 110.417 176.704 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -32.14 47.53 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 C-N-CA 119.545 -0.862 . . . . 1.6200000000000001 110.836 171.023 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -78.91 -36.27 42.15 Favored 'General case' 0 CA--C 1.547 0.841 0 N-CA-C 113.75 1.019 . . . . 3.54 113.75 -179.94 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -121.23 150.86 40.71 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 125.25 1.42 . . . . 6.4699999999999998 112.285 -168.141 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -85.53 -35.59 21.02 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 114.588 1.329 . . . . 6.1299999999999999 114.588 146.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 40.9 tptt -104.6 -41.29 5.74 Favored 'General case' 0 N--CA 1.466 0.358 0 N-CA-C 115.427 1.64 . . . . 7.75 115.427 -148.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -56.64 138.94 51.66 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 119.186 0.903 . . . . 6.9100000000000001 109.411 178.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 1.3 pp 171.49 -41.25 0.0 OUTLIER 'General case' 0 C--N 1.331 -0.213 0 C-N-CA 128.16 2.584 . . . . 7.2199999999999998 108.26 176.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 59.8 mtpt -76.92 142.79 39.94 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.799 -0.815 . . . . 8.6899999999999995 108.799 174.193 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 14.7 tt -155.94 170.64 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.295 0 N-CA-C 106.843 -1.54 . . . . 7.25 106.843 -174.856 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 52.7 ttt180 -146.13 170.38 16.81 Favored 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 107.863 -1.162 . . . . 8.0999999999999996 107.863 -176.292 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -176.19 136.66 0.29 Allowed 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 126.044 1.738 . . . . 6.46 107.235 179.593 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 53.2 tptt . . . . . 0 C--O 1.252 1.197 0 N-CA-C 104.971 -2.233 . . . . 8.2799999999999994 104.971 154.133 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 89.1 mtp . . . . . 0 N--CA 1.472 0.665 0 N-CA-C 106.688 -1.597 . . . . 7.8099999999999996 106.688 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.03 90.33 0.19 Allowed 'General case' 0 CA--C 1.533 0.303 0 CA-C-N 119.397 0.999 . . . . 6.0499999999999998 112.43 -173.945 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 29.19 93.97 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 127.429 2.292 . . . . 8.1199999999999992 114.607 153.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 -155.34 -62.78 0.02 OUTLIER Pre-proline 0 CA--C 1.539 0.548 0 N-CA-C 107.495 -1.298 . . . . 6.5999999999999996 107.495 -170.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 64.3 Cg_endo -65.82 164.89 25.24 Favored 'Trans proline' 0 N--CA 1.456 -0.714 0 C-N-CA 121.359 1.373 . . . . 3.04 111.049 170.684 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.1 mt -112.13 -178.38 3.4 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 127.046 2.138 . . . . 1.77 109.921 -164.298 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.5 t -70.96 167.08 19.91 Favored 'General case' 0 N--CA 1.471 0.58 0 O-C-N 120.733 -1.229 . . . . 2.0299999999999998 110.093 176.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -61.56 -54.38 43.85 Favored 'General case' 0 CA--C 1.536 0.42 0 O-C-N 121.166 -0.959 . . . . 2.2400000000000002 111.607 -166.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.7 mt -60.97 -44.24 97.6 Favored 'General case' 0 C--O 1.222 -0.357 0 O-C-N 121.344 -0.847 . . . . 1.4399999999999999 111.232 177.563 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -50.87 -51.47 51.16 Favored 'General case' 0 CA--C 1.545 0.766 0 C-N-CA 127.207 2.203 . . . . 2.3999999999999999 112.21 174.846 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.1 mm-40 -49.84 -58.41 5.45 Favored 'General case' 0 CA--C 1.532 0.265 0 C-N-CA 123.569 0.748 . . . . 4.4299999999999997 109.157 170.393 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 15.0 m -56.08 -50.65 70.42 Favored 'General case' 0 CA--C 1.533 0.298 0 C-N-CA 123.973 0.909 . . . . 2.3799999999999999 111.719 -173.828 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.276 2.7 pp -61.92 -43.61 97.72 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.422 0 N-CA-C 109.004 -0.739 . . . . 1.1399999999999999 109.004 -177.646 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.3 tt0 -61.29 -45.69 93.42 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 119.305 0.957 . . . . 4.21 110.925 175.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.4 OUTLIER -56.25 -36.53 68.64 Favored 'General case' 0 CA--C 1.54 0.568 0 C-N-CA 123.614 0.766 . . . . 1.8300000000000001 111.747 -178.403 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . 0.252 31.2 m -79.46 -40.13 21.3 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 O-C-N 120.926 -1.109 . . . . 1.0600000000000001 111.5 172.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 51.8 t -51.2 -48.46 31.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.421 0 CA-C-N 120.48 1.491 . . . . 1.0600000000000001 110.989 175.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 11.2 t -59.55 -40.9 88.79 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.866 -0.522 . . . . 0.75 110.524 178.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . 0.782 HG21 HD21 ' B' ' 9' ' ' LEU . 28.7 m -58.94 -50.08 75.39 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.434 0.694 . . . . 1.0800000000000001 110.039 176.523 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 6.7 m-30 -52.36 -57.25 10.4 Favored 'General case' 0 C--O 1.226 -0.169 0 C-N-CA 123.423 0.689 . . . . 6.6100000000000003 109.191 175.351 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 84.0 t80 -56.51 -53.38 58.19 Favored 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 124.635 1.174 . . . . 3.6200000000000001 110.382 -172.233 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.8 t -63.4 -48.5 77.6 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 120.008 -0.677 . . . . 1.8300000000000001 110.403 -176.909 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -60.62 -42.39 96.74 Favored 'General case' 0 C--O 1.222 -0.382 0 CA-C-N 119.458 1.027 . . . . 3.4700000000000002 110.773 178.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.2 -17.71 58.94 Favored 'General case' 0 C--O 1.236 0.355 0 C-N-CA 124.804 1.242 . . . . 1.05 111.965 177.485 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 4.7 ptt180 -71.04 -20.14 62.42 Favored 'General case' 0 N--CA 1.452 -0.374 0 CA-C-O 117.363 -1.304 . . . . 5.0300000000000002 111.772 173.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -42.35 -63.0 0.83 Allowed 'General case' 0 C--N 1.346 0.456 0 CA-C-N 119.282 0.947 . . . . 2.73 112.009 -175.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -120.7 171.42 8.6 Favored 'General case' 0 N--CA 1.446 -0.645 0 C-N-CA 126.405 1.882 . . . . 2.3900000000000001 106.781 -176.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -11.1 119.45 0.01 OUTLIER Glycine 0 CA--C 1.53 0.989 0 C-N-CA 127.546 2.498 . . . . 1.3799999999999999 114.298 175.022 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 13.6 ttm180 72.56 105.16 0.07 Allowed 'General case' 0 C--O 1.237 0.421 0 C-N-CA 123.446 0.698 . . . . 4.0199999999999996 112.731 167.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 58.1 pttt -75.1 50.17 0.47 Allowed 'General case' 0 CA--C 1.54 0.579 0 C-N-CA 124.56 1.144 . . . . 3.73 112.868 177.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -147.73 -57.6 0.24 Allowed 'General case' 0 C--O 1.227 -0.121 0 C-N-CA 125.802 1.641 . . . . 3.7200000000000002 106.914 174.261 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -84.0 144.66 28.98 Favored 'General case' 0 C--O 1.243 0.757 0 C-N-CA 124.311 1.044 . . . . 1.6599999999999999 111.181 179.746 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 6.6 mp -99.87 121.76 41.79 Favored 'General case' 0 N--CA 1.449 -0.476 0 N-CA-C 108.087 -1.079 . . . . 2.75 108.087 172.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.6 m -79.54 166.82 21.53 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 107.772 -1.195 . . . . 2.5800000000000001 107.772 177.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.6 p -54.88 -44.66 73.58 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 O-C-N 120.92 -1.112 . . . . 2.04 112.695 -169.58 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -62.04 -58.18 8.83 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 109.468 -0.568 . . . . 1.9099999999999999 109.468 176.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -37.76 -52.04 1.27 Allowed 'General case' 0 CA--C 1.532 0.282 0 C-N-CA 126.743 2.017 . . . . 1.8799999999999999 111.744 172.514 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 34.3 t80 -58.27 -55.59 32.97 Favored 'General case' 0 N--CA 1.442 -0.834 0 C-N-CA 124.764 1.225 . . . . 2.8399999999999999 109.15 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 34.6 tttt -59.85 -42.51 93.81 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 119.28 -0.968 . . . . 3.3100000000000001 112.307 178.701 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 73.2 mt-10 -52.23 -42.46 63.62 Favored 'General case' 0 CA--C 1.521 -0.137 0 CA-C-N 119.172 0.897 . . . . 2.2000000000000002 110.621 174.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.4 tt -66.13 -47.18 74.96 Favored 'General case' 0 N--CA 1.446 -0.658 0 N-CA-C 107.758 -1.201 . . . . 3.0099999999999998 107.758 -173.664 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -64.32 -51.85 63.13 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.29 0 C-N-CA 118.581 -1.248 . . . . 1.22 109.393 -178.496 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 95.1 m -48.13 -53.99 14.79 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.446 1.098 . . . . 1.3600000000000001 111.999 178.239 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -80.23 -54.83 5.38 Favored 'General case' 0 CA--C 1.53 0.194 0 C-N-CA 124.337 1.055 . . . . 2.4300000000000002 110.641 -172.617 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 28.3 tt0 -83.31 -39.63 20.53 Favored 'General case' 0 N--CA 1.452 -0.346 0 C-N-CA 124.634 1.174 . . . . 6.0 110.457 -167.486 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.3 mm? -115.48 68.94 2.82 Favored Pre-proline 0 CA--C 1.537 0.473 0 CA-C-N 119.266 0.939 . . . . 2.46 111.288 -179.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 55.7 Cg_endo -64.78 -37.53 35.09 Favored 'Trans proline' 0 N--CA 1.455 -0.766 0 C-N-CA 122.36 2.04 . . . . 2.46 112.302 -178.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 34.5 m170 -123.84 -34.08 3.06 Favored 'General case' 0 C--N 1.342 0.257 0 N-CA-C 113.307 0.854 . . . . 6.4800000000000004 113.307 -174.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.702 HD13 ' CD1' ' B' ' 6' ' ' LEU . 30.2 tp -54.9 -59.85 4.17 Favored 'General case' 0 C--N 1.341 0.21 0 CA-C-N 118.471 0.578 . . . . 2.23 110.182 -175.812 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 16.0 mt -74.92 124.3 26.66 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 105.21 -2.145 . . . . 2.9100000000000001 105.21 152.741 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.2 -7.37 21.26 Favored 'General case' 0 C--N 1.326 -0.415 0 C-N-CA 125.455 1.502 . . . . 7.8600000000000003 110.039 -176.024 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 11.8 t0 -110.22 87.89 2.63 Favored 'General case' 0 N--CA 1.435 -1.188 0 N-CA-C 104.844 -2.28 . . . . 4.46 104.844 169.726 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 19.5 m -98.26 22.63 1.2 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.546 0 CA-C-N 114.59 -1.187 . . . . 2.4399999999999999 108.865 161.811 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -93.2 -76.02 1.32 Allowed Glycine 0 N--CA 1.446 -0.669 0 N-CA-C 107.319 -2.312 . . . . 2.2799999999999998 107.319 176.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 22.7 m -79.22 61.52 3.35 Favored 'General case' 0 N--CA 1.455 -0.215 0 C-N-CA 126.147 1.779 . . . . 2.3500000000000001 110.085 -171.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -72.07 -29.56 64.25 Favored 'General case' 0 N--CA 1.442 -0.848 0 C-N-CA 125.768 1.627 . . . . 1.48 109.327 178.152 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.9 p-10 -53.72 -63.49 1.13 Allowed 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 125.869 1.667 . . . . 4.6699999999999999 112.726 174.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -58.13 -33.66 69.4 Favored 'General case' 0 CA--C 1.533 0.295 0 O-C-N 120.489 -1.382 . . . . 3.0299999999999998 111.046 177.786 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 -56.76 17.11 Favored 'General case' 0 CA--C 1.535 0.4 0 N-CA-C 108.584 -0.895 . . . . 2.5800000000000001 108.584 172.276 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -46.99 -50.53 18.97 Favored 'General case' 0 C--O 1.226 -0.166 0 C-N-CA 123.877 0.871 . . . . 2.1499999999999999 110.01 176.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 3.6 mptp? -60.19 -38.39 83.12 Favored 'General case' 0 CA--C 1.537 0.452 0 CA-C-N 117.981 0.355 . . . . 3.8500000000000001 111.183 -179.899 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 19.7 m -68.67 -47.81 65.57 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 122.642 0.377 . . . . 1.73 111.95 178.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 5.3 mp -73.94 -48.89 27.45 Favored 'General case' 0 C--O 1.232 0.137 0 O-C-N 121.815 -0.553 . . . . 1.9099999999999999 111.122 -176.1 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.2 t70 -75.7 78.44 2.66 Favored 'General case' 0 N--CA 1.452 -0.368 0 C-N-CA 123.48 0.712 . . . . 2.4199999999999999 109.961 -169.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 17.5 m -47.63 -37.4 5.54 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 124.152 0.981 . . . . 2.3500000000000001 113.412 -170.461 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.4 p-10 -96.06 -8.51 33.29 Favored 'General case' 0 CA--C 1.534 0.364 0 N-CA-C 113.059 0.763 . . . . 2.7799999999999998 113.059 -179.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 54.39 55.03 8.58 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 125.969 1.708 . . . . 3.04 111.329 179.266 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 15.3 p30 -87.43 -42.83 12.53 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 123.57 0.748 . . . . 2.0899999999999999 110.22 174.999 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 9.5 m 101.9 13.96 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.486 0 C-N-CA 130.088 3.355 . . . . 1.6599999999999999 112.727 -171.043 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 21.4 mt-10 -112.93 111.35 22.04 Favored 'General case' 0 N--CA 1.45 -0.474 0 N-CA-C 105.514 -2.032 . . . . 3.25 105.514 162.154 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -79.93 89.93 5.32 Favored 'General case' 0 N--CA 1.447 -0.62 0 N-CA-C 103.421 -2.807 . . . . 1.0800000000000001 103.421 175.286 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 26.3 ttpt -71.26 160.27 33.12 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.441 1.097 . . . . 3.3700000000000001 108.349 -178.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -40.09 -60.71 0.99 Allowed 'General case' 0 CA--C 1.54 0.56 0 C-N-CA 124.561 1.144 . . . . 5.0300000000000002 112.975 -168.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 3.8 t30 -69.66 -20.02 63.59 Favored 'General case' 0 CA--C 1.544 0.715 0 N-CA-C 113.195 0.813 . . . . 1.9099999999999999 113.195 -177.97 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -76.7 -61.35 2.0 Allowed 'General case' 0 C--O 1.231 0.111 0 CA-C-N 119.866 1.212 . . . . 1.8300000000000001 108.288 172.796 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 12.1 t80 -45.33 -39.75 7.04 Favored 'General case' 0 N--CA 1.456 -0.133 0 C-N-CA 125.586 1.554 . . . . 2.8900000000000001 110.792 176.685 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.489 ' HE1' ' HA3' ' B' ' 81' ' ' GLY . 11.6 t90 -39.07 -43.59 1.04 Allowed 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 125.243 1.417 . . . . 4.71 114.686 174.296 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.53 -38.92 32.58 Favored 'General case' 0 C--O 1.221 -0.399 0 N-CA-C 109.793 -0.447 . . . . 6.5800000000000001 109.793 178.251 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 8.5 tp -57.06 -42.39 80.51 Favored 'General case' 0 N--CA 1.449 -0.52 0 CA-C-O 118.862 -0.59 . . . . 1.0800000000000001 111.278 178.238 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 14.9 mm -70.76 -41.07 77.46 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.544 0 N-CA-C 107.195 -1.409 . . . . 1.75 107.195 -177.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.521 ' HA2' ' CD2' ' B' ' 77' ' ' TRP . . . -60.97 -38.35 95.34 Favored Glycine 0 N--CA 1.441 -1.006 0 CA-C-N 115.24 -0.891 . . . . 1.24 111.687 178.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -81.02 -49.36 11.02 Favored 'General case' 0 N--CA 1.432 -1.334 0 CA-C-O 117.789 -1.1 . . . . 3.5899999999999999 111.331 -179.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.464 HD12 HG21 ' B' ' 13' ' ' ILE 0.258 4.0 pp -55.34 -34.0 63.84 Favored 'General case' 0 CA--C 1.541 0.596 0 CA-C-N 120.885 1.675 . . . . 2.4399999999999999 110.881 174.735 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.42 -40.34 78.13 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 121.219 -0.925 . . . . 2.04 112.52 168.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.3 -48.42 75.74 Favored 'General case' 0 C--N 1.331 -0.201 0 C-N-CA 125.068 1.347 . . . . 2.8900000000000001 111.484 173.793 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -62.38 -28.11 69.54 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 125.679 1.592 . . . . 2.8399999999999999 111.936 -158.778 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.0 tt -50.73 -38.05 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.77 0 C-N-CA 123.497 0.719 . . . . 1.8899999999999999 111.279 169.073 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . 2.306 0.0 OUTLIER -86.73 -55.13 4.0 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 129.342 3.057 . . . . 5.1100000000000003 110.472 176.324 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 13.1 tttm -76.03 62.69 1.68 Allowed 'General case' 0 CA--C 1.537 0.466 0 C-N-CA 127.465 2.306 . . . . 4.9199999999999999 112.471 -168.839 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.573 ' HE3' ' HB3' ' B' ' 1' ' ' MET . 1.2 ttpp -80.31 -18.34 49.47 Favored 'General case' 0 CA--C 1.537 0.45 0 O-C-N 121.245 -0.909 . . . . 8.9100000000000001 110.364 151.493 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . 0.568 ' HD3' ' HB2' ' B' ' 1' ' ' MET . 16.7 pttt -125.22 -41.2 2.08 Favored 'General case' 0 N--CA 1.454 -0.226 0 C-N-CA 124.941 1.296 . . . . 12.09 113.263 -158.743 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 13.2 m-20 54.36 -76.95 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 108.071 -1.085 . . . . 7.3700000000000001 108.071 -144.334 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -162.33 29.49 0.11 Allowed 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 126.123 1.769 . . . . 10.949999999999999 110.879 169.628 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 25.3 pttm -154.75 170.75 20.87 Favored 'General case' 0 CA--C 1.532 0.285 0 O-C-N 121.229 -0.919 . . . . 12.98 112.722 -164.261 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 0.33 0.3 OUTLIER 52.91 71.35 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 127.847 2.459 . . . . 10.76 114.41 167.06 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 34.1 mmm-85 69.39 134.74 0.03 OUTLIER 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 126.566 1.947 . . . . 14.210000000000001 112.876 162.727 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . 2.495 0.0 OUTLIER 151.83 51.06 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.43 1 C-N-CA 132.878 4.471 . . . . 13.09 104.722 -1.663 . . . . . . . . 4 3 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp . . . . . 0 C--O 1.249 1.07 1 C-N-CA 131.711 4.004 . . . . 14.43 102.372 179.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.573 ' HB3' ' HE3' ' A' ' 90' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.479 0.998 0 CA-C-O 118.929 -0.558 . . . . 8.1500000000000004 110.612 . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 160.27 -171.87 0.01 OUTLIER 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 127.779 2.432 . . . . 4.0800000000000001 107.493 -177.928 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 104.86 97.05 0.01 OUTLIER 'General case' 0 CA--C 1.538 0.496 0 N-CA-C 117.268 2.322 . . . . 4.21 117.268 128.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.448 ' HB3' ' CD ' ' B' ' 5' ' ' PRO 0.512 15.3 tt0 120.99 -114.82 0.0 OUTLIER Pre-proline 0 CA--C 1.552 1.042 0 CA-C-O 115.322 -2.275 . . . . 6.5800000000000001 115.071 105.902 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . 0.448 ' CD ' ' HB3' ' B' ' 4' ' ' GLU . 65.5 Cg_endo -86.07 124.96 2.59 Favored 'Trans proline' 0 C--N 1.353 0.806 0 CA-C-N 124.562 2.665 . . . . 2.3700000000000001 112.588 -167.817 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.702 ' CD1' HD13 ' A' ' 49' ' ' LEU . 0.1 OUTLIER -132.24 -92.19 0.39 Allowed 'General case' 0 CA--C 1.552 1.049 0 N-CA-C 115.718 1.747 . . . . 3.54 115.718 -166.57 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.471 ' H ' ' HG2' ' B' ' 10' ' ' GLU . 9.2 t -130.04 -140.97 0.23 Allowed 'General case' 0 CA--C 1.544 0.716 0 C-N-CA 127.84 2.456 . . . . 2.1299999999999999 111.409 -171.724 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 28.4 tt0 -87.46 -63.58 1.28 Allowed 'General case' 0 C--N 1.34 0.157 0 C-N-CA 125.448 1.499 . . . . 3.1200000000000001 107.948 177.206 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . 0.782 HD21 HG21 ' A' ' 19' ' ' THR . 0.6 OUTLIER -50.23 -34.13 21.93 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 123.628 0.771 . . . . 3.2799999999999998 111.354 -179.395 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.471 ' HG2' ' H ' ' B' ' 7' ' ' THR . 0.0 OUTLIER -46.72 -46.83 20.52 Favored 'General case' 0 N--CA 1.453 -0.31 0 C-N-CA 122.89 0.476 . . . . 6.5300000000000002 110.933 175.202 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.402 ' N ' ' HG3' ' B' ' 10' ' ' GLU . 19.8 mt-10 -65.04 -44.15 90.04 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 108.149 -1.056 . . . . 5.0199999999999996 108.149 -171.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 24.6 p -75.09 -27.09 59.75 Favored 'General case' 0 N--CA 1.451 -0.414 0 CA-C-N 115.157 -0.929 . . . . 1.29 111.682 -173.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.464 HG21 HD12 ' A' ' 83' ' ' LEU 0.268 2.0 pp -74.89 -40.66 46.15 Favored 'Isoleucine or valine' 0 C--N 1.34 0.19 0 CA-C-N 119.47 1.032 . . . . 1.5 111.215 166.197 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 7.5 tm-20 -53.2 -56.84 13.27 Favored 'General case' 0 N--CA 1.454 -0.24 0 CA-C-N 119.305 0.957 . . . . 4.0099999999999998 109.093 179.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.1 t -52.2 -42.35 63.44 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.048 0.451 . . . . 1.8 111.668 -173.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 19.8 m -79.3 -29.58 13.69 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 O-C-N 120.942 -1.099 . . . . 1.21 111.804 178.955 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 25.3 t -63.42 -41.65 93.47 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.339 0 CA-C-N 119.041 0.837 . . . . 1.6299999999999999 109.551 172.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . 0.255 9.8 t -67.2 -42.98 83.24 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-O 118.091 -0.957 . . . . 1.8100000000000001 110.482 174.15 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 4.2 m -51.56 -56.63 12.43 Favored 'General case' 0 CA--C 1.537 0.445 0 CA-C-N 120.855 1.661 . . . . 1.25 110.382 171.451 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -40.47 -62.0 0.84 Allowed 'General case' 0 C--O 1.225 -0.217 0 C-N-CA 125.097 1.359 . . . . 4.5099999999999998 110.189 172.742 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -64.81 -48.42 74.45 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.772 0.32 . . . . 2.4300000000000002 111.596 -171.001 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 54.8 p -60.29 -35.54 75.79 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.07 0.548 . . . . 2.3199999999999998 111.754 -178.571 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 16.6 m-85 -69.66 -54.66 12.82 Favored 'General case' 0 N--CA 1.458 -0.07 0 CA-C-O 121.325 0.583 . . . . 2.8599999999999999 110.403 168.925 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.62 -18.48 64.96 Favored 'General case' 0 N--CA 1.445 -0.715 0 C-N-CA 126.199 1.8 . . . . 1.1100000000000001 112.072 -166.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -52.55 -27.25 15.87 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 118.816 -0.611 . . . . 4.0499999999999998 111.804 169.991 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -56.02 -68.9 0.17 Allowed 'General case' 0 CA--C 1.541 0.607 0 N-CA-C 117.677 2.473 . . . . 2.2799999999999998 117.677 -151.154 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -89.18 -76.85 0.4 Allowed 'General case' 0 CA--C 1.532 0.284 0 CA-C-N 119.209 0.913 . . . . 2.7400000000000002 111.922 -161.013 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.16 167.43 29.11 Favored Glycine 0 N--CA 1.446 -0.686 0 C-N-CA 127.722 2.582 . . . . 1.77 110.472 150.415 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . 0.407 ' NH1' ' OE2' ' B' ' 70' ' ' GLU . 36.8 ttm180 53.63 101.13 0.01 OUTLIER 'General case' 0 C--O 1.238 0.458 0 C-N-CA 124.336 1.054 . . . . 3.6000000000000001 113.81 136.975 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 14.7 pttm -60.5 -39.01 86.18 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 113.479 0.918 . . . . 3.8900000000000001 113.479 -175.06 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 8.4 m-20 -77.88 -19.25 55.11 Favored 'General case' 0 CA--C 1.536 0.425 0 N-CA-C 113.343 0.868 . . . . 4.5999999999999996 113.343 -168.755 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 96.8 p -130.32 160.52 33.69 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-N 119.544 1.065 . . . . 1.7 111.639 179.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.507 HD13 ' CD1' ' B' ' 76' ' ' TYR . 5.2 mp -113.22 161.84 16.71 Favored 'General case' 0 N--CA 1.45 -0.426 0 C-N-CA 124.281 1.032 . . . . 2.2000000000000002 111.717 -179.371 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 15.2 m -140.97 170.45 15.72 Favored 'General case' 0 N--CA 1.449 -0.505 0 C-N-CA 127.095 2.158 . . . . 2.46 105.852 -178.519 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 33.0 m -88.91 54.07 0.12 Allowed 'Isoleucine or valine' 0 CA--C 1.536 0.429 0 O-C-N 121.279 -0.888 . . . . 2.8700000000000001 112.024 -170.346 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -152.12 54.29 0.81 Allowed 'General case' 0 CA--C 1.533 0.316 0 N-CA-C 105.934 -1.876 . . . . 2.1299999999999999 105.934 141.818 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.2 mt-10 -160.56 -58.52 0.06 Allowed 'General case' 0 N--CA 1.452 -0.341 0 C-N-CA 127.952 2.501 . . . . 1.73 104.722 -174.764 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 70.1 t80 -56.36 -60.01 4.13 Favored 'General case' 0 N--CA 1.449 -0.482 0 CA-C-N 114.741 -1.118 . . . . 2.1200000000000001 110.309 177.599 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 41.3 tttm -58.66 -35.03 71.92 Favored 'General case' 0 N--CA 1.452 -0.346 0 CA-C-O 121.303 0.573 . . . . 3.75 109.565 -175.675 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . 0.288 16.3 mm-40 -63.01 -18.7 63.6 Favored 'General case' 0 N--CA 1.44 -0.954 0 N-CA-C 112.824 0.676 . . . . 5.2699999999999996 112.824 -174.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 24.7 tp -62.24 -50.78 70.39 Favored 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 108.573 -0.899 . . . . 1.8400000000000001 108.573 169.601 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 16.6 m -70.72 -42.73 77.7 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.236 0 N-CA-C 109.816 -0.438 . . . . 0.90000000000000002 109.816 -174.579 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 24.1 m -51.96 -55.22 21.69 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 122.688 0.395 . . . . 1.01 110.275 173.076 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 15.2 tt0 -82.33 -58.72 2.81 Favored 'General case' 0 CA--C 1.54 0.571 0 N-CA-C 113.835 1.05 . . . . 2.3700000000000001 113.835 -168.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 5.1 mm-40 -79.57 -48.53 13.66 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 114.51 1.3 . . . . 3.8900000000000001 114.51 -164.332 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . 0.434 HD11 HD11 ' B' ' 83' ' ' LEU . 1.5 mm? -52.43 -38.78 59.93 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 115.69 1.737 . . . . 2.1400000000000001 115.69 -148.725 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 97.3 Cg_endo -63.94 -39.3 33.43 Favored 'Trans proline' 0 N--CA 1.451 -1.023 0 C-N-CA 122.569 -1.846 . . . . 2.3100000000000001 109.619 -58.888 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 34.0 t60 -89.09 -30.6 18.54 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.139 1.375 . . . . 3.5600000000000001 112.365 -168.057 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 19.3 tp -47.57 -63.28 1.1 Allowed 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.491 1.516 . . . . 1.1699999999999999 111.405 -175.761 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.414 HD23 ' HA ' ' B' ' 50' ' ' LEU . 33.0 mt -93.09 72.42 4.65 Favored 'General case' 0 N--CA 1.455 -0.191 0 N-CA-C 108.372 -0.973 . . . . 1.6599999999999999 108.372 163.13 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -41.9 147.29 0.22 Allowed 'General case' 0 C--O 1.233 0.222 0 C-N-CA 124.81 1.244 . . . . 5.5300000000000002 110.305 174.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 32.0 t0 61.9 41.08 11.86 Favored 'General case' 0 C--N 1.343 0.286 0 N-CA-C 106.856 -1.535 . . . . 4.1699999999999999 106.856 173.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 5.9 m 32.25 50.54 0.16 Allowed 'Isoleucine or valine' 0 N--CA 1.448 -0.568 0 C-N-CA 127.748 2.419 . . . . 3.79 112.924 -172.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 65.07 19.16 65.61 Favored Glycine 0 CA--C 1.525 0.698 0 CA-C-O 118.718 -1.046 . . . . 7.3700000000000001 114.174 174.094 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 5.6 p 42.22 61.24 2.04 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 118.288 1.044 . . . . 5.0300000000000002 108.658 -168.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -45.51 -46.75 14.08 Favored 'General case' 0 N--CA 1.443 -0.825 0 C-N-CA 126.416 1.886 . . . . 2.04 112.648 -148.72 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 -40.37 -47.72 2.59 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.598 1.959 . . . . 3.25 112.812 174.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 28.1 tt0 -54.22 -60.47 3.29 Favored 'General case' 0 C--N 1.341 0.226 0 N-CA-C 109.332 -0.618 . . . . 4.6299999999999999 109.332 176.39 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -60.55 -44.69 95.84 Favored 'General case' 0 N--CA 1.445 -0.701 0 CA-C-O 118.458 -0.782 . . . . 5.1799999999999997 109.242 -175.836 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 9.2 mtp -47.54 -60.89 2.22 Favored 'General case' 0 N--CA 1.464 0.249 0 CA-C-N 119.586 1.085 . . . . 3.79 110.508 175.602 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -63.31 -36.8 84.89 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-N 116.382 -0.372 . . . . 3.9100000000000001 110.546 -175.392 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 14.7 t -62.92 -41.28 99.4 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 123.015 0.526 . . . . 2.6899999999999999 111.204 175.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 29.9 mt -77.19 -51.25 11.29 Favored 'General case' 0 CA--C 1.527 0.079 0 C-N-CA 125.317 1.447 . . . . 1.21 110.394 -172.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -53.39 -14.9 0.85 Allowed 'General case' 0 CA--C 1.541 0.633 0 N-CA-C 116.615 2.08 . . . . 2.1800000000000002 116.615 -165.834 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 17.8 m -36.43 -32.35 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.467 0.379 0 C-N-CA 129.71 3.204 . . . . 1.9299999999999999 117.468 -139.983 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 3.6 p-10 -65.55 -12.61 54.49 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 119.352 0.978 . . . . 2.8199999999999998 112.393 175.849 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 61.51 41.99 11.89 Favored 'General case' 0 N--CA 1.464 0.267 0 C-N-CA 124.363 1.065 . . . . 3.1800000000000002 113.012 167.336 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 48.9 p30 -91.92 -7.93 47.76 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.456 1.502 . . . . 2.1800000000000002 111.48 163.103 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.0 m 65.31 10.14 6.24 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.985 1.314 . . . . 2.6400000000000001 113.78 -172.072 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . 0.407 ' OE2' ' NH1' ' B' ' 29' ' ' ARG . 35.5 mt-10 -99.44 154.12 18.46 Favored 'General case' 0 C--O 1.234 0.286 0 N-CA-C 108.447 -0.945 . . . . 2.8999999999999999 108.447 167.001 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -111.81 93.51 4.5 Favored 'General case' 0 N--CA 1.45 -0.437 0 N-CA-C 106.215 -1.772 . . . . 1.1100000000000001 106.215 168.971 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -83.69 178.98 7.72 Favored 'General case' 0 N--CA 1.464 0.249 0 C-N-CA 123.412 0.685 . . . . 3.8399999999999999 110.705 179.581 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 40.6 p90 -91.61 52.28 2.02 Favored 'General case' 0 CA--C 1.539 0.546 0 N-CA-C 112.885 0.698 . . . . 4.4800000000000004 112.885 -171.681 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -155.52 49.84 0.55 Allowed 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 107.002 -1.481 . . . . 2.79 107.002 114.01 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -90.99 -60.88 1.8 Allowed 'General case' 0 N--CA 1.441 -0.879 0 N-CA-C 106.066 -1.828 . . . . 1.8999999999999999 106.066 140.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.507 ' CD1' HD13 ' B' ' 33' ' ' LEU . 65.3 t80 -52.8 -49.74 65.01 Favored 'General case' 0 C--N 1.339 0.144 0 C-N-CA 124.103 0.961 . . . . 4.0199999999999996 113.259 -168.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.521 ' CD2' ' HA2' ' A' ' 81' ' ' GLY . 0.3 OUTLIER -43.9 -34.32 1.61 Allowed 'General case' 0 C--N 1.341 0.233 0 O-C-N 123.786 0.679 . . . . 5.3300000000000001 111.206 177.34 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . 0.425 ' HA ' ' CH2' ' A' ' 77' ' ' TRP . 45.3 mtp180 -51.84 -52.95 45.69 Favored 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 120.098 -0.641 . . . . 4.9699999999999998 110.933 -175.835 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.632 ' O ' HD13 ' B' ' 83' ' ' LEU . 3.2 tp -57.56 -28.04 63.2 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 118.251 -1.38 . . . . 1.3799999999999999 110.811 -179.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 45.1 mt -71.84 -47.89 53.82 Favored 'Isoleucine or valine' 0 CA--C 1.516 -0.346 0 N-CA-C 107.041 -1.466 . . . . 2.3399999999999999 107.041 -168.274 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.489 ' HA3' ' HE1' ' A' ' 77' ' ' TRP . . . -80.95 -27.99 47.74 Favored Glycine 0 N--CA 1.42 -2.37 0 CA-C-O 117.863 -1.521 . . . . 2.71 111.227 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 49.5 mt-10 -57.28 -47.45 81.42 Favored 'General case' 0 CA--C 1.505 -0.769 0 N-CA-C 105.264 -2.124 . . . . 3.3900000000000001 105.264 -173.092 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.632 HD13 ' O ' ' B' ' 79' ' ' LEU . 7.8 mp -38.54 -47.94 1.36 Allowed 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 124.904 1.282 . . . . 2.6099999999999999 113.173 174.283 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.74 -29.8 70.96 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.87 0.868 . . . . 1.3500000000000001 111.573 -178.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -80.28 -45.9 17.11 Favored 'General case' 0 N--CA 1.449 -0.491 0 C-N-CA 123.876 0.87 . . . . 1.47 111.24 167.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -57.39 -50.39 73.15 Favored 'General case' 0 CA--C 1.533 0.301 0 CA-C-N 119.831 1.196 . . . . 3.5699999999999998 108.193 -171.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 14.3 tt -50.49 -39.22 17.16 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 C-N-CA 123.454 0.701 . . . . 1.45 111.651 174.506 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.66 -19.11 42.37 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.537 1.535 . . . . 3.71 112.598 -176.27 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 42.3 tttp -137.14 92.02 2.68 Favored 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 123.984 0.914 . . . . 5.3799999999999999 111.888 -161.626 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 5.2 tmtp? -39.62 -59.45 1.13 Allowed 'General case' 0 CA--C 1.539 0.557 0 C-N-CA 126.589 1.956 . . . . 4.5199999999999996 115.38 -169.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 2.4 pptp? -148.91 16.47 0.97 Allowed 'General case' 0 N--CA 1.47 0.557 0 N-CA-C 113.556 0.947 . . . . 8.3900000000000006 113.556 -165.809 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 29.3 m-20 -125.36 118.22 25.43 Favored 'General case' 0 N--CA 1.455 -0.183 0 N-CA-C 108.654 -0.869 . . . . 4.6699999999999999 108.654 -165.737 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 1.3 pp 176.41 -40.85 0.01 OUTLIER 'General case' 0 CA--C 1.529 0.153 0 C-N-CA 126.041 1.736 . . . . 5.2199999999999998 109.321 -173.299 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 10.5 pttm -71.04 68.19 0.44 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.883 1.273 . . . . 7.1900000000000004 112.043 -178.496 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 4.9 tp -128.47 116.2 40.78 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.169 0 C-N-CA 124.666 1.186 . . . . 7.2199999999999998 108.258 172.729 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 30.2 tpt180 -161.29 148.43 14.9 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 107.875 -1.157 . . . . 12.16 107.875 177.559 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 5.0 tmtp? -177.97 138.38 0.2 Allowed 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 126.08 1.752 . . . . 9.7699999999999996 106.428 177.375 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 46.9 tptt . . . . . 0 C--O 1.257 1.461 0 N-CA-C 103.756 -2.683 . . . . 6.0 103.756 168.185 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 27.7 mmm . . . . . 0 N--CA 1.469 0.52 0 N-CA-C 108.324 -0.991 . . . . 7.8099999999999996 108.324 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . 177.87 172.68 0.61 Allowed 'General case' 0 C--O 1.231 0.118 0 C-N-CA 126.527 1.931 . . . . 2.9500000000000002 106.665 -173.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 70.99 95.23 0.07 Allowed 'General case' 0 N--CA 1.454 -0.244 0 C-N-CA 126.349 1.86 . . . . 3.1000000000000001 111.863 178.23 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.5 tp10 -71.49 121.57 84.73 Favored Pre-proline 0 N--CA 1.442 -0.854 0 N-CA-C 108.61 -0.885 . . . . 5.9500000000000002 108.61 179.656 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 93.8 Cg_endo -70.14 141.15 42.97 Favored 'Trans proline' 0 N--CA 1.453 -0.854 0 C-N-CA 121.951 1.767 . . . . 2.3300000000000001 108.133 173.568 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 86.7 mt -99.1 163.73 12.45 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 108.325 -0.991 . . . . 1.3300000000000001 108.325 -175.062 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 14.3 t -73.8 153.01 40.14 Favored 'General case' 0 N--CA 1.47 0.546 0 O-C-N 120.739 -1.225 . . . . 1.96 109.898 -175.631 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 19.0 mt-10 -45.07 -51.63 9.91 Favored 'General case' 0 N--CA 1.464 0.243 0 O-C-N 121.232 -0.918 . . . . 2.46 112.855 -174.279 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -58.9 -52.08 67.28 Favored 'General case' 0 CA--C 1.536 0.432 0 CA-C-O 118.311 -0.852 . . . . 1.54 111.255 178.391 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -48.87 -55.05 12.82 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 127.083 2.153 . . . . 2.5600000000000001 111.767 173.554 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 47.2 mm-40 -52.52 -52.31 55.29 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.164 0.985 . . . . 3.0600000000000001 109.932 174.987 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 14.9 t -57.74 -50.6 72.68 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 123.385 0.674 . . . . 2.3900000000000001 111.08 -178.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.279 2.8 pp -62.61 -37.68 79.57 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.396 0 O-C-N 121.247 -0.908 . . . . 0.66000000000000003 110.431 179.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 4.7 tm-20 -57.26 -59.4 5.16 Favored 'General case' 0 N--CA 1.453 -0.295 0 CA-C-N 119.344 0.974 . . . . 2.7200000000000002 109.965 174.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 6.6 t -53.92 -40.78 67.02 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 118.986 0.812 . . . . 1.8100000000000001 111.552 -172.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.1 m -76.34 -30.66 19.98 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.398 0 O-C-N 120.525 -1.359 . . . . 0.78000000000000003 112.108 178.042 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.3 t -64.37 -44.69 97.2 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.222 0 CA-C-N 119.679 1.127 . . . . 0.59999999999999998 110.065 173.224 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.4 t -65.42 -42.25 92.7 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.46 -0.775 . . . . 0.90000000000000002 110.242 175.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 50.5 m -55.5 -50.62 69.46 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.906 0.775 . . . . 0.96999999999999997 110.147 173.678 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 11.4 t80 -48.25 -60.04 2.96 Favored 'General case' 0 C--O 1.226 -0.153 0 C-N-CA 123.405 0.682 . . . . 3.2599999999999998 110.089 172.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 59.0 t80 -52.93 -51.56 60.91 Favored 'General case' 0 C--O 1.234 0.285 0 C-N-CA 124.226 1.01 . . . . 3.4300000000000002 111.571 -173.759 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 7.1 t -63.78 -25.15 68.05 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-O 118.493 -0.765 . . . . 2.2000000000000002 112.17 -176.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -81.54 -42.84 19.59 Favored 'General case' 0 C--O 1.221 -0.428 0 CA-C-N 118.951 0.796 . . . . 2.6299999999999999 111.456 169.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -52.43 -40.25 61.98 Favored 'General case' 0 C--O 1.238 0.498 0 O-C-N 120.872 -1.142 . . . . 1.1000000000000001 110.671 -179.09 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -73.4 -19.21 61.04 Favored 'General case' 0 N--CA 1.449 -0.507 0 CA-C-O 116.065 -1.921 . . . . 4.9800000000000004 113.342 -178.804 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -45.0 -61.81 1.48 Allowed 'General case' 0 C--N 1.345 0.395 0 CA-C-N 120.758 1.617 . . . . 2.5499999999999998 110.133 -168.505 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -128.77 96.74 4.46 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 126.348 1.859 . . . . 5.5800000000000001 107.613 -177.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 66.38 149.83 0.11 Allowed Glycine 0 CA--C 1.531 1.077 0 C-N-CA 125.425 1.488 . . . . 1.3500000000000001 114.334 167.325 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 51.92 82.43 0.07 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 124.134 0.974 . . . . 5.8899999999999997 110.806 175.203 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.7 pttm -71.27 31.31 0.05 OUTLIER 'General case' 0 CA--C 1.539 0.522 0 N-CA-C 114.731 1.382 . . . . 3.6200000000000001 114.731 -175.368 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.5 t0 -139.57 22.06 2.52 Favored 'General case' 0 CA--C 1.54 0.592 0 C-N-CA 125.604 1.562 . . . . 4.5099999999999998 108.657 167.828 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 2.8 m -154.82 140.48 17.99 Favored 'General case' 0 CA--C 1.544 0.732 0 O-C-N 120.925 -1.109 . . . . 2.71 113.165 -179.017 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 7.1 mp -103.94 117.36 34.13 Favored 'General case' 0 CA--C 1.54 0.595 0 C-N-CA 125.14 1.376 . . . . 2.5800000000000001 112.705 176.043 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.2 t -83.69 177.04 8.55 Favored 'General case' 0 C--O 1.227 -0.131 0 O-C-N 120.84 -1.162 . . . . 2.7200000000000002 109.784 171.432 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 5.5 m -55.43 -50.18 67.66 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.415 0 N-CA-C 112.903 0.705 . . . . 2.7799999999999998 112.903 -163.695 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.8 t-20 -62.37 -57.4 11.45 Favored 'General case' 0 C--O 1.222 -0.346 0 CA-C-N 118.604 0.638 . . . . 2.5299999999999998 109.781 179.514 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.1 mt-10 -38.1 -50.87 1.4 Allowed 'General case' 0 N--CA 1.465 0.29 0 C-N-CA 125.306 1.442 . . . . 2.1499999999999999 110.787 173.864 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.405 ' CD2' ' HG ' ' A' ' 71' ' ' LEU . 0.8 OUTLIER -58.64 -53.6 56.5 Favored 'General case' 0 N--CA 1.438 -1.029 0 CA-C-N 114.728 -1.124 . . . . 3.7200000000000002 110.226 177.892 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 63.1 tttm -60.71 -37.21 80.91 Favored 'General case' 0 N--CA 1.444 -0.761 0 C-N-CA 120.618 -0.433 . . . . 3.2400000000000002 110.06 -174.2 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -53.81 -37.45 63.56 Favored 'General case' 0 N--CA 1.445 -0.68 0 CA-C-O 119.076 -0.488 . . . . 3.6299999999999999 110.937 176.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 38.8 tp -68.63 -45.72 71.11 Favored 'General case' 0 C--N 1.339 0.115 0 CA-C-N 119.881 1.219 . . . . 2.3799999999999999 109.27 -177.948 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 10.2 m -69.42 -38.46 77.18 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.178 0 CA-C-O 121.457 0.646 . . . . 1.22 109.359 -173.668 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 74.8 m -69.42 -43.39 73.48 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 124.276 1.031 . . . . 1.3500000000000001 110.224 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.5 tt0 -80.14 -60.47 2.32 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 123.095 0.558 . . . . 2.0699999999999998 111.783 -173.46 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.507 ' O ' HG21 ' B' ' 7' ' ' THR . 3.1 mm-40 -79.45 -37.75 36.24 Favored 'General case' 0 N--CA 1.465 0.32 0 CA-C-O 118.407 -0.806 . . . . 3.9100000000000001 113.011 -167.539 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -102.84 83.51 0.55 Allowed Pre-proline 0 N--CA 1.469 0.478 0 C-N-CA 125.127 1.371 . . . . 2.29 111.732 -165.119 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -64.81 -32.14 56.46 Favored 'Trans proline' 0 N--CA 1.449 -1.115 0 C-N-CA 122.659 2.239 . . . . 1.6200000000000001 111.898 178.329 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -149.37 -3.36 0.42 Allowed 'General case' 0 C--N 1.347 0.487 0 N-CA-C 118.332 2.716 . . . . 4.9900000000000002 118.332 -174.332 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.653 HD23 ' HB2' ' A' ' 83' ' ' LEU . 10.5 tp -58.89 -64.44 0.94 Allowed 'General case' 0 C--N 1.334 -0.085 0 CA-C-N 120.536 1.516 . . . . 1.21 110.487 174.431 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 45.6 mt -78.67 -42.12 29.45 Favored 'General case' 0 N--CA 1.455 -0.225 0 CA-C-N 115.952 -0.567 . . . . 3.1000000000000001 110.97 -175.613 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 28.5 40.66 0.0 OUTLIER 'General case' 0 C--N 1.343 0.305 0 C-N-CA 129.281 3.032 . . . . 4.4100000000000001 114.603 -170.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.2 t0 -136.06 24.76 3.3 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 127.405 2.282 . . . . 5.0499999999999998 109.236 -176.621 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 20.1 m -58.02 -28.94 35.18 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 124.405 1.082 . . . . 2.0699999999999998 110.82 -178.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.16 -41.97 16.15 Favored Glycine 0 CA--C 1.528 0.885 0 C-N-CA 124.047 0.832 . . . . 1.98 111.877 172.61 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 87.3 p -104.43 34.23 3.19 Favored 'General case' 0 C--N 1.342 0.259 0 CA-C-N 117.979 0.889 . . . . 3.3300000000000001 111.166 -177.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -54.47 -35.02 62.59 Favored 'General case' 0 N--CA 1.446 -0.642 0 O-C-N 121.001 -1.062 . . . . 1.3 110.567 179.762 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.9 p-10 -56.07 -40.35 73.44 Favored 'General case' 0 CA--C 1.537 0.48 0 O-C-N 121.395 -0.816 . . . . 4.1600000000000001 111.954 173.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 38.0 tt0 -69.2 -49.83 52.93 Favored 'General case' 0 N--CA 1.455 -0.204 0 N-CA-C 108.019 -1.104 . . . . 3.2400000000000002 108.019 178.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.92 -42.78 65.7 Favored 'General case' 0 CA--C 1.539 0.52 0 N-CA-C 109.328 -0.619 . . . . 2.6600000000000001 109.328 177.111 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 12.5 tmm? -61.7 -52.53 63.9 Favored 'General case' 0 C--O 1.232 0.174 0 C-N-CA 124.686 1.194 . . . . 2.0 110.093 178.374 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 33.8 mtmm -53.97 -38.93 65.52 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 118.744 -0.646 . . . . 2.9900000000000002 111.906 176.707 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.1 t -60.79 -61.54 2.51 Favored 'General case' 0 C--N 1.341 0.221 0 CA-C-N 118.908 0.776 . . . . 2.6099999999999999 109.198 168.75 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 28.5 mt -53.27 -61.31 2.38 Favored 'General case' 0 C--O 1.238 0.454 0 C-N-CA 125.29 1.436 . . . . 1.3999999999999999 112.36 -166.769 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 47.2 t0 -72.13 88.77 1.12 Allowed 'General case' 0 N--CA 1.45 -0.445 0 N-CA-C 109.028 -0.73 . . . . 2.0899999999999999 109.028 -171.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.9 m -49.07 -28.07 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.576 0 C-N-CA 124.299 1.04 . . . . 2.3399999999999999 113.71 -175.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 3.7 p30 -104.56 -11.66 16.86 Favored 'General case' 0 N--CA 1.467 0.4 0 C-N-CA 125.031 1.332 . . . . 2.5800000000000001 112.845 178.407 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 73.1 mt-30 52.69 50.4 18.22 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 124.473 1.109 . . . . 4.1399999999999997 111.361 177.848 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 29.0 p30 -82.33 -20.62 37.0 Favored 'General case' 0 CA--C 1.537 0.47 0 N-CA-C 109.077 -0.712 . . . . 1.6499999999999999 109.077 166.739 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER 78.95 26.57 0.45 Allowed 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.244 1.418 . . . . 2.0899999999999999 111.449 176.671 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -135.13 120.73 19.37 Favored 'General case' 0 C--O 1.237 0.423 0 N-CA-C 104.313 -2.477 . . . . 5.3899999999999997 104.313 162.023 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.405 ' HG ' ' CD2' ' A' ' 38' ' ' PHE . 0.8 OUTLIER -93.31 90.99 7.01 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 107.057 -1.46 . . . . 1.1899999999999999 107.057 -168.037 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 4.0 pttt -76.22 169.59 17.93 Favored 'General case' 0 CA--C 1.528 0.113 0 O-C-N 123.147 0.279 . . . . 4.0999999999999996 110.726 -178.024 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 19.2 p90 -36.66 -61.63 0.52 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 114.441 1.275 . . . . 6.2599999999999998 114.441 -163.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -76.98 -26.56 54.05 Favored 'General case' 0 CA--C 1.541 0.629 0 CA-C-N 119.539 1.063 . . . . 2.23 111.212 -175.148 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 89.4 mt-10 -64.98 -56.75 11.36 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 108.374 -0.973 . . . . 2.0800000000000001 108.374 174.835 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.4 t80 -48.9 -54.93 13.34 Favored 'General case' 0 N--CA 1.455 -0.208 0 C-N-CA 124.871 1.268 . . . . 3.1499999999999999 109.775 173.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 59.2 t90 -46.85 -41.89 16.44 Favored 'General case' 0 N--CA 1.45 -0.45 0 C-N-CA 123.955 0.902 . . . . 4.2300000000000004 111.956 -168.799 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 23.6 ttp85 -45.06 -40.67 6.91 Favored 'General case' 0 C--N 1.343 0.311 0 CA-C-O 118.305 -0.855 . . . . 3.6800000000000002 111.357 179.016 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 6.6 tp -45.09 -50.35 11.1 Favored 'General case' 0 N--CA 1.446 -0.659 0 CA-C-O 118.154 -0.927 . . . . 0.94999999999999996 111.87 177.052 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 92.1 mt -58.81 -32.03 46.06 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.394 0 N-CA-C 108.316 -0.994 . . . . 1.6399999999999999 108.316 -176.727 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.616 ' HA3' ' CE2' ' B' ' 77' ' ' TRP . . . -70.0 -50.14 30.63 Favored Glycine 0 N--CA 1.444 -0.771 0 C-N-CA 127.072 2.273 . . . . 1.24 112.103 177.415 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.444 ' O ' ' HG2' ' A' ' 86' ' ' GLU . 3.0 mt-10 -58.2 -62.9 1.49 Allowed 'General case' 0 N--CA 1.441 -0.905 0 N-CA-C 106.775 -1.565 . . . . 2.8999999999999999 106.775 177.129 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.653 ' HB2' HD23 ' A' ' 49' ' ' LEU 0.262 4.3 pp -53.34 -37.42 62.31 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 119.301 0.955 . . . . 2.1099999999999999 112.305 177.23 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.52 -62.11 1.9 Allowed 'General case' 0 C--N 1.342 0.245 0 CA-C-N 119.179 0.9 . . . . 2.1899999999999999 111.073 173.855 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . 0.275 0.0 OUTLIER -70.2 -20.09 63.13 Favored 'General case' 0 CA--C 1.534 0.33 0 C-N-CA 119.095 -1.042 . . . . 1.98 112.042 -174.75 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 82' ' ' GLU . 5.3 mm-40 -56.31 -31.35 63.6 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 118.144 -0.931 . . . . 2.6200000000000001 110.676 173.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.5 tt -58.81 -12.49 2.64 Favored 'Isoleucine or valine' 0 C--N 1.348 0.501 0 N-CA-C 113.417 0.895 . . . . 1.5600000000000001 113.417 173.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 5.5 ptm85 -118.75 -38.43 3.11 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 118.918 0.781 . . . . 4.2199999999999998 112.079 172.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -84.25 -47.5 10.73 Favored 'General case' 0 CA--C 1.536 0.408 0 N-CA-C 116.565 2.061 . . . . 3.3100000000000001 116.565 -177.028 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 24.3 tttm -65.33 -58.23 6.42 Favored 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 120.263 1.392 . . . . 10.43 111.367 -149.611 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 2.2 ttpm? -152.2 4.02 0.38 Allowed 'General case' 0 C--O 1.234 0.27 0 C-N-CA 124.215 1.006 . . . . 8.5999999999999996 110.524 167.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 31.6 t70 -7.47 -107.09 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 125.68 1.592 . . . . 10.08 113.322 -139.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 12.5 tp -76.68 -65.02 0.99 Allowed 'General case' 0 N--CA 1.44 -0.973 0 C-N-CA 125.95 1.7 . . . . 15.380000000000001 106.783 176.531 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 72.9 mttt -132.38 111.38 11.27 Favored 'General case' 0 N--CA 1.453 -0.276 0 C-N-CA 124.975 1.31 . . . . 15.81 108.419 -177.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 0.332 42.5 pt 59.08 -63.96 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.494 0 C-N-CA 128.207 2.603 . . . . 9.0999999999999996 115.965 175.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 18.8 ttm180 170.26 96.11 0.0 OUTLIER 'General case' 0 N--CA 1.464 0.257 0 N-CA-C 105.377 -2.083 . . . . 14.77 105.377 -164.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 21.8 tttp -174.43 58.5 0.02 OUTLIER 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 120.165 1.348 . . . . 10.84 114.301 -155.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . 2.426 0.2 OUTLIER . . . . . 0 C--O 1.253 1.25 0 CA-C-O 116.138 -1.887 . . . . 12.720000000000001 108.932 165.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.427 1.4 pmm? . . . . . 0 N--CA 1.466 0.339 0 N-CA-C 107.898 -1.149 . . . . 8.1300000000000008 107.898 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -167.23 117.16 0.85 Allowed 'General case' 0 N--CA 1.455 -0.181 0 CA-C-O 118.428 -0.796 . . . . 5.9900000000000002 109.836 173.131 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 23.14 99.11 0.0 OUTLIER 'General case' 0 CA--C 1.543 0.692 0 N-CA-C 114.602 1.334 . . . . 4.7599999999999998 114.602 118.35 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 95.1 mt-10 -75.08 162.04 74.91 Favored Pre-proline 0 CA--C 1.548 0.876 0 CA-C-N 119.098 0.863 . . . . 5.5999999999999996 109.831 171.027 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 86.0 Cg_endo -78.56 155.51 27.91 Favored 'Trans proline' 0 CA--C 1.539 0.732 0 C-N-CA 123.819 3.013 . . . . 3.2000000000000002 111.239 177.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 66.1 mt -155.77 -163.05 1.42 Allowed 'General case' 0 CA--C 1.555 1.141 0 N-CA-C 112.675 0.62 . . . . 3.5299999999999998 112.675 -151.651 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.688 HG22 ' CG ' ' B' ' 10' ' ' GLU . 2.2 t -66.51 178.04 1.37 Allowed 'General case' 0 N--CA 1.471 0.617 0 C-N-CA 125.451 1.501 . . . . 2.0499999999999998 111.224 178.226 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -59.26 -61.54 2.55 Favored 'General case' 0 CA--C 1.537 0.445 0 O-C-N 121.436 -0.79 . . . . 2.6899999999999999 112.387 -175.174 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 14.4 mt -53.63 -43.61 68.84 Favored 'General case' 0 CA--C 1.538 0.512 0 O-C-N 121.162 -0.961 . . . . 1.28 111.68 175.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.688 ' CG ' HG22 ' B' ' 7' ' ' THR . 69.5 mt-10 -53.73 -48.19 69.87 Favored 'General case' 0 CA--C 1.554 1.121 0 C-N-CA 124.761 1.225 . . . . 3.54 111.785 175.45 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 29.3 mm-40 -59.15 -46.99 86.93 Favored 'General case' 0 CA--C 1.534 0.363 0 O-C-N 120.609 -1.307 . . . . 4.5199999999999996 109.772 173.669 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 16.1 m -57.44 -43.78 84.17 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 123.479 0.712 . . . . 1.6699999999999999 110.977 -175.433 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.256 2.3 pp -67.05 -41.32 87.06 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.149 0 CA-C-O 118.479 -0.772 . . . . 1.05 111.385 172.042 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -53.49 -56.75 14.37 Favored 'General case' 0 CA--C 1.534 0.335 0 CA-C-N 119.258 0.935 . . . . 2.3999999999999999 110.661 178.383 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.9 t -49.33 -45.8 45.97 Favored 'General case' 0 CA--C 1.543 0.707 0 CA-C-N 118.996 0.816 . . . . 1.3 111.968 -174.373 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 20.3 m -72.62 -38.18 58.24 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.382 0 O-C-N 120.808 -1.182 . . . . 0.92000000000000004 111.395 179.434 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 43.8 t -58.04 -41.28 80.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.358 0 O-C-N 121.823 -0.548 . . . . 1.0600000000000001 110.218 174.179 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . 0.257 11.9 t -70.64 -41.23 72.43 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-O 118.205 -0.902 . . . . 1.1899999999999999 111.257 176.456 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 4.0 m -51.21 -52.43 44.58 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-N 120.649 1.568 . . . . 1.0900000000000001 109.991 171.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . 0.461 ' CZ ' HD23 ' B' ' 33' ' ' LEU . 25.2 t80 -51.9 -61.07 2.49 Favored 'General case' 0 CA--C 1.531 0.214 0 C-N-CA 123.362 0.665 . . . . 4.2300000000000004 110.09 174.818 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 36.8 t80 -61.74 -40.92 96.79 Favored 'General case' 0 C--N 1.334 -0.107 0 C-N-CA 123.463 0.705 . . . . 3.3100000000000001 111.517 -168.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 41.1 p -60.96 -60.09 4.35 Favored 'General case' 0 N--CA 1.451 -0.419 0 N-CA-C 109.474 -0.565 . . . . 2.25 109.474 173.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 3.0 m-85 -57.99 -35.12 70.76 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 118.417 0.553 . . . . 3.6600000000000001 111.346 -174.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -54.04 -29.31 43.38 Favored 'General case' 0 CA--C 1.513 -0.448 0 C-N-CA 127.182 2.193 . . . . 1.0600000000000001 110.929 -176.663 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 11.2 ptm180 -47.06 -34.31 5.71 Favored 'General case' 0 N--CA 1.448 -0.562 0 O-C-N 124.241 0.963 . . . . 4.5300000000000002 111.873 175.527 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -58.84 -66.55 0.48 Allowed 'General case' 0 CA--C 1.536 0.441 0 N-CA-C 115.963 1.838 . . . . 1.71 115.963 -146.845 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 71.3 mt-10 -91.2 -75.89 0.46 Allowed 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 119.24 -0.984 . . . . 3.0299999999999998 113.089 -167.637 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.44 156.19 23.18 Favored Glycine 0 C--N 1.338 0.667 0 C-N-CA 127.394 2.426 . . . . 2.3900000000000001 109.666 160.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER 47.4 102.37 0.0 OUTLIER 'General case' 0 C--O 1.242 0.684 0 N-CA-C 114.775 1.398 . . . . 4.6100000000000003 114.775 144.316 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -71.5 47.28 0.12 Allowed 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 125.13 1.372 . . . . 4.1699999999999999 112.867 176.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 33.0 t70 -157.24 -51.69 0.07 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 123.674 0.79 . . . . 3.1699999999999999 109.448 -173.409 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 33.9 p -85.36 146.39 27.03 Favored 'General case' 0 C--O 1.243 0.734 0 C-N-CA 123.126 0.57 . . . . 1.6299999999999999 110.366 172.461 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.461 HD23 ' CZ ' ' B' ' 20' ' ' PHE . 0.7 OUTLIER -92.5 178.41 5.82 Favored 'General case' 0 C--O 1.232 0.141 0 N-CA-C 108.2 -1.037 . . . . 2.0800000000000001 108.2 164.013 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . 0.41 ' C ' ' O ' ' B' ' 35' ' ' VAL . 28.0 m -154.23 -175.98 5.65 Favored 'General case' 0 N--CA 1.45 -0.467 0 CA-C-O 122.077 0.941 . . . . 2.8999999999999999 110.46 -143.553 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.41 ' O ' ' C ' ' B' ' 34' ' ' SER . 21.7 t -73.18 -166.15 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 N-CA-C 100.781 -3.785 . . . . 3.3700000000000001 100.781 141.275 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -82.47 51.85 1.93 Allowed 'General case' 0 CA--C 1.552 1.057 0 O-C-N 116.709 -3.744 . . . . 3.71 113.114 -111.038 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 29.5 mt-10 -61.58 -59.41 5.25 Favored 'General case' 0 CA--C 1.516 -0.359 0 C-N-CA 126.796 2.038 . . . . 1.6299999999999999 108.887 125.479 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.472 ' CE2' HD13 ' B' ' 63' ' ' LEU . 0.4 OUTLIER -54.96 -44.42 74.35 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 119.727 -0.789 . . . . 2.2200000000000002 111.786 -163.252 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -56.87 -35.36 68.83 Favored 'General case' 0 CA--C 1.539 0.552 0 O-C-N 121.477 -0.764 . . . . 2.8999999999999999 111.806 176.965 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 92.9 mt-10 -56.39 -31.98 64.37 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.474 0.579 . . . . 3.1000000000000001 111.726 177.002 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -64.43 -55.11 23.07 Favored 'General case' 0 C--O 1.235 0.341 0 CA-C-N 119.294 0.952 . . . . 2.6600000000000001 108.648 179.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 13.8 m -69.05 -38.47 78.36 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.344 0 CA-C-N 114.486 -1.233 . . . . 0.93999999999999995 109.256 -170.208 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 85.5 m -63.63 -57.67 9.33 Favored 'General case' 0 N--CA 1.449 -0.52 0 C-N-CA 124.328 1.051 . . . . 1.23 110.958 174.09 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 8.2 tt0 -76.01 -60.79 2.17 Favored 'General case' 0 N--CA 1.455 -0.222 0 O-C-N 122.136 -0.353 . . . . 2.46 111.025 -165.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.81 -47.37 12.93 Favored 'General case' 0 N--CA 1.456 -0.157 0 O-C-N 122.314 -0.241 . . . . 3.0600000000000001 111.096 -171.596 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 2.1 tp -84.3 -16.44 0.23 Allowed Pre-proline 0 CA--C 1.544 0.738 0 N-CA-C 120.893 3.664 . . . . 2.0699999999999998 120.893 -151.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 14.2 Cg_endo -44.4 -50.97 7.45 Favored 'Trans proline' 0 CA--C 1.535 0.53 0 C-N-CA 123.51 2.806 . . . . 1.8700000000000001 116.053 -143.576 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 42.6 t-80 -76.91 48.95 0.62 Allowed 'General case' 0 CA--C 1.541 0.625 0 CA-C-N 118.777 0.717 . . . . 3.4100000000000001 112.215 -176.39 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.408 HD12 ' HA ' ' B' ' 49' ' ' LEU . 13.2 tp -150.99 -61.62 0.18 Allowed 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 124.257 1.023 . . . . 0.95999999999999996 109.738 179.02 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 96.7 mt -109.59 112.37 24.42 Favored 'General case' 0 CA--C 1.521 -0.147 0 N-CA-C 108.378 -0.971 . . . . 1.6899999999999999 108.378 169.334 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.3 -165.06 0.71 Allowed 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 108.779 -0.823 . . . . 5.0300000000000002 108.779 170.709 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 66.1 m-20 64.64 24.84 13.03 Favored 'General case' 0 N--CA 1.466 0.351 0 C-N-CA 124.849 1.26 . . . . 3.9700000000000002 110.626 169.892 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 33.0 m -61.62 -18.94 19.91 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 125.009 1.324 . . . . 1.76 113.03 -168.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.15 -52.85 49.35 Favored Glycine 0 CA--C 1.53 1.016 0 N-CA-C 110.305 -1.118 . . . . 2.77 110.305 168.096 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 22.6 t -81.29 34.66 0.37 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.797 1.239 . . . . 2.3900000000000001 111.534 -171.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -60.03 -25.19 65.12 Favored 'General case' 0 N--CA 1.448 -0.559 0 C-N-CA 125.201 1.4 . . . . 1.22 110.246 -174.319 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 9.1 p-10 -52.29 -33.01 40.25 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.113 1.365 . . . . 3.3700000000000001 113.215 173.04 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 2.2 pt-20 -58.25 -44.67 88.44 Favored 'General case' 0 C--N 1.346 0.425 0 CA-C-N 120.044 1.293 . . . . 2.5800000000000001 109.049 175.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -70.73 -49.18 49.73 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 107.419 -1.326 . . . . 4.0800000000000001 107.419 -178.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 13.9 tpt -39.68 -55.89 1.81 Allowed 'General case' 0 CA--C 1.534 0.348 0 CA-C-N 119.687 1.13 . . . . 2.54 110.615 176.032 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 25.2 ttmm -60.92 -52.46 64.95 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 116.592 -0.276 . . . . 3.3199999999999998 111.088 178.435 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.2 m -58.62 -30.37 67.21 Favored 'General case' 0 CA--C 1.536 0.427 0 N-CA-C 113.082 0.771 . . . . 1.6799999999999999 113.082 -178.915 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.472 HD13 ' CE2' ' B' ' 38' ' ' PHE . 60.3 mt -81.67 -55.28 4.75 Favored 'General case' 0 N--CA 1.45 -0.444 0 C-N-CA 126.183 1.793 . . . . 1.25 109.855 -176.545 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.26 2.9 t70 -68.72 -10.96 59.47 Favored 'General case' 0 C--O 1.218 -0.602 0 N-CA-C 115.083 1.512 . . . . 2.23 115.083 -170.163 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 18.9 m -31.98 -23.79 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 N-CA-C 120.069 3.359 . . . . 1.71 120.069 -134.888 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 3.6 p30 -51.43 -34.38 34.67 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-N 121.106 1.776 . . . . 2.98 110.223 157.455 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 10.0 tt0 65.48 47.5 2.25 Favored 'General case' 0 N--CA 1.453 -0.283 0 C-N-CA 124.993 1.317 . . . . 2.9300000000000002 109.163 174.132 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 27.2 p30 -76.9 -29.13 55.6 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 115.188 -0.915 . . . . 1.9299999999999999 108.815 168.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 4.0 m 96.14 -5.98 0.08 Allowed 'General case' 0 N--CA 1.468 0.451 0 C-N-CA 128.25 2.62 . . . . 2.3599999999999999 113.503 178.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 13.9 mt-10 -101.68 119.13 38.29 Favored 'General case' 0 N--CA 1.453 -0.312 0 N-CA-C 107.094 -1.447 . . . . 2.77 107.094 170.389 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -85.23 112.33 20.65 Favored 'General case' 0 N--CA 1.45 -0.463 0 N-CA-C 107.696 -1.224 . . . . 1.27 107.696 178.752 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -83.43 173.35 11.58 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 126.932 2.093 . . . . 2.9500000000000002 110.719 -177.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -82.72 52.73 2.18 Favored 'General case' 0 C--N 1.345 0.407 0 O-C-N 121.08 -1.013 . . . . 3.8500000000000001 111.004 176.675 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -169.58 48.07 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 106.498 -1.667 . . . . 2.54 106.498 125.655 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -97.38 -64.18 1.06 Allowed 'General case' 0 N--CA 1.45 -0.445 0 O-C-N 119.841 -1.787 . . . . 1.98 109.265 152.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.455 ' CD2' ' CZ ' ' B' ' 38' ' ' PHE . 22.6 t80 -49.07 -48.71 43.89 Favored 'General case' 0 CA--C 1.516 -0.365 0 C-N-CA 125.327 1.451 . . . . 3.4500000000000002 110.138 -177.039 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.627 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 0.7 OUTLIER -53.28 -31.64 44.76 Favored 'General case' 0 N--CA 1.446 -0.642 0 CA-C-N 114.494 -1.23 . . . . 4.7599999999999998 110.886 -169.626 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . 0.469 ' HB2' ' CD2' ' B' ' 63' ' ' LEU . 28.4 mmt180 -40.16 -46.71 2.27 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 123.951 0.9 . . . . 4.4900000000000002 112.283 170.863 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 2.8 tp -54.45 -37.18 64.87 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-N 117.908 0.322 . . . . 0.97999999999999998 110.886 -178.824 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 84.3 mt -63.85 -32.93 58.98 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.207 0 N-CA-C 108.31 -0.996 . . . . 1.3600000000000001 108.31 -179.034 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.54 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -72.24 -40.88 54.78 Favored Glycine 0 CA--C 1.491 -1.459 0 C-N-CA 124.523 1.059 . . . . 1.46 110.688 -179.674 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . 0.401 ' O ' ' HG2' ' B' ' 86' ' ' GLU . 1.2 mm-40 -64.67 -64.92 0.75 Allowed 'General case' 0 N--CA 1.433 -1.308 0 N-CA-C 106.075 -1.824 . . . . 2.25 106.075 177.085 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 3.8 pp -55.44 -34.58 64.58 Favored 'General case' 0 CA--C 1.533 0.312 0 CA-C-N 118.533 0.606 . . . . 1.8200000000000001 112.341 -173.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.65 -62.13 2.08 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-N 118.346 0.521 . . . . 1.49 111.042 170.127 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.302 0.0 OUTLIER -63.41 -30.63 71.73 Favored 'General case' 0 N--CA 1.454 -0.244 0 CA-C-O 118.219 -0.896 . . . . 1.8300000000000001 111.428 -173.574 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' B' ' 82' ' ' GLU . 12.1 mm-40 -54.21 -26.14 26.79 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.15 0.98 . . . . 2.8599999999999999 111.952 177.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 3.5 tt -59.4 -38.28 74.09 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 CA-C-N 119.802 1.183 . . . . 1.24 110.834 172.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -82.35 -41.84 19.49 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 126.6 1.96 . . . . 3.7799999999999998 110.583 176.747 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -97.32 114.61 26.42 Favored 'General case' 0 C--O 1.224 -0.247 0 C-N-CA 126.442 1.897 . . . . 5.0499999999999998 111.011 -165.981 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 38.3 ttpt -63.98 -39.27 93.75 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 121.735 -0.603 . . . . 5.25 110.61 167.961 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 9.8 mmtt -162.82 -2.62 0.04 OUTLIER 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 124.21 1.004 . . . . 6.2300000000000004 113.434 179.217 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 31.0 t70 -80.56 56.58 2.64 Favored 'General case' 0 CA--C 1.537 0.447 0 CA-C-N 119.894 1.225 . . . . 4.75 111.598 -177.229 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.46 ' CG ' ' H ' ' B' ' 94' ' ' LYS . 0.3 OUTLIER -84.16 -94.11 0.07 Allowed 'General case' 0 N--CA 1.456 -0.164 0 N-CA-C 107.805 -1.183 . . . . 5.2800000000000002 107.805 168.869 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . 0.46 ' H ' ' CG ' ' B' ' 93' ' ' LEU . 0.0 OUTLIER 68.47 159.09 0.16 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 127.422 2.289 . . . . 8.2100000000000009 111.615 176.176 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 0.2 OUTLIER -145.49 147.38 18.66 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.227 0 N-CA-C 106.908 -1.515 . . . . 7.8899999999999997 106.908 173.74 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 26.5 tpt180 -167.03 119.54 0.95 Allowed 'General case' 0 N--CA 1.455 -0.194 0 N-CA-C 107.386 -1.339 . . . . 6.3099999999999996 107.386 178.18 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -176.62 136.02 0.24 Allowed 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 106.186 -1.783 . . . . 8.7200000000000006 106.186 -178.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 10.8 tptp . . . . . 0 C--O 1.253 1.239 0 N-CA-C 104.36 -2.459 . . . . 6.2800000000000002 104.36 166.201 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 48.8 mtt . . . . . 0 N--CA 1.469 0.478 0 N-CA-C 109.477 -0.564 . . . . 6.2400000000000002 109.477 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -85.73 62.35 7.41 Favored 'General case' 0 N--CA 1.455 -0.21 0 C-N-CA 123.325 0.65 . . . . 4.3499999999999996 110.669 -175.106 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 51.59 57.32 6.69 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 125.258 1.423 . . . . 6.0499999999999998 113.202 170.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 9.5 mp0 -91.42 -66.3 0.13 Allowed Pre-proline 0 CA--C 1.538 0.502 0 C-N-CA 124.431 1.092 . . . . 7.5899999999999999 110.969 -173.127 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 81.3 Cg_endo -71.64 161.98 43.57 Favored 'Trans proline' 0 N--CA 1.455 -0.788 0 CA-C-N 121.05 1.411 . . . . 3.9100000000000001 109.727 170.406 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 40.5 mt -130.62 -157.9 0.85 Allowed 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 125.716 1.606 . . . . 1.9199999999999999 108.344 -171.351 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 57.3 m -60.55 144.79 50.75 Favored 'General case' 0 C--O 1.224 -0.243 0 O-C-N 120.506 -1.371 . . . . 3.8199999999999998 109.909 176.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -35.58 -66.86 0.18 Allowed 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.948 1.299 . . . . 3.7000000000000002 111.756 170.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 96.2 mt -63.21 -32.69 74.15 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-O 117.377 -1.297 . . . . 2.0899999999999999 113.022 179.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -52.91 -49.5 65.82 Favored 'General case' 0 C--N 1.347 0.477 0 CA-C-N 120.855 1.661 . . . . 2.25 111.515 168.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 20.8 mm-40 -49.5 -51.77 34.04 Favored 'General case' 0 CA--C 1.534 0.352 0 N-CA-C 108.493 -0.929 . . . . 3.0800000000000001 108.493 175.22 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 11.5 m -60.43 -53.14 61.1 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-N 115.647 -0.706 . . . . 1.99 111.862 -175.667 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.272 2.7 pp -64.88 -38.49 82.9 Favored 'Isoleucine or valine' 0 C--O 1.232 0.177 0 O-C-N 121.577 -0.702 . . . . 0.80000000000000004 109.741 -176.513 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 20.5 tt0 -62.47 -50.13 72.65 Favored 'General case' 0 CA--C 1.534 0.359 0 O-C-N 121.645 -0.66 . . . . 3.0299999999999998 111.222 175.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.1 t -58.93 -34.65 71.96 Favored 'General case' 0 CA--C 1.539 0.537 0 CA-C-N 119.073 0.851 . . . . 1.2 111.749 -173.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 23.0 m -77.13 -41.44 30.9 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.346 0 O-C-N 121.171 -0.956 . . . . 0.72999999999999998 110.878 174.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.9 t -53.91 -47.7 63.96 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 118.923 0.783 . . . . 0.76000000000000001 110.81 175.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.9 t -62.67 -43.16 99.51 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 121.454 -0.779 . . . . 0.88 110.897 179.435 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 39.1 m -59.9 -50.2 74.7 Favored 'General case' 0 CA--C 1.537 0.476 0 O-C-N 121.877 -0.514 . . . . 1.05 109.689 178.743 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 4.3 t80 -47.73 -56.93 6.26 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 123.461 0.705 . . . . 3.0699999999999998 110.585 169.35 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 62.3 t80 -60.3 -45.32 93.78 Favored 'General case' 0 N--CA 1.45 -0.447 0 C-N-CA 123.077 0.551 . . . . 3.29 111.178 -169.757 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.4 t -61.31 -32.36 72.22 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 120.061 -0.656 . . . . 2.5299999999999998 110.789 179.931 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 56.3 m-85 -70.19 -43.95 69.69 Favored 'General case' 0 C--O 1.218 -0.599 0 CA-C-N 119.432 1.015 . . . . 3.0299999999999998 110.72 168.395 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -50.13 -38.59 39.76 Favored 'General case' 0 C--N 1.328 -0.359 0 C-N-CA 124.748 1.219 . . . . 1.05 111.797 -171.271 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 22.8 ptt85 -75.63 -20.45 58.5 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-O 117.563 -1.208 . . . . 4.5700000000000003 113.877 -177.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 4.3 tp60 -47.77 -57.9 5.01 Favored 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 120.1 1.318 . . . . 2.3300000000000001 112.898 -166.537 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -120.66 93.57 4.08 Favored 'General case' 0 C--O 1.242 0.704 0 C-N-CA 128.541 2.736 . . . . 3.1299999999999999 106.08 -171.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 48.59 -174.19 0.03 OUTLIER Glycine 0 CA--C 1.526 0.736 0 C-N-CA 125.699 1.619 . . . . 1.71 112.37 -176.361 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 17.3 mmt-85 29.74 97.46 0.0 OUTLIER 'General case' 0 C--O 1.24 0.596 0 C-N-CA 126.09 1.756 . . . . 4.75 112.846 164.629 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.53 40.87 0.38 Allowed 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.598 1.559 . . . . 5.5999999999999996 109.167 177.749 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 -154.81 -51.87 0.09 Allowed 'General case' 0 N--CA 1.451 -0.412 0 N-CA-C 106.285 -1.746 . . . . 4.9699999999999998 106.285 -145.305 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 14.5 p -115.16 139.3 50.03 Favored 'General case' 0 C--O 1.246 0.889 0 C-N-CA 125.566 1.546 . . . . 2.2400000000000002 111.097 172.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -101.4 117.64 35.35 Favored 'General case' 0 N--CA 1.449 -0.515 0 CA-C-N 113.727 -1.579 . . . . 2.5 108.241 -176.846 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 19.0 m -88.35 174.98 7.84 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 126.074 1.75 . . . . 2.1200000000000001 110.999 178.776 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 33.5 m -58.82 -48.82 84.99 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.304 0 O-C-N 121.395 -0.816 . . . . 2.6800000000000002 112.979 -172.654 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.2 t30 -68.35 -47.38 67.62 Favored 'General case' 0 C--O 1.22 -0.474 0 CA-C-O 118.4 -0.81 . . . . 2.9500000000000002 109.518 -178.262 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 70.3 mt-10 -41.81 -46.91 4.04 Favored 'General case' 0 N--CA 1.465 0.324 0 CA-C-N 119.059 0.845 . . . . 2.1000000000000001 112.02 168.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.401 ' CZ ' HD13 ' A' ' 63' ' ' LEU . 0.1 OUTLIER -56.71 -59.99 4.21 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 123.168 0.587 . . . . 2.8999999999999999 110.602 172.986 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 17.1 tttt -57.93 -41.18 82.23 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 123.491 0.716 . . . . 2.6899999999999999 111.32 -172.621 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 97.4 mt-10 -47.84 -40.63 21.85 Favored 'General case' 0 N--CA 1.448 -0.534 0 C-N-CA 124.137 0.975 . . . . 3.1899999999999999 112.122 174.057 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.0 tm? -59.32 -52.47 65.49 Favored 'General case' 0 C--N 1.34 0.194 0 CA-C-N 119.617 1.098 . . . . 3.1800000000000002 108.113 -178.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 6.1 m -72.94 -50.87 29.61 Favored 'Isoleucine or valine' 0 N--CA 1.444 -0.729 0 CA-C-N 114.919 -1.037 . . . . 1.6100000000000001 109.703 -169.498 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.2 m -57.36 -44.31 84.27 Favored 'General case' 0 N--CA 1.446 -0.658 0 C-N-CA 125.401 1.48 . . . . 1.6000000000000001 111.656 178.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -60.22 -62.34 1.94 Allowed 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.78 0.718 . . . . 3.7400000000000002 110.999 -173.284 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 35.4 mt-30 -145.15 38.53 1.17 Allowed 'General case' 0 CA--C 1.537 0.448 0 N-CA-C 113.493 0.923 . . . . 4.6900000000000004 113.493 -173.033 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.58 HD21 HD22 ' A' ' 83' ' ' LEU . 0.6 OUTLIER -129.13 31.75 0.22 Allowed Pre-proline 0 CA--C 1.549 0.934 0 N-CA-C 116.074 1.879 . . . . 2.2400000000000002 116.074 178.857 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.7 Cg_endo -62.38 -60.52 0.19 Allowed 'Trans proline' 0 C--N 1.348 0.539 0 C-N-CA 122.852 2.368 . . . . 2.5099999999999998 114.232 -165.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.7 m-70 -66.3 -37.96 86.63 Favored 'General case' 0 CA--C 1.53 0.192 0 O-C-N 121.337 -0.852 . . . . 4.2599999999999998 111.421 -175.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.459 HD13 HD12 ' B' ' 6' ' ' LEU . 22.5 tp -65.66 -54.32 29.11 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 122.993 0.517 . . . . 1.48 110.027 -173.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.5 mt -107.63 87.71 2.56 Favored 'General case' 0 C--N 1.343 0.314 0 CA-C-O 121.841 0.829 . . . . 2.1000000000000001 109.533 169.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -51.69 160.35 0.66 Allowed 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 113.981 -1.463 . . . . 5.5300000000000002 111.645 170.999 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 57.53 39.66 27.62 Favored 'General case' 0 CA--C 1.533 0.301 0 C-N-CA 124.205 1.002 . . . . 5.3899999999999997 111.098 168.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -41.28 -34.57 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.45 -0.451 0 C-N-CA 128.186 2.594 . . . . 2.6299999999999999 112.658 177.073 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -39.75 -48.69 3.23 Favored Glycine 0 CA--C 1.529 0.922 0 C-N-CA 124.153 0.883 . . . . 1.71 112.006 174.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 15.6 t -91.95 20.72 5.49 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 123.763 0.825 . . . . 1.9099999999999999 113.226 -172.509 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.498 ' C ' HD13 ' A' ' 56' ' ' LEU . 1.5 tm? -39.2 -46.38 1.48 Allowed 'General case' 0 CA--C 1.529 0.162 0 C-N-CA 125.642 1.577 . . . . 1.72 111.897 173.854 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 m-20 -49.94 -37.5 32.22 Favored 'General case' 0 CA--C 1.536 0.439 0 C-N-CA 126.932 2.093 . . . . 4.5599999999999996 111.75 -174.443 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -58.49 -52.9 63.67 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-O 121.535 0.683 . . . . 2.96 109.781 173.456 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -57.47 -49.51 76.05 Favored 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 107.933 -1.136 . . . . 2.9300000000000002 107.933 -178.8 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -49.51 -54.6 17.02 Favored 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.414 0.686 . . . . 1.6100000000000001 110.651 177.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.0 mtpp -59.83 -43.78 94.41 Favored 'General case' 0 CA--C 1.534 0.339 0 O-C-N 122.346 -0.221 . . . . 2.9500000000000002 111.203 -179.426 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 13.6 t -60.24 -44.1 95.53 Favored 'General case' 0 CA--C 1.538 0.51 0 CA-C-O 121.831 0.824 . . . . 1.8899999999999999 111.185 178.18 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.401 HD13 ' CZ ' ' A' ' 38' ' ' PHE . 11.0 mt -64.69 -46.3 82.96 Favored 'General case' 0 C--O 1.234 0.266 0 C-N-CA 124.531 1.133 . . . . 2.1699999999999999 110.601 -179.046 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 54.8 t0 -69.11 77.0 0.34 Allowed 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 124.439 1.096 . . . . 1.6399999999999999 110.629 -177.04 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 22.0 m -46.15 -43.35 5.03 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 C-N-CA 124.673 1.189 . . . . 1.6799999999999999 113.648 -172.758 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 27.6 p-10 -96.82 6.6 48.36 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 123.436 0.694 . . . . 2.2400000000000002 112.254 -176.239 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 9.1 tt0 37.5 56.8 1.42 Allowed 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 126.831 2.053 . . . . 3.1000000000000001 112.189 -177.941 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 50.6 p30 -94.42 -5.92 45.22 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.929 1.292 . . . . 1.6299999999999999 110.565 177.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 18.9 m 67.8 19.94 9.49 Favored 'General case' 0 CA--C 1.531 0.238 0 C-N-CA 124.892 1.277 . . . . 1.73 111.583 -174.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -131.03 109.39 10.47 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.685 -1.598 . . . . 3.0299999999999998 106.685 174.567 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.422 ' CD2' ' N ' ' A' ' 71' ' ' LEU . 0.1 OUTLIER -83.53 105.39 14.42 Favored 'General case' 0 N--CA 1.452 -0.355 0 N-CA-C 103.86 -2.644 . . . . 1.23 103.86 171.838 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.43 164.86 1.24 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 108.71 -0.848 . . . . 4.04 108.71 169.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 46.0 m-85 -38.05 -60.55 0.74 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 124.923 1.289 . . . . 4.7000000000000002 110.98 175.495 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER -67.78 -26.64 66.2 Favored 'General case' 0 CA--C 1.536 0.411 0 C-N-CA 124.229 1.012 . . . . 1.5600000000000001 112.264 -175.367 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.6 mt-10 -73.36 -59.07 2.88 Favored 'General case' 0 CA--C 1.529 0.17 0 CA-C-N 118.804 0.729 . . . . 2.1600000000000001 109.067 174.749 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 9.9 t80 -51.8 -47.86 64.08 Favored 'General case' 0 CA--C 1.512 -0.481 0 N-CA-C 109.422 -0.584 . . . . 2.5499999999999998 109.422 -179.801 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.675 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 55.4 t90 -46.5 -39.53 10.95 Favored 'General case' 0 N--CA 1.44 -0.94 0 O-C-N 124.312 1.007 . . . . 4.1299999999999999 111.528 -175.808 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 70.6 mtt180 -43.43 -40.99 4.04 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.676 0.671 . . . . 4.0300000000000002 112.756 175.014 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 28.7 tp -52.55 -44.64 65.97 Favored 'General case' 0 N--CA 1.45 -0.434 0 C-N-CA 123.065 0.546 . . . . 1.05 111.149 179.036 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 55.1 mt -60.23 -28.34 41.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 N-CA-C 108.0 -1.111 . . . . 1.47 108.0 178.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.587 ' CA ' ' CZ2' ' B' ' 77' ' ' TRP . . . -68.88 -52.76 22.68 Favored Glycine 0 CA--C 1.492 -1.367 0 C-N-CA 126.547 2.022 . . . . 1.27 111.896 178.978 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.4 mm-40 -59.43 -59.71 5.01 Favored 'General case' 0 N--CA 1.434 -1.238 0 N-CA-C 105.792 -1.929 . . . . 2.3799999999999999 105.792 179.674 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.58 HD22 HD21 ' A' ' 46' ' ' LEU 0.298 4.3 pp -54.35 -38.43 66.07 Favored 'General case' 0 CA--C 1.551 1.015 0 O-C-N 121.339 -0.851 . . . . 1.95 112.768 179.016 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . 0.463 ' O ' HG22 ' A' ' 87' ' ' ILE . . . -62.84 -29.01 70.41 Favored 'General case' 0 N--CA 1.465 0.325 0 O-C-N 121.091 -1.005 . . . . 1.25 113.528 175.016 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 15.2 ttmt -81.06 -44.16 18.42 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 125.601 1.56 . . . . 1.6899999999999999 109.691 174.784 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 62.5 mm-40 -63.29 -25.73 68.45 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 124.82 1.248 . . . . 2.5899999999999999 111.162 -175.346 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.463 HG22 ' O ' ' A' ' 84' ' ' ALA . 12.4 tt -48.23 -34.37 4.85 Favored 'Isoleucine or valine' 0 C--N 1.344 0.34 0 CA-C-N 119.259 0.936 . . . . 1.4199999999999999 112.825 167.725 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 38.1 ttp180 -96.51 -48.6 5.48 Favored 'General case' 0 N--CA 1.449 -0.481 0 C-N-CA 124.611 1.164 . . . . 5.1100000000000003 108.669 177.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 74.1 tttt -65.93 -14.61 61.87 Favored 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 113.527 0.936 . . . . 2.8599999999999999 113.527 -173.197 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 7.0 pttt -49.89 -28.96 7.32 Favored 'General case' 0 CA--C 1.543 0.674 0 O-C-N 120.893 -1.129 . . . . 9.5399999999999991 111.342 164.061 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . 2.224 26.2 ttmt 7.97 -77.0 0.0 OUTLIER 'General case' 0 C--O 1.235 0.308 0 N-CA-C 118.029 2.603 . . . . 14.24 118.029 135.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -140.16 -83.36 0.24 Allowed 'General case' 0 N--CA 1.454 -0.251 0 CA-C-N 114.125 -1.398 . . . . 6.0700000000000003 107.605 -115.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 48.7 tp -80.4 67.89 6.39 Favored 'General case' 0 N--CA 1.436 -1.17 0 C-N-CA 124.228 1.011 . . . . 8.6500000000000004 108.975 -178.857 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 57.9 mttp 88.47 98.41 0.03 OUTLIER 'General case' 0 C--N 1.334 -0.079 0 C-N-CA 126.982 2.113 . . . . 10.359999999999999 110.179 161.411 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.9 mp -51.93 -66.14 0.24 Allowed 'Isoleucine or valine' 0 N--CA 1.454 -0.237 0 C-N-CA 124.95 1.3 . . . . 8.0500000000000007 109.116 -175.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 36.55 70.21 0.17 Allowed 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 126.496 1.919 . . . . 17.18 111.745 176.357 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.59 136.21 0.15 Allowed 'General case' 0 C--O 1.232 0.144 0 C-N-CA 126.933 2.093 . . . . 11.18 107.143 -179.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.249 1.046 0 CA-C-O 118.529 -0.748 . . . . 15.85 109.542 171.513 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 83.5 mtp . . . . . 0 N--CA 1.471 0.603 0 N-CA-C 107.375 -1.343 . . . . 9.0299999999999994 107.375 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.427 . . 54.27 -150.48 0.39 Allowed 'General case' 0 CA--C 1.534 0.364 0 O-C-N 123.545 0.528 . . . . 6.5 110.578 -171.127 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 74.26 101.28 0.07 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.324 1.449 . . . . 5.75 112.025 172.647 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.569 ' HB3' ' CD ' ' B' ' 5' ' ' PRO 0.341 9.5 tt0 -101.83 -115.04 0.0 OUTLIER Pre-proline 0 CA--C 1.558 1.253 0 CA-C-O 114.843 -2.503 . . . . 7.4199999999999999 110.967 -172.759 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . 0.569 ' CD ' ' HB3' ' B' ' 4' ' ' GLU . 22.4 Cg_endo -90.1 163.19 4.79 Favored 'Trans proline' 0 C--N 1.36 1.146 0 CA-C-N 124.554 2.662 . . . . 3.52 110.651 179.516 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.81 HD12 ' HG3' ' B' ' 10' ' ' GLU . 5.9 mt -139.81 -53.28 0.53 Allowed 'General case' 0 CA--C 1.544 0.72 0 N-CA-C 113.759 1.022 . . . . 4.2400000000000002 113.759 -155.385 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 6.8 t -170.09 -175.41 2.0 Allowed 'General case' 0 N--CA 1.479 0.995 0 CA-C-N 120.204 1.366 . . . . 2.25 110.989 -172.937 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 70.8 tt0 -71.42 -67.25 0.53 Allowed 'General case' 0 N--CA 1.467 0.407 0 CA-C-N 119.848 1.204 . . . . 2.71 112.118 -167.107 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 11.9 mt -48.97 -42.34 37.31 Favored 'General case' 0 C--N 1.34 0.196 0 O-C-N 121.615 -0.678 . . . . 1.26 110.793 173.815 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.81 ' HG3' HD12 ' B' ' 6' ' ' LEU . 11.3 tm-20 -48.94 -61.29 2.14 Favored 'General case' 0 N--CA 1.441 -0.914 0 CA-C-O 117.76 -1.114 . . . . 5.8399999999999999 112.472 169.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 10.1 mt-10 -51.51 -41.6 61.11 Favored 'General case' 0 CA--C 1.539 0.541 0 CA-C-N 121.402 1.91 . . . . 3.75 109.946 178.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.2 t -61.83 -30.4 70.81 Favored 'General case' 0 CA--C 1.533 0.306 0 CA-C-O 118.334 -0.841 . . . . 1.6299999999999999 112.839 -179.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.408 ' CD1' HD12 ' A' ' 87' ' ' ILE 0.284 2.7 pp -80.51 -35.68 15.4 Favored 'Isoleucine or valine' 0 C--N 1.34 0.192 0 CA-C-N 119.842 1.201 . . . . 1.0900000000000001 110.892 167.341 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.7 tm-20 -52.38 -53.32 46.33 Favored 'General case' 0 CA--C 1.537 0.461 0 N-CA-C 108.066 -1.087 . . . . 3.0299999999999998 108.066 179.546 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 7.8 t -55.02 -35.4 64.38 Favored 'General case' 0 CA--C 1.543 0.704 0 N-CA-C 113.115 0.783 . . . . 1.25 113.115 -175.454 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 20.0 m -80.11 -37.09 17.27 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.232 0 O-C-N 120.807 -1.183 . . . . 0.77000000000000002 110.172 175.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 43.4 t -58.65 -45.57 90.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.281 0 C-N-CA 123.807 0.843 . . . . 0.87 110.593 177.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 8.9 t -60.79 -44.08 97.29 Favored 'General case' 0 CA--C 1.536 0.419 0 CA-C-N 119.853 1.206 . . . . 1.3400000000000001 110.609 175.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 23.1 m -57.77 -52.16 66.61 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 119.094 0.861 . . . . 1.0600000000000001 109.733 178.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -46.83 -60.88 2.13 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 125.186 1.394 . . . . 3.8999999999999999 110.968 171.281 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 64.8 t80 -59.49 -49.72 76.68 Favored 'General case' 0 N--CA 1.454 -0.227 0 C-N-CA 124.977 1.311 . . . . 2.8300000000000001 110.975 -171.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 34.6 p -56.15 -56.68 17.96 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-O 118.915 -0.564 . . . . 2.1899999999999999 109.819 177.886 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -52.71 -47.24 67.43 Favored 'General case' 0 C--O 1.223 -0.32 0 CA-C-N 119.099 0.863 . . . . 2.8300000000000001 111.338 175.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.39 -29.7 58.99 Favored 'General case' 0 N--CA 1.448 -0.536 0 C-N-CA 125.366 1.467 . . . . 1.2 110.653 -175.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -59.07 -21.25 58.87 Favored 'General case' 0 CA--C 1.517 -0.294 0 CA-C-O 117.435 -1.269 . . . . 5.5199999999999996 113.289 177.48 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -58.08 -65.03 0.71 Allowed 'General case' 0 N--CA 1.446 -0.651 0 C-N-CA 118.148 -1.421 . . . . 2.0299999999999998 114.56 -156.703 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -88.41 -80.21 0.29 Allowed 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 119.279 -0.968 . . . . 3.48 112.774 -162.732 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.34 170.05 29.62 Favored Glycine 0 C--N 1.34 0.774 0 C-N-CA 128.802 3.096 . . . . 2.29 110.834 148.689 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 21.8 mmm180 61.29 87.58 0.09 Allowed 'General case' 0 C--O 1.241 0.622 0 N-CA-C 112.283 0.475 . . . . 4.9299999999999997 112.283 140.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 56.3 pttt -74.83 52.72 0.55 Allowed 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 125.631 1.572 . . . . 3.52 110.833 174.997 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 3.0 p30 -161.94 -58.74 0.05 OUTLIER 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 107.842 -1.17 . . . . 3.9199999999999999 107.842 -172.013 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 17.1 m -96.66 142.27 28.9 Favored 'General case' 0 C--O 1.245 0.858 0 C-N-CA 124.135 0.974 . . . . 3.5499999999999998 110.486 179.063 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -83.18 131.96 35.09 Favored 'General case' 0 N--CA 1.45 -0.433 0 C-N-CA 124.313 1.045 . . . . 2.1099999999999999 109.058 -179.256 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 1.3 p -114.8 174.44 5.97 Favored 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.848 1.259 . . . . 2.5299999999999998 108.724 171.988 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 7.4 p -99.81 51.23 0.12 Allowed 'Isoleucine or valine' 0 C--N 1.338 0.087 0 O-C-N 121.255 -0.903 . . . . 2.5499999999999998 111.143 -170.229 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -155.2 53.74 0.63 Allowed 'General case' 0 N--CA 1.447 -0.585 0 N-CA-C 105.416 -2.068 . . . . 2.0299999999999998 105.416 145.247 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 85.9 mt-10 -149.24 -54.45 0.17 Allowed 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 130.683 3.593 . . . . 2.0099999999999998 104.527 173.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -53.48 -55.11 28.05 Favored 'General case' 0 N--CA 1.448 -0.56 0 CA-C-N 115.174 -0.921 . . . . 2.2799999999999998 109.192 179.018 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 42.5 tttt -61.21 -41.73 97.36 Favored 'General case' 0 N--CA 1.452 -0.332 0 C-N-CA 120.296 -0.561 . . . . 2.98 111.118 179.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 83.4 mt-10 -51.41 -40.39 59.22 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 118.134 0.425 . . . . 3.1099999999999999 111.587 177.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 10.2 tt -67.98 -47.3 68.94 Favored 'General case' 0 C--O 1.234 0.27 0 N-CA-C 109.15 -0.685 . . . . 1.8899999999999999 109.15 -175.3 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.4 m -68.52 -47.82 75.29 Favored 'Isoleucine or valine' 0 N--CA 1.45 -0.43 0 N-CA-C 109.873 -0.417 . . . . 0.83999999999999997 109.873 -176.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 55.8 m -60.29 -55.26 35.83 Favored 'General case' 0 N--CA 1.448 -0.566 0 C-N-CA 124.381 1.072 . . . . 0.92000000000000004 111.501 178.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 21.6 tt0 -79.02 -58.81 3.05 Favored 'General case' 0 N--CA 1.453 -0.324 0 CA-C-N 118.25 0.477 . . . . 2.46 110.52 -171.851 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 2.0 tp60 -80.98 -50.67 9.41 Favored 'General case' 0 N--CA 1.453 -0.297 0 CA-C-O 121.203 0.525 . . . . 2.9399999999999999 110.387 -166.602 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -84.79 -16.93 0.23 Allowed Pre-proline 0 CA--C 1.543 0.702 0 N-CA-C 120.158 3.392 . . . . 1.8600000000000001 120.158 -163.53 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_endo -39.91 -50.69 3.26 Favored 'Trans proline' 0 CA--C 1.532 0.386 0 C-N-CA 125.038 3.825 . . . . 2.3999999999999999 116.841 -134.652 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 13.2 t-160 -66.46 -30.94 71.39 Favored 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 112.968 0.729 . . . . 2.2200000000000002 112.968 -172.944 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 29.2 tp -67.64 -73.49 0.14 Allowed 'General case' 0 CA--C 1.535 0.388 0 CA-C-N 118.573 0.624 . . . . 1.1899999999999999 110.096 -170.378 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 60.6 mt -79.42 78.96 5.91 Favored 'General case' 0 CA--C 1.518 -0.278 0 N-CA-C 108.218 -1.03 . . . . 1.6699999999999999 108.218 170.166 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.18 169.91 0.76 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.67 -0.695 . . . . 4.9299999999999997 110.243 167.588 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 66.85 40.03 3.23 Favored 'General case' 0 N--CA 1.467 0.409 0 C-N-CA 125.233 1.413 . . . . 4.7599999999999998 109.602 -167.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 27.3 m -59.78 -24.3 28.88 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.336 0 C-N-CA 124.188 0.995 . . . . 2.0 111.854 177.936 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -52.6 -67.03 2.28 Favored Glycine 0 CA--C 1.528 0.883 0 N-CA-C 109.408 -1.477 . . . . 2.4700000000000002 109.408 171.636 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.8 m -72.02 61.73 0.44 Allowed 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 127.032 2.133 . . . . 3.1699999999999999 111.292 -178.552 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.6 tm? -80.9 -37.62 29.39 Favored 'General case' 0 N--CA 1.439 -1.019 0 C-N-CA 124.449 1.1 . . . . 1.1200000000000001 109.178 175.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 6.8 p-10 -54.63 -49.76 69.75 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 123.55 0.74 . . . . 3.5299999999999998 111.342 -175.766 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.8 OUTLIER -59.63 -38.39 81.22 Favored 'General case' 0 CA--C 1.535 0.4 0 O-C-N 121.872 -0.517 . . . . 3.0800000000000001 111.348 176.686 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -61.23 -54.13 48.05 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 123.352 0.661 . . . . 4.04 109.392 176.595 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -52.75 -52.68 55.44 Favored 'General case' 0 N--CA 1.453 -0.299 0 C-N-CA 126.321 1.848 . . . . 1.6000000000000001 110.136 177.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 77.3 mttt -58.33 -45.96 87.1 Favored 'General case' 0 CA--C 1.532 0.27 0 C-N-CA 123.183 0.593 . . . . 4.2999999999999998 110.358 178.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 12.3 t -57.96 -44.72 87.2 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 123.095 0.558 . . . . 1.6000000000000001 110.551 177.994 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 22.9 mt -63.42 -45.03 92.83 Favored 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 123.136 0.575 . . . . 1.75 111.356 176.242 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.328 16.1 t0 -51.66 -8.35 0.06 Allowed 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 118.799 2.888 . . . . 2.1099999999999999 118.799 -169.202 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 26.9 m -34.07 -19.46 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.47 0.539 1 C-N-CA 131.982 4.113 . . . . 1.8700000000000001 119.276 -137.099 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -53.86 -36.62 62.79 Favored 'General case' 0 CA--C 1.534 0.352 0 CA-C-N 120.366 1.439 . . . . 3.1800000000000002 109.656 160.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 17.2 mt-30 66.62 63.51 0.5 Allowed 'General case' 0 C--N 1.342 0.255 0 C-N-CA 125.586 1.555 . . . . 4.3300000000000001 109.268 -171.226 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 30.0 p30 -120.35 -16.13 8.48 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 126.859 2.063 . . . . 2.4399999999999999 112.668 -175.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.5 m 70.87 22.37 4.74 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 126.247 1.819 . . . . 2.6899999999999999 113.093 -176.85 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 1.7 tt0 -128.5 112.44 14.34 Favored 'General case' 0 C--O 1.235 0.34 0 N-CA-C 106.16 -1.793 . . . . 3.3700000000000001 106.16 166.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -81.02 110.57 16.68 Favored 'General case' 0 N--CA 1.456 -0.13 0 N-CA-C 106.403 -1.703 . . . . 1.4099999999999999 106.403 174.781 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 10.5 tppt? -79.0 168.66 19.37 Favored 'General case' 0 N--CA 1.45 -0.462 0 N-CA-C 108.518 -0.919 . . . . 3.7200000000000002 108.518 -173.834 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 20.0 p90 -91.26 50.42 1.75 Allowed 'General case' 0 CA--C 1.534 0.33 0 O-C-N 121.999 -0.438 . . . . 5.3300000000000001 110.314 174.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -156.7 48.43 0.46 Allowed 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 106.661 -1.607 . . . . 2.25 106.661 119.158 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 41.9 mt-10 -94.65 -62.12 1.38 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.897 1.679 . . . . 2.6200000000000001 109.078 142.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 16.7 t80 -44.91 -48.73 11.26 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 125.883 1.673 . . . . 3.7400000000000002 110.078 -173.451 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.675 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 4.1 t-105 -44.74 -37.13 3.55 Favored 'General case' 0 N--CA 1.445 -0.698 0 CA-C-O 117.627 -1.178 . . . . 4.7000000000000002 111.76 -178.985 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 1.7 ttt85 -40.11 -47.26 2.32 Favored 'General case' 0 C--N 1.35 0.624 0 CA-C-N 119.987 1.267 . . . . 6.7999999999999998 110.864 174.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 15.8 tp -44.19 -47.07 9.16 Favored 'General case' 0 N--CA 1.449 -0.521 0 C-N-CA 123.637 0.775 . . . . 0.85999999999999999 110.599 -178.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 53.9 mt -62.76 -34.0 63.2 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.387 0 CA-C-O 121.988 0.899 . . . . 1.6000000000000001 109.559 -173.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.572 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -72.53 -42.81 46.86 Favored Glycine 0 CA--C 1.487 -1.7 0 N-CA-C 109.544 -1.423 . . . . 1.47 109.544 -179.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . 0.262 5.0 mm-40 -67.07 -48.41 68.34 Favored 'General case' 0 N--CA 1.421 -1.882 0 N-CA-C 105.535 -2.024 . . . . 3.29 105.535 -175.819 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 7.7 mt -42.9 -58.07 2.55 Favored 'General case' 0 CA--C 1.538 0.482 0 CA-C-N 121.262 1.846 . . . . 2.2200000000000002 111.896 166.864 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.42 -23.46 49.62 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 123.618 0.767 . . . . 1.3 112.536 179.324 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.01 -57.21 3.74 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.453 1.101 . . . . 2.0299999999999998 110.581 170.47 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 16.0 mm-40 -57.53 -28.03 63.13 Favored 'General case' 0 N--CA 1.462 0.153 0 C-N-CA 129.01 2.924 . . . . 2.79 111.68 -168.11 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 2.9 tt -49.58 -44.17 18.97 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 O-C-N 122.014 -0.429 . . . . 1.1399999999999999 110.662 168.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 55.5 ttt85 -85.56 -61.65 1.71 Allowed 'General case' 0 CA--C 1.544 0.73 0 C-N-CA 125.62 1.568 . . . . 3.8599999999999999 113.67 167.861 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . 0.479 ' HG3' ' H ' ' B' ' 92' ' ' ASP . 35.3 tttm -56.33 129.65 41.3 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 125.75 1.62 . . . . 7.1399999999999997 110.947 -173.652 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 53.2 mtpt -84.06 -56.59 3.59 Favored 'General case' 0 CA--C 1.534 0.33 0 CA-C-O 121.754 0.788 . . . . 4.9100000000000001 109.167 164.222 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 17.9 ptpt -147.82 -2.22 0.56 Allowed 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.833 1.653 . . . . 6.7300000000000004 112.113 -177.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . 0.479 ' H ' ' HG3' ' B' ' 89' ' ' LYS . 1.0 OUTLIER -92.94 54.31 2.16 Favored 'General case' 0 N--CA 1.452 -0.371 0 O-C-N 121.736 -0.602 . . . . 4.9100000000000001 110.477 -138.809 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 53.9 tp -123.68 -72.15 0.69 Allowed 'General case' 0 N--CA 1.446 -0.631 0 C-N-CA 124.123 0.969 . . . . 5.4500000000000002 109.754 -172.445 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -168.04 168.77 11.69 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 124.17 0.988 . . . . 7.4800000000000004 108.596 177.223 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 6.3 tp -153.91 43.09 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 C-N-CA 123.192 0.597 . . . . 8.8900000000000006 110.498 177.939 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -162.23 154.63 19.41 Favored 'General case' 0 CA--C 1.532 0.268 0 O-C-N 121.189 -0.944 . . . . 7.8200000000000003 109.396 173.224 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 22.3 tptp -177.05 138.09 0.24 Allowed 'General case' 0 N--CA 1.455 -0.209 0 C-N-CA 127.471 2.308 . . . . 7.75 105.1 -171.788 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 9.5 tptp . . . . . 0 C--O 1.253 1.251 0 N-CA-C 103.402 -2.814 . . . . 10.130000000000001 103.402 161.542 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.4 mtt . . . . . 0 N--CA 1.474 0.761 0 N-CA-C 105.019 -2.215 . . . . 8.2599999999999998 105.019 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -61.32 175.13 0.6 Allowed 'General case' 0 C--O 1.237 0.444 0 N-CA-C 109.057 -0.72 . . . . 3.29 109.057 136.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.39 99.11 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.216 0 C-N-CA 129.108 2.963 . . . . 3.6699999999999999 109.686 -175.048 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 -70.56 126.17 92.18 Favored Pre-proline 0 N--CA 1.45 -0.426 0 C-N-CA 123.877 0.871 . . . . 4.6600000000000001 110.565 -174.215 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.51 113.1 3.63 Favored 'Trans proline' 0 N--CA 1.453 -0.903 0 C-N-CA 122.346 2.031 . . . . 2.4300000000000002 109.269 178.394 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 61.5 mt -69.23 164.2 23.25 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 123.076 0.55 . . . . 1.4399999999999999 110.312 177.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.4 t -76.63 162.21 27.93 Favored 'General case' 0 CA--C 1.528 0.109 0 N-CA-C 108.992 -0.744 . . . . 2.0 108.992 176.928 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 34.3 tt0 -56.91 -53.28 59.7 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 124.171 0.988 . . . . 3.1800000000000002 111.216 -169.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 5.5 mt -62.77 -49.87 73.29 Favored 'General case' 0 CA--C 1.536 0.433 0 CA-C-O 118.046 -0.978 . . . . 1.4199999999999999 112.563 178.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 89.5 mt-10 -51.1 -54.46 24.81 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 119.687 1.13 . . . . 2.1200000000000001 110.683 175.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 16.8 tp10 -49.26 -56.18 10.22 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.066 1.347 . . . . 3.8399999999999999 110.161 174.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 19.3 t -53.5 -46.97 70.24 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 123.999 0.92 . . . . 2.1499999999999999 111.392 -178.588 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.311 2.8 pp -70.04 -35.49 64.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.289 0 O-C-N 120.966 -1.084 . . . . 0.98999999999999999 111.42 178.487 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -59.14 -51.84 68.26 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 119.2 0.909 . . . . 2.79 109.977 176.11 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . 0.256 12.5 t -53.26 -38.94 63.49 Favored 'General case' 0 CA--C 1.547 0.864 0 O-C-N 121.801 -0.562 . . . . 1.8700000000000001 112.177 -176.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 2.5 m -72.92 -39.35 58.25 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.311 0 O-C-N 120.461 -1.399 . . . . 0.90000000000000002 111.226 175.666 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.4 t -55.22 -47.3 77.76 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.112 0 CA-C-N 118.252 0.478 . . . . 0.81000000000000005 110.184 175.613 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . 0.253 10.2 t -62.11 -48.57 79.56 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-O 117.937 -1.03 . . . . 1.23 111.334 178.502 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 16.4 m -49.92 -52.26 34.6 Favored 'General case' 0 C--N 1.348 0.503 0 CA-C-N 120.395 1.452 . . . . 1.51 110.803 173.019 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.3 t80 -50.92 -60.0 3.55 Favored 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 123.228 0.611 . . . . 3.0099999999999998 110.163 176.217 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 0.8 OUTLIER -61.89 -45.16 94.95 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 122.96 0.504 . . . . 3.1299999999999999 111.384 -170.663 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -65.3 -19.22 65.86 Favored 'General case' 0 CA--C 1.535 0.385 0 CA-C-O 119.252 -0.404 . . . . 2.1600000000000001 111.902 177.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.526 ' HB3' HD21 ' A' ' 33' ' ' LEU . 0.3 OUTLIER -81.54 -44.11 17.78 Favored 'General case' 0 C--O 1.219 -0.519 0 CA-C-N 118.401 0.546 . . . . 3.1099999999999999 111.899 164.947 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.17 -33.11 67.12 Favored 'General case' 0 C--O 1.237 0.443 0 C-N-CA 125.453 1.501 . . . . 0.78000000000000003 111.655 -168.191 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 34.2 ptt180 -62.73 -34.96 78.27 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 124.545 1.138 . . . . 4.6600000000000001 112.439 177.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -40.86 -64.69 0.5 Allowed 'General case' 0 C--N 1.344 0.365 0 CA-C-O 122.139 0.971 . . . . 1.8999999999999999 113.255 -160.039 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -106.08 81.93 1.7 Allowed 'General case' 0 N--CA 1.442 -0.841 0 N-CA-C 103.889 -2.634 . . . . 3.1600000000000001 103.889 -178.076 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 48.06 -172.94 0.04 OUTLIER Glycine 0 CA--C 1.53 1.012 0 C-N-CA 126.835 2.16 . . . . 2.1699999999999999 114.518 179.461 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 32.2 ttm180 34.73 88.54 0.01 OUTLIER 'General case' 0 C--O 1.235 0.333 0 C-N-CA 127.267 2.227 . . . . 4.75 112.367 169.05 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 13.0 ptpt -75.97 57.84 1.11 Allowed 'General case' 0 CA--C 1.538 0.49 0 C-N-CA 124.955 1.302 . . . . 3.9900000000000002 112.784 -166.779 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -163.53 -44.79 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 C-N-CA 126.646 1.979 . . . . 4.3700000000000001 106.906 174.539 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 m -82.08 113.39 19.91 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 125.479 1.512 . . . . 1.8600000000000001 109.59 -179.113 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.645 HD22 ' CE1' ' A' ' 76' ' ' TYR . 4.8 mp -84.33 136.62 33.82 Favored 'General case' 0 N--CA 1.448 -0.529 0 CA-C-N 116.149 -0.478 . . . . 2.7200000000000002 110.05 168.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.9 t -81.2 174.59 11.4 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 126.519 1.928 . . . . 2.8599999999999999 108.625 172.541 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 11.5 p -62.21 -43.01 97.4 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.112 0 O-C-N 122.079 -0.388 . . . . 2.1699999999999999 110.01 179.725 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 8.3 t30 -67.58 -57.29 6.72 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 118.182 -0.913 . . . . 2.0499999999999998 109.113 179.231 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.408 ' HB3' HD23 ' A' ' 33' ' ' LEU . 5.5 mt-10 -37.6 -49.16 1.08 Allowed 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.361 1.464 . . . . 1.8300000000000001 112.072 169.735 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 4.6 t80 -60.03 -59.99 4.53 Favored 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.967 -0.458 . . . . 3.3599999999999999 110.597 174.271 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.5 tttm -52.92 -40.67 63.78 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 118.281 0.491 . . . . 3.2000000000000002 111.671 -176.451 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -51.82 -39.97 59.68 Favored 'General case' 0 N--CA 1.446 -0.627 0 C-N-CA 123.968 0.907 . . . . 3.2799999999999998 110.574 -179.923 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 57.5 tp -68.58 -45.8 71.08 Favored 'General case' 0 N--CA 1.456 -0.14 0 CA-C-N 119.543 1.065 . . . . 2.3700000000000001 109.435 -176.699 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.491 HG12 HD22 ' A' ' 46' ' ' LEU . 35.6 m -69.62 -28.1 36.27 Favored 'Isoleucine or valine' 0 C--O 1.227 -0.123 0 CA-C-O 120.99 0.424 . . . . 1.8899999999999999 110.4 -175.699 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 63.7 m -81.09 -40.23 24.42 Favored 'General case' 0 N--CA 1.447 -0.587 0 C-N-CA 124.383 1.073 . . . . 1.8 111.105 177.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 20.9 tt0 -82.78 -55.86 4.18 Favored 'General case' 0 N--CA 1.456 -0.172 0 C-N-CA 124.176 0.991 . . . . 2.5600000000000001 110.067 -172.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 7.2 mp0 -96.71 -146.51 0.29 Allowed 'General case' 0 CA--C 1.541 0.608 0 N-CA-C 107.616 -1.253 . . . . 3.9700000000000002 107.616 169.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.537 HD21 HD11 ' A' ' 83' ' ' LEU . 8.0 mp 38.63 44.95 0.68 Allowed Pre-proline 0 CA--C 1.548 0.898 0 C-N-CA 126.243 1.817 . . . . 2.5299999999999998 113.15 -167.284 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.456 ' HD2' HG21 ' B' ' 7' ' ' THR . 58.3 Cg_endo -59.93 -32.86 95.77 Favored 'Trans proline' 0 N--CA 1.454 -0.806 0 C-N-CA 122.55 2.167 . . . . 1.9199999999999999 111.966 179.9 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.1 OUTLIER -132.94 -6.33 3.11 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 114.485 1.291 . . . . 3.2000000000000002 114.485 179.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.567 HD23 ' HG ' ' A' ' 83' ' ' LEU 2.134 10.8 mp -2.05 -144.83 0.0 OUTLIER 'General case' 0 CA--C 1.536 0.405 0 N-CA-C 120.989 3.7 . . . . 2.1699999999999999 120.989 129.485 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.422 ' C ' ' H ' ' A' ' 52' ' ' ASP . 6.2 mt -82.73 88.13 6.74 Favored 'General case' 0 N--CA 1.447 -0.601 0 CA-C-N 113.33 -1.759 . . . . 2.0600000000000001 107.714 174.8 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -64.73 18.88 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.702 0 N-CA-C 114.899 1.444 . . . . 5.0700000000000003 114.899 177.445 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.422 ' H ' ' C ' ' A' ' 50' ' ' LEU . 64.9 m-20 -115.57 20.67 14.55 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 128.192 2.597 . . . . 5.6699999999999999 109.289 -172.653 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.0 m -53.33 -15.18 0.76 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.409 0 C-N-CA 126.681 1.992 . . . . 2.6899999999999999 114.833 -172.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -56.33 -51.85 53.47 Favored Glycine 0 CA--C 1.529 0.936 0 N-CA-C 110.048 -1.221 . . . . 2.3799999999999999 110.048 170.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 2.8 t -84.92 60.45 6.23 Favored 'General case' 0 CA--C 1.53 0.181 0 CA-C-O 122.361 1.077 . . . . 2.8900000000000001 109.826 -173.179 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -77.38 -36.5 53.46 Favored 'General case' 0 N--CA 1.438 -1.057 0 O-C-N 121.628 -0.67 . . . . 1.6000000000000001 109.79 -176.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -59.61 -46.7 88.19 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 118.783 0.719 . . . . 4.6699999999999999 110.496 178.917 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 80.2 tt0 -45.04 -57.92 3.53 Favored 'General case' 0 C--O 1.235 0.306 0 C-N-CA 124.576 1.15 . . . . 3.3300000000000001 109.413 170.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 6.0 mmpt? -60.28 -45.15 94.32 Favored 'General case' 0 N--CA 1.446 -0.627 0 CA-C-O 118.735 -0.65 . . . . 5.3399999999999999 110.78 -179.205 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -51.34 -54.94 21.4 Favored 'General case' 0 C--N 1.334 -0.087 0 CA-C-N 119.428 1.013 . . . . 1.51 109.59 178.84 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 44.6 mtmt -57.57 -37.64 73.48 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 122.584 0.354 . . . . 3.1499999999999999 111.001 177.298 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 14.5 m -62.9 -47.75 81.95 Favored 'General case' 0 CA--C 1.537 0.468 0 O-C-N 121.863 -0.523 . . . . 1.8799999999999999 112.165 175.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.418 HD21 ' HB2' ' A' ' 79' ' ' LEU . 7.2 mp -66.77 -60.24 2.86 Favored 'General case' 0 C--O 1.232 0.171 0 O-C-N 121.27 -0.894 . . . . 2.0299999999999998 109.32 -179.555 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.0 t0 -75.98 74.7 2.88 Favored 'General case' 0 N--CA 1.451 -0.396 0 C-N-CA 125.175 1.39 . . . . 1.5800000000000001 109.683 -168.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 28.1 m -45.55 -37.19 2.17 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 C-N-CA 124.93 1.292 . . . . 1.75 113.17 -175.971 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 11.0 p-10 -102.37 8.18 40.28 Favored 'General case' 0 CA--C 1.533 0.312 0 N-CA-C 113.131 0.789 . . . . 2.8399999999999999 113.131 -176.159 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 11.3 tt0 46.81 59.14 4.14 Favored 'General case' 0 CA--C 1.536 0.425 0 C-N-CA 125.76 1.624 . . . . 3.3599999999999999 112.359 172.233 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 40.5 p30 -108.69 -9.57 15.25 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 125.36 1.464 . . . . 2.0 111.76 178.835 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.2 m 62.47 25.7 15.31 Favored 'General case' 0 CA--C 1.53 0.195 0 C-N-CA 124.173 0.989 . . . . 1.6599999999999999 111.9 -170.663 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 20.0 mt-10 -122.81 100.91 7.15 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 126.194 1.798 . . . . 3.23 107.57 169.662 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.7 mm? -86.49 79.97 8.79 Favored 'General case' 0 N--CA 1.445 -0.687 0 N-CA-C 105.926 -1.879 . . . . 0.96999999999999997 105.926 170.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 58.9 pttt -69.24 171.78 7.94 Favored 'General case' 0 N--CA 1.466 0.338 0 C-N-CA 122.776 0.43 . . . . 3.96 110.706 174.209 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -37.92 -61.15 0.67 Allowed 'General case' 0 N--CA 1.466 0.36 0 C-N-CA 125.563 1.545 . . . . 5.29 112.842 -167.038 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 14.7 t-20 -68.39 -44.5 74.97 Favored 'General case' 0 CA--C 1.533 0.298 0 O-C-N 121.582 -0.699 . . . . 2.4700000000000002 111.432 -177.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -57.53 -33.15 67.79 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 123.209 0.603 . . . . 1.8600000000000001 111.203 178.147 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.645 ' CE1' HD22 ' A' ' 33' ' ' LEU . 35.5 t80 -78.67 -48.19 15.51 Favored 'General case' 0 N--CA 1.451 -0.401 0 CA-C-N 118.102 0.41 . . . . 3.23 110.363 175.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.622 ' CD1' ' HA2' ' B' ' 81' ' ' GLY . 44.5 t-105 -48.54 -29.09 3.85 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 123.823 0.849 . . . . 5.0800000000000001 111.72 176.886 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.406 ' HA ' ' CH2' ' B' ' 77' ' ' TRP . 14.4 mmm180 -37.23 -56.62 0.93 Allowed 'General case' 0 N--CA 1.473 0.681 0 C-N-CA 124.347 1.059 . . . . 3.6600000000000001 110.859 166.766 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.418 ' HB2' HD21 ' A' ' 63' ' ' LEU . 26.0 tp -49.07 -43.33 40.9 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 123.905 0.882 . . . . 0.80000000000000004 111.219 -179.588 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.3 mp -80.72 -29.64 11.8 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.236 0 N-CA-C 107.925 -1.139 . . . . 1.95 107.925 -168.501 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.43 ' HA3' ' CE2' ' B' ' 77' ' ' TRP . . . -56.22 -51.11 58.04 Favored Glycine 0 N--CA 1.439 -1.141 0 N-CA-C 110.259 -1.137 . . . . 1.1299999999999999 110.259 164.786 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.1 mm-40 -63.22 -33.93 76.57 Favored 'General case' 0 N--CA 1.44 -0.95 0 CA-C-O 118.596 -0.716 . . . . 2.4300000000000002 110.456 179.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.567 ' HG ' HD23 ' A' ' 49' ' ' LEU . 8.0 mp -57.84 -55.58 33.04 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-N 119.793 1.179 . . . . 2.3999999999999999 109.708 173.716 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -52.12 -48.25 64.91 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 121.346 0.593 . . . . 1.55 109.914 177.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 31.7 ttmt -55.65 -34.65 65.15 Favored 'General case' 0 C--O 1.22 -0.455 0 CA-C-O 117.849 -1.072 . . . . 2.3999999999999999 112.271 174.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 25.5 mm-40 -78.91 -14.22 59.35 Favored 'General case' 0 C--O 1.231 0.122 0 C-N-CA 127.406 2.283 . . . . 2.1299999999999999 112.624 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -91.5 -26.72 4.98 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.854 0 N-CA-C 113.773 1.027 . . . . 2.75 113.773 157.803 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.77 -65.5 0.75 Allowed 'General case' 0 CA--C 1.546 0.8 0 CA-C-N 119.851 1.205 . . . . 4.8200000000000003 111.579 175.277 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 11.0 ptpt -84.18 -170.29 3.02 Favored 'General case' 0 C--O 1.214 -0.784 0 N-CA-C 104.106 -2.553 . . . . 3.5899999999999999 104.106 145.345 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 40.4 mttp -49.63 -46.08 49.02 Favored 'General case' 0 N--CA 1.446 -0.652 0 CA-C-N 124.72 3.418 . . . . 8.6400000000000006 110.741 -21.117 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . 0.267 1.5 tppt? 153.54 61.77 0.0 OUTLIER 'General case' 0 N--CA 1.479 0.999 1 C-N-CA 141.013 7.725 . . . . 9.6799999999999997 104.747 -13.544 . . . . . . . . 3 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -113.76 170.91 7.91 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 125.618 1.567 . . . . 8.5500000000000007 110.273 162.023 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . 0.292 0.6 OUTLIER 92.97 -93.61 0.0 OUTLIER 'General case' 0 N--CA 1.442 -0.839 0 C-N-CA 129.253 3.021 . . . . 13.369999999999999 113.659 171.981 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 7.8 mtmp? -147.8 123.6 10.58 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-O 117.343 -1.313 . . . . 15.19 110.188 -169.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.1 OUTLIER -76.88 -43.09 33.08 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.953 0 CA-C-N 121.572 1.987 . . . . 14.44 111.539 177.173 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER 68.95 44.18 1.08 Allowed 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 123.887 0.875 . . . . 16.02 110.514 -175.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 10.6 tmtt? -177.65 136.38 0.19 Allowed 'General case' 0 N--CA 1.461 0.096 0 C-N-CA 126.406 1.883 . . . . 18.550000000000001 106.045 173.133 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.249 1.031 0 N-CA-C 103.269 -2.863 . . . . 16.129999999999999 103.269 156.142 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 6.6 tpt . . . . . 0 C--O 1.205 -1.241 0 CA-C-O 115.599 -2.143 . . . . 12.529999999999999 106.296 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . 0.538 ' CB ' ' HA ' ' B' ' 3' ' ' ALA 0.295 . . -134.74 -144.59 0.22 Allowed 'General case' 0 N--CA 1.485 1.298 0 CA-C-N 124.152 3.16 . . . . 4.71 115.195 -167.046 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . 0.538 ' HA ' ' CB ' ' B' ' 2' ' ' ALA 2.361 . . 104.78 101.62 0.01 OUTLIER 'General case' 0 C--N 1.352 0.71 1 C-N-CA 134.404 5.081 . . . . 4.0800000000000001 112.159 27.453 . . . . . . . . 4 3 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.406 ' HB2' ' O ' ' B' ' 3' ' ' ALA 0.279 2.2 mt-10 124.06 175.11 0.0 OUTLIER Pre-proline 0 N--CA 1.48 1.059 1 C-N-CA 135.003 5.321 . . . . 6.7999999999999998 107.947 -178.386 . . . . . . . . 4 3 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -70.71 147.35 56.59 Favored 'Trans proline' 0 C--N 1.353 0.766 0 CA-C-N 122.462 1.915 . . . . 4.04 112.375 -169.111 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . 2.316 0.2 OUTLIER -90.72 -146.82 0.19 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 127.81 2.444 . . . . 2.4399999999999999 112.751 -167.217 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.593 HG22 ' HB2' ' B' ' 10' ' ' GLU . 1.1 t -118.51 -109.68 0.35 Allowed 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 126.738 2.015 . . . . 1.8700000000000001 108.001 178.662 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -105.75 -68.72 0.85 Allowed 'General case' 0 N--CA 1.454 -0.248 0 C-N-CA 126.351 1.86 . . . . 5.1200000000000001 107.483 172.525 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 3.7 mp -65.79 -51.09 61.89 Favored 'General case' 0 N--CA 1.446 -0.673 0 O-C-N 121.807 -0.558 . . . . 2.7200000000000002 110.032 -177.283 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.593 ' HB2' HG22 ' B' ' 7' ' ' THR . 4.2 mp0 -52.25 -39.58 60.52 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 119.22 -0.419 . . . . 3.8399999999999999 111.375 173.301 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -53.57 -56.09 20.12 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.179 -0.675 . . . . 4.9500000000000002 109.179 172.725 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 35.9 p -71.35 -39.63 71.19 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 119.926 -0.71 . . . . 2.1899999999999999 110.822 -167.317 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.3 pp -69.67 -35.54 66.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.559 0 O-C-N 121.261 -0.899 . . . . 1.45 109.863 177.945 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 7.2 tm-20 -60.83 -55.46 32.86 Favored 'General case' 0 C--N 1.342 0.249 0 CA-C-N 119.199 0.909 . . . . 3.1000000000000001 109.615 171.992 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.4 t -55.43 -38.84 69.5 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-O 121.911 0.862 . . . . 1.5800000000000001 111.564 -170.787 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 17.0 m -72.89 -39.17 58.34 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.337 0 O-C-N 120.667 -1.271 . . . . 1.1699999999999999 111.402 174.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 45.2 t -60.85 -44.1 96.98 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.223 0 CA-C-N 119.447 1.021 . . . . 1.3899999999999999 111.389 176.532 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 10.1 t -62.46 -45.92 90.84 Favored 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 119.725 1.148 . . . . 1.52 110.257 177.702 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 60.3 m -52.93 -55.18 25.31 Favored 'General case' 0 CA--C 1.536 0.429 0 CA-C-O 121.345 0.593 . . . . 1.47 109.73 174.513 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 62.1 t80 -49.99 -49.83 49.19 Favored 'General case' 0 N--CA 1.453 -0.318 0 C-N-CA 124.611 1.164 . . . . 4.2000000000000002 111.101 175.414 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 60.8 t80 -62.18 -54.31 42.9 Favored 'General case' 0 N--CA 1.453 -0.304 0 C-N-CA 123.889 0.875 . . . . 2.6899999999999999 110.649 -175.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 15.0 t -62.13 -29.32 70.26 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 119.555 -0.858 . . . . 3.4399999999999999 110.797 179.995 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 2.5 m-85 -63.4 -54.02 43.29 Favored 'General case' 0 C--O 1.223 -0.292 0 CA-C-N 118.4 0.545 . . . . 3.1600000000000001 111.092 167.894 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.57 -30.28 62.97 Favored 'General case' 0 N--CA 1.448 -0.57 0 C-N-CA 126.336 1.854 . . . . 1.6799999999999999 110.407 -172.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 8.5 ptt180 -54.85 -26.88 38.3 Favored 'General case' 0 N--CA 1.454 -0.236 0 C-N-CA 124.01 0.924 . . . . 3.9700000000000002 112.657 176.603 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.451 ' HB3' ' CG ' ' B' ' 37' ' ' GLU . 11.2 tt0 -62.87 -68.64 0.32 Allowed 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 114.063 1.134 . . . . 4.3499999999999996 114.063 -157.083 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . 0.469 ' CD ' ' H ' ' B' ' 28' ' ' GLY . 0.0 OUTLIER -90.2 -74.91 0.47 Allowed 'General case' 0 CA--C 1.532 0.25 0 N-CA-C 115.026 1.491 . . . . 5.0700000000000003 115.026 -163.245 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . 0.469 ' H ' ' CD ' ' B' ' 27' ' ' GLU . . . -92.08 170.1 32.76 Favored Glycine 0 N--CA 1.443 -0.843 0 C-N-CA 127.943 2.687 . . . . 2.6600000000000001 109.779 154.965 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 3.2 tpt180 38.41 102.09 0.0 OUTLIER 'General case' 0 C--O 1.24 0.58 0 C-N-CA 125.63 1.572 . . . . 4.04 114.792 142.675 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 15.6 ptmt -71.09 49.73 0.14 Allowed 'General case' 0 CA--C 1.535 0.372 0 C-N-CA 125.631 1.572 . . . . 3.3599999999999999 112.578 176.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 1.9 t0 -153.84 -53.67 0.1 Allowed 'General case' 0 N--CA 1.451 -0.401 0 C-N-CA 125.072 1.349 . . . . 3.7200000000000002 108.17 -172.828 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 6.4 p -104.78 157.58 17.1 Favored 'General case' 0 C--O 1.244 0.799 0 C-N-CA 124.219 1.007 . . . . 2.29 113.305 -177.32 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.416 HD13 ' HB3' ' B' ' 37' ' ' GLU . 1.4 mm? -111.03 151.34 28.13 Favored 'General case' 0 C--N 1.34 0.158 0 C-N-CA 127.86 2.464 . . . . 2.3399999999999999 109.39 -173.054 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 8.2 t -149.95 178.18 9.16 Favored 'General case' 0 C--O 1.235 0.304 0 C-N-CA 124.378 1.071 . . . . 3.5299999999999998 108.323 169.976 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 9.2 p -83.89 53.09 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.271 0 CA-C-O 121.865 0.84 . . . . 2.8399999999999999 111.127 -171.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.25 56.12 0.51 Allowed 'General case' 0 N--CA 1.452 -0.345 0 N-CA-C 105.618 -1.993 . . . . 2.9100000000000001 105.618 150.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.451 ' CG ' ' HB3' ' B' ' 26' ' ' GLN . 1.3 tt0 -173.78 -59.92 0.02 OUTLIER 'General case' 0 N--CA 1.445 -0.699 0 N-CA-C 104.037 -2.579 . . . . 1.8300000000000001 104.037 -172.677 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 4.4 t80 -57.55 -56.46 21.6 Favored 'General case' 0 N--CA 1.451 -0.397 0 CA-C-N 115.33 -0.85 . . . . 2.0800000000000001 109.52 172.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.495 ' HE3' HD12 ' B' ' 56' ' ' LEU . 16.3 ttmt -57.05 -37.8 72.31 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 122.074 -0.391 . . . . 3.0 111.179 -177.005 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 3.2 mt-10 -62.74 -30.03 71.12 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.449 -0.782 . . . . 2.9300000000000002 111.683 177.833 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -62.25 -52.54 63.32 Favored 'General case' 0 C--O 1.233 0.185 0 N-CA-C 107.978 -1.119 . . . . 2.6600000000000001 107.978 -179.425 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.408 ' HA ' HD23 ' B' ' 46' ' ' LEU . 2.6 m -68.17 -42.55 84.9 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.26 0 CA-C-N 115.125 -0.943 . . . . 0.81999999999999995 109.969 -174.752 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 96.6 m -54.08 -54.16 43.24 Favored 'General case' 0 N--CA 1.448 -0.531 0 CA-C-N 115.941 -0.572 . . . . 1.28 110.054 173.189 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 20.1 tt0 -82.15 -62.78 1.53 Allowed 'General case' 0 CA--C 1.541 0.634 0 N-CA-C 113.796 1.035 . . . . 1.96 113.796 -167.015 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -83.19 -36.13 24.91 Favored 'General case' 0 N--CA 1.47 0.556 0 N-CA-C 115.932 1.827 . . . . 3.6899999999999999 115.932 -163.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' B' ' 42' ' ' VAL . 1.5 mm? -46.67 -38.82 12.7 Favored Pre-proline 0 N--CA 1.469 0.515 0 N-CA-C 114.027 1.121 . . . . 1.79 114.027 -159.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 38.2 Cg_endo -64.04 -20.87 68.21 Favored 'Trans proline' 0 N--CA 1.449 -1.09 0 C-N-CA 122.191 -2.004 . . . . 2.1800000000000002 109.978 -62.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 14.9 t-80 -93.09 -56.27 3.03 Favored 'General case' 0 N--CA 1.45 -0.429 0 C-N-CA 124.058 0.943 . . . . 2.8700000000000001 110.986 -169.789 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.474 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 7.4 tp -30.56 -72.12 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 126.133 1.773 . . . . 1.2 113.34 -167.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 79.7 mt -90.24 128.74 36.48 Favored 'General case' 0 N--CA 1.452 -0.344 0 N-CA-C 106.464 -1.68 . . . . 1.8899999999999999 106.464 169.794 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -118.43 -5.28 10.81 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 124.797 1.239 . . . . 6.7599999999999998 111.835 -173.745 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 12.8 p-10 -88.74 16.61 6.51 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 128.168 2.587 . . . . 4.75 111.201 -177.634 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 14.4 m -52.42 -28.09 11.57 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.364 0 C-N-CA 125.259 1.424 . . . . 1.72 111.404 177.33 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.08 -35.13 8.29 Favored Glycine 0 CA--C 1.531 1.087 0 C-N-CA 124.308 0.956 . . . . 3.3900000000000001 112.657 172.75 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.6 t -124.77 47.83 2.07 Favored 'General case' 0 CA--C 1.531 0.235 0 CA-C-N 117.817 0.808 . . . . 2.75 109.23 171.994 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.534 HD13 ' C ' ' B' ' 56' ' ' LEU . 2.3 tm? -45.63 -39.69 8.06 Favored 'General case' 0 N--CA 1.452 -0.362 0 C-N-CA 124.159 0.984 . . . . 1.3300000000000001 110.134 172.304 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -58.38 -25.62 62.28 Favored 'General case' 0 CA--C 1.544 0.741 0 C-N-CA 124.196 0.998 . . . . 4.2699999999999996 111.854 -174.561 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -58.53 -54.24 49.22 Favored 'General case' 0 C--N 1.344 0.332 0 O-C-N 121.326 -0.859 . . . . 2.8700000000000001 109.399 165.872 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.65 -49.29 75.49 Favored 'General case' 0 C--O 1.222 -0.393 0 N-CA-C 108.421 -0.955 . . . . 3.23 108.421 179.619 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 16.3 tpt -46.23 -60.24 2.43 Favored 'General case' 0 N--CA 1.462 0.13 0 C-N-CA 123.635 0.774 . . . . 2.4900000000000002 108.953 177.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 38.1 ttmt -57.46 -42.15 81.96 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 122.516 0.326 . . . . 3.6699999999999999 111.367 -178.859 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.5 m -65.48 -34.83 79.19 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 123.116 0.566 . . . . 2.71 112.442 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 39.2 mt -80.02 -44.91 19.31 Favored 'General case' 0 CA--C 1.529 0.154 0 C-N-CA 124.884 1.274 . . . . 1.77 109.645 -176.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 27.3 t0 -49.35 -8.76 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 128.346 2.658 . . . . 2.3199999999999998 117.17 -175.48 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 19.8 m -33.65 -28.27 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 C-N-CA 131.024 3.73 . . . . 2.3799999999999999 118.923 -124.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 18.7 p-10 -67.4 -20.62 65.56 Favored 'General case' 0 CA--C 1.536 0.408 0 CA-C-N 120.724 1.602 . . . . 3.48 110.977 170.869 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 9.8 tt0 69.85 65.52 0.24 Allowed 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 125.059 1.344 . . . . 3.6600000000000001 110.617 172.226 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 48.9 p30 -119.56 -7.39 10.13 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 126.37 1.868 . . . . 2.5499999999999998 112.321 -176.819 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 14.8 m 72.73 18.61 4.17 Favored 'General case' 0 CA--C 1.533 0.307 0 C-N-CA 126.337 1.855 . . . . 2.5299999999999998 112.673 -174.241 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 29.9 tt0 -126.11 110.28 13.33 Favored 'General case' 0 C--O 1.237 0.405 0 C-N-CA 125.362 1.465 . . . . 4.1200000000000001 108.798 170.858 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -80.44 104.08 10.74 Favored 'General case' 0 N--CA 1.453 -0.309 0 N-CA-C 106.813 -1.551 . . . . 1.55 106.813 170.242 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 73.7 tttt -91.21 166.64 12.84 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 126.533 1.933 . . . . 4.0700000000000003 110.023 -176.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -89.73 56.7 3.61 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.636 -0.665 . . . . 5.7699999999999996 111.525 179.234 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -158.52 49.26 0.37 Allowed 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 106.861 -1.533 . . . . 2.75 106.861 109.895 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 77.7 mt-10 -95.58 -61.32 1.48 Allowed 'General case' 0 N--CA 1.451 -0.417 0 C-N-CA 126.906 2.083 . . . . 2.5600000000000001 108.843 145.807 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 75.9 t80 -48.13 -38.34 17.65 Favored 'General case' 0 CA--C 1.514 -0.419 0 C-N-CA 125.779 1.632 . . . . 3.48 110.968 -174.042 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.43 ' CE2' ' HA3' ' A' ' 81' ' ' GLY . 23.0 t90 -39.75 -41.94 1.18 Allowed 'General case' 0 N--CA 1.445 -0.704 0 O-C-N 124.228 0.955 . . . . 5.2800000000000002 111.525 176.637 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 31.8 mmt180 -49.3 -30.28 7.16 Favored 'General case' 0 C--O 1.219 -0.55 0 CA-C-O 117.666 -1.159 . . . . 5.1299999999999999 113.095 179.282 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.424 HD12 ' HA ' ' B' ' 79' ' ' LEU . 18.3 tp -57.66 -44.43 85.69 Favored 'General case' 0 N--CA 1.452 -0.328 0 CA-C-N 121.776 2.08 . . . . 1.1000000000000001 111.184 174.944 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 1.4 mt -80.94 -26.94 10.92 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.685 0 C-N-CA 124.2 1.0 . . . . 1.8300000000000001 108.832 178.319 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.622 ' HA2' ' CD1' ' A' ' 77' ' ' TRP . . . -37.56 -57.02 1.55 Allowed Glycine 0 C--N 1.347 1.159 0 C-N-CA 127.7 2.572 . . . . 1.8 110.189 159.754 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . 0.402 ' C ' ' HG2' ' B' ' 86' ' ' GLU . 45.0 mm-40 -82.46 -63.78 1.31 Allowed 'General case' 0 N--CA 1.421 -1.895 0 CA-C-N 111.644 -2.278 . . . . 2.4900000000000002 108.252 -172.146 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.474 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 1.7 mp -38.49 -59.6 0.89 Allowed 'General case' 0 N--CA 1.47 0.526 0 CA-C-N 120.45 1.477 . . . . 2.1000000000000001 113.428 -169.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.34 -36.1 65.92 Favored 'General case' 0 C--O 1.224 -0.287 0 C-N-CA 123.148 0.579 . . . . 1.4099999999999999 111.365 -178.194 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 22.0 ttpp -80.69 -39.9 26.35 Favored 'General case' 0 N--CA 1.447 -0.577 0 C-N-CA 124.031 0.933 . . . . 1.6100000000000001 112.329 175.756 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.402 ' HG2' ' C ' ' B' ' 82' ' ' GLU . 5.3 mm-40 -60.45 -25.61 66.13 Favored 'General case' 0 C--N 1.339 0.129 0 CA-C-N 119.757 1.162 . . . . 3.1899999999999999 112.266 -177.039 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 1.5 tp -44.1 -44.44 2.09 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.941 0 N-CA-C 109.566 -0.531 . . . . 1.3300000000000001 109.566 167.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 24.1 tpt180 -85.71 -60.15 2.1 Favored 'General case' 0 CA--C 1.54 0.569 0 C-N-CA 126.805 2.042 . . . . 4.7800000000000002 113.198 171.172 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 29.0 tttm -66.25 115.0 5.76 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 125.616 1.566 . . . . 6.3399999999999999 111.574 -166.9 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 12.2 ttmt -76.09 -61.23 2.01 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 109.463 -0.569 . . . . 4.71 109.463 170.252 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -176.59 72.41 0.02 OUTLIER 'General case' 0 N--CA 1.462 0.162 0 C-N-CA 126.271 1.828 . . . . 6.5 108.142 -178.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 22.3 t0 -131.6 151.23 51.77 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 106.085 -1.82 . . . . 5.1699999999999999 106.085 153.609 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 1.6 pt? 175.12 -51.75 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.327 0 C-N-CA 128.362 2.665 . . . . 4.5499999999999998 107.83 -178.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 161.93 174.22 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.23 0 C-N-CA 128.839 2.856 . . . . 7.1699999999999999 107.468 -177.919 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 8.5 tp -147.71 50.83 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.448 0 CA-C-O 121.971 0.891 . . . . 8.8399999999999999 109.723 178.791 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 8.4 ttm180 -165.32 -147.08 0.09 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.38 1.072 . . . . 7.4299999999999997 108.445 175.125 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 87.2 tttt -176.66 138.98 0.3 Allowed 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 128.923 2.889 . . . . 9.8699999999999992 104.261 -174.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 34.6 tptt . . . . . 0 C--O 1.255 1.381 0 N-CA-C 103.834 -2.654 . . . . 6.8799999999999999 103.834 172.105 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.7 mtt . . . . . 0 N--CA 1.476 0.839 0 N-CA-C 105.696 -1.964 . . . . 8.1600000000000001 105.696 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.99 162.32 19.58 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-N 119.683 1.129 . . . . 3.6099999999999999 109.885 169.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 62.91 80.0 0.24 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.514 1.526 . . . . 3.46 112.137 177.195 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.9 tp10 -81.2 114.44 49.07 Favored Pre-proline 0 N--CA 1.446 -0.625 0 C-N-CA 124.545 1.138 . . . . 4.9199999999999999 109.685 -178.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 84.5 Cg_endo -79.53 98.87 1.18 Allowed 'Trans proline' 0 N--CA 1.453 -0.897 0 C-N-CA 122.559 2.172 . . . . 2.6000000000000001 109.575 -177.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -76.61 177.47 7.47 Favored 'General case' 0 CA--C 1.538 0.499 0 N-CA-C 109.586 -0.524 . . . . 2.3900000000000001 109.586 170.88 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 28.1 m -58.05 147.07 30.75 Favored 'General case' 0 CA--C 1.532 0.282 0 O-C-N 121.394 -0.816 . . . . 3.9100000000000001 110.778 -173.005 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 75.6 tt0 -53.96 -49.38 68.89 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.526 -0.734 . . . . 2.7000000000000002 110.285 175.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 9.7 mt -59.22 -39.87 84.07 Favored 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 117.98 -1.009 . . . . 1.6100000000000001 112.891 172.332 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -54.31 -50.27 67.73 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 120.583 1.538 . . . . 2.6200000000000001 111.465 170.059 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 43.1 mm-40 -50.48 -53.33 30.66 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 109.322 -0.622 . . . . 4.1500000000000004 109.322 176.762 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.9 p -67.14 -43.53 82.12 Favored 'General case' 0 N--CA 1.453 -0.286 0 O-C-N 121.746 -0.596 . . . . 1.79 111.932 -174.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.482 HG21 HD12 ' B' ' 83' ' ' LEU 0.276 1.8 pp -62.2 -41.04 89.86 Favored 'Isoleucine or valine' 0 C--N 1.342 0.242 0 CA-C-N 119.961 1.255 . . . . 0.80000000000000004 110.587 176.08 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 17.3 tt0 -58.36 -47.48 83.68 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 119.285 0.948 . . . . 3.2200000000000002 110.388 174.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -59.53 -35.32 73.97 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 112.626 0.602 . . . . 1.22 112.626 -175.582 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 22.0 m -80.16 -38.83 18.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.414 0 O-C-N 120.541 -1.35 . . . . 0.73999999999999999 111.187 173.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 29.5 t -57.95 -44.12 86.09 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.26 0 CA-C-N 118.708 0.685 . . . . 0.53000000000000003 110.528 178.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.6 t -61.08 -46.69 89.62 Favored 'General case' 0 CA--C 1.535 0.402 0 O-C-N 121.375 -0.828 . . . . 0.66000000000000003 110.075 177.173 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 10.7 m -56.68 -49.9 73.73 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-N 118.687 0.676 . . . . 0.85999999999999999 109.778 177.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 2.1 t80 -47.83 -57.45 5.62 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.986 0.914 . . . . 3.3100000000000001 110.951 170.751 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.1 t80 -67.26 -46.83 72.52 Favored 'General case' 0 C--O 1.234 0.284 0 C-N-CA 123.124 0.57 . . . . 2.71 111.123 -168.163 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 40.1 p -56.67 -28.49 60.81 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.577 0.751 . . . . 2.6099999999999999 111.517 176.706 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -75.49 -55.18 5.94 Favored 'General case' 0 C--O 1.222 -0.384 0 C-N-CA 123.339 0.655 . . . . 2.5099999999999998 111.969 165.938 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.61 -28.37 54.82 Favored 'General case' 0 C--N 1.327 -0.385 0 C-N-CA 126.907 2.083 . . . . 0.91000000000000003 112.173 -169.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 1.7 ppt_? -74.35 -18.79 60.63 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 124.563 1.145 . . . . 3.6800000000000002 113.083 -179.456 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -49.66 -67.93 0.22 Allowed 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 119.204 0.911 . . . . 2.6400000000000001 112.516 -175.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -108.48 172.69 6.7 Favored 'General case' 0 N--CA 1.447 -0.601 0 C-N-CA 126.861 2.064 . . . . 2.6000000000000001 106.703 -174.469 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -9.35 116.73 0.01 OUTLIER Glycine 0 CA--C 1.532 1.127 0 C-N-CA 127.481 2.467 . . . . 1.95 114.814 172.715 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 8.0 mpt_? 64.03 107.34 0.03 OUTLIER 'General case' 0 C--O 1.239 0.529 0 C-N-CA 124.701 1.201 . . . . 4.3700000000000001 113.279 171.658 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 26.0 pttm -65.57 58.82 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.086 0.954 . . . . 3.6099999999999999 111.298 164.376 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 13.4 t70 -166.51 -47.91 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.248 0 C-N-CA 125.788 1.635 . . . . 4.46 108.834 -171.374 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 13.9 p -95.85 129.2 43.16 Favored 'General case' 0 C--O 1.24 0.576 0 C-N-CA 125.446 1.499 . . . . 1.8 109.164 173.458 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.412 HD22 ' CD1' ' A' ' 76' ' ' TYR . 6.7 mp -84.11 136.24 34.08 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 108.018 -1.105 . . . . 2.5499999999999998 108.018 161.167 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.1 t -80.24 170.91 15.77 Favored 'General case' 0 C--N 1.328 -0.366 0 C-N-CA 125.097 1.359 . . . . 2.77 107.808 167.919 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.4 p -58.99 -41.33 82.88 Favored 'Isoleucine or valine' 0 N--CA 1.457 -0.117 0 O-C-N 121.882 -0.511 . . . . 3.0699999999999998 109.872 176.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -66.33 -59.6 3.56 Favored 'General case' 0 N--CA 1.451 -0.381 0 CA-C-O 118.481 -0.771 . . . . 1.8 109.211 -179.451 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.3 mt-10 -37.51 -54.16 1.14 Allowed 'General case' 0 N--CA 1.464 0.275 0 C-N-CA 124.145 0.978 . . . . 1.9199999999999999 112.048 169.822 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -59.88 -51.89 67.79 Favored 'General case' 0 N--CA 1.45 -0.466 0 CA-C-N 116.633 -0.258 . . . . 2.9700000000000002 111.128 178.441 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 29.8 tttm -56.9 -38.96 73.55 Favored 'General case' 0 N--CA 1.455 -0.206 0 CA-C-N 118.568 0.622 . . . . 3.8399999999999999 109.67 -176.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 25.4 mm-40 -66.32 -19.94 65.95 Favored 'General case' 0 N--CA 1.442 -0.868 0 CA-C-O 118.816 -0.611 . . . . 5.0199999999999996 112.125 -176.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -61.52 -55.82 26.86 Favored 'General case' 0 C--N 1.34 0.166 0 CA-C-N 119.638 1.108 . . . . 2.71 108.053 169.824 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 3.0 m -71.0 -44.21 75.81 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.313 0 CA-C-O 121.811 0.815 . . . . 1.6399999999999999 109.605 -169.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 38.2 m -68.38 -42.2 79.45 Favored 'General case' 0 N--CA 1.444 -0.766 0 C-N-CA 124.979 1.312 . . . . 1.3999999999999999 110.179 -175.765 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -75.79 -50.76 14.28 Favored 'General case' 0 CA--C 1.533 0.304 0 CA-C-N 118.769 0.713 . . . . 2.5899999999999999 110.646 178.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 39.2 mt-30 -149.45 73.23 1.18 Allowed 'General case' 0 CA--C 1.531 0.224 0 CA-C-N 118.314 0.506 . . . . 3.7999999999999998 112.185 -173.847 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 1.8 tp -154.65 45.79 0.27 Allowed Pre-proline 0 CA--C 1.549 0.904 0 N-CA-C 112.766 0.654 . . . . 2.0499999999999998 112.766 155.093 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo -62.59 -74.58 0.02 OUTLIER 'Trans proline' 0 C--N 1.35 0.646 0 C-N-CA 124.116 3.211 . . . . 1.98 114.726 -162.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 23.0 t-160 -63.62 -24.4 67.78 Favored 'General case' 0 CA--C 1.531 0.22 0 O-C-N 121.47 -0.769 . . . . 4.5300000000000002 111.107 -169.116 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 3.6 tp -74.2 -75.43 0.16 Allowed 'General case' 0 N--CA 1.445 -0.711 0 C-N-CA 122.617 0.367 . . . . 1.5700000000000001 110.447 177.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 67.6 mt -95.71 65.78 2.64 Favored 'General case' 0 CA--C 1.521 -0.149 0 N-CA-C 108.636 -0.876 . . . . 2.5699999999999998 108.636 179.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.464 ' CD ' ' H ' ' A' ' 51' ' ' LYS . 0.0 OUTLIER -54.68 -30.75 56.41 Favored 'General case' 0 C--N 1.333 -0.123 0 CA-C-N 114.253 -1.34 . . . . 5.7699999999999996 111.936 178.599 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.421 ' OD2' ' NZ ' ' A' ' 59' ' ' LYS . 33.3 t70 -73.35 72.16 1.29 Allowed 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 121.988 0.899 . . . . 3.4700000000000002 108.906 162.731 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.2 t -77.11 -6.52 9.1 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 127.954 2.501 . . . . 2.9900000000000002 109.557 161.091 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.89 -69.56 1.36 Allowed Glycine 0 C--N 1.345 1.041 0 C-N-CA 124.745 1.164 . . . . 2.27 110.493 -178.936 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.54 52.89 1.47 Allowed 'General case' 0 CA--C 1.533 0.314 0 CA-C-O 123.159 1.457 . . . . 4.1500000000000004 109.766 -176.347 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.5 tm? -57.3 -25.61 59.57 Favored 'General case' 0 N--CA 1.443 -0.807 0 C-N-CA 126.818 2.047 . . . . 2.0600000000000001 110.049 -174.736 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -42.32 -45.67 4.32 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 126.513 1.925 . . . . 4.5 111.576 169.158 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 22.8 tt0 -45.94 -52.83 10.97 Favored 'General case' 0 C--N 1.346 0.433 0 N-CA-C 108.992 -0.744 . . . . 6.3899999999999997 108.992 177.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.477 ' HE2' ' H ' ' A' ' 59' ' ' LYS . 1.5 mppt? -74.83 -63.28 1.29 Allowed 'General case' 0 N--CA 1.436 -1.154 0 N-CA-C 106.015 -1.846 . . . . 4.2400000000000002 106.015 -174.598 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.7 tmt? -47.5 -55.4 9.2 Favored 'General case' 0 N--CA 1.463 0.221 0 C-N-CA 123.56 0.744 . . . . 2.27 110.369 -170.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.2 ttpp -73.22 -19.0 61.18 Favored 'General case' 0 N--CA 1.442 -0.842 0 CA-C-N 115.252 -0.885 . . . . 5.7800000000000002 111.557 -169.528 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 44.9 m -82.81 -38.11 23.56 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 123.365 0.666 . . . . 2.1699999999999999 112.536 166.125 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 72.0 mt -69.09 -51.1 42.19 Favored 'General case' 0 N--CA 1.454 -0.257 0 C-N-CA 125.391 1.476 . . . . 1.9199999999999999 109.91 -172.733 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.5 t0 -72.74 73.35 1.09 Allowed 'General case' 0 N--CA 1.45 -0.461 0 N-CA-C 108.108 -1.071 . . . . 2.27 108.108 175.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 11.6 m -52.58 -40.86 35.16 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 C-N-CA 124.222 1.009 . . . . 2.7200000000000002 112.512 -170.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 22.6 p-10 -88.99 -2.79 58.75 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 112.317 0.488 . . . . 2.4700000000000002 112.317 179.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 7.0 tt0 58.07 55.08 5.44 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 125.001 1.32 . . . . 3.98 110.958 170.562 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 53.0 p30 -108.48 -3.24 18.31 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 125.667 1.587 . . . . 2.21 112.378 -177.219 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.8 m 80.35 0.05 1.96 Allowed 'General case' 0 CA--C 1.532 0.257 0 C-N-CA 126.66 1.984 . . . . 2.2000000000000002 113.511 -178.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -110.4 131.23 55.23 Favored 'General case' 0 N--CA 1.455 -0.219 0 CA-C-N 119.065 0.848 . . . . 3.0499999999999998 109.023 168.627 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -87.9 90.83 8.53 Favored 'General case' 0 N--CA 1.445 -0.684 0 N-CA-C 105.898 -1.89 . . . . 1.5900000000000001 105.898 161.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -52.94 148.78 7.22 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 119.568 1.076 . . . . 3.6299999999999999 108.25 169.26 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 31.1 p90 -38.78 -49.53 1.62 Allowed 'General case' 0 CA--C 1.536 0.413 0 CA-C-N 120.026 1.284 . . . . 4.9900000000000002 113.494 178.979 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.4 t-20 -66.46 -34.9 78.97 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 112.986 0.736 . . . . 2.2799999999999998 112.986 177.512 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.0 mt-10 -65.53 -55.31 18.48 Favored 'General case' 0 CA--C 1.528 0.134 0 CA-C-N 119.272 0.942 . . . . 2.6499999999999999 109.476 172.951 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . 0.412 ' CD1' HD22 ' A' ' 33' ' ' LEU . 30.9 t80 -45.86 -51.63 12.69 Favored 'General case' 0 C--N 1.34 0.161 0 C-N-CA 123.848 0.859 . . . . 3.1299999999999999 109.664 175.645 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.68 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 2.1 t-105 -45.89 -33.56 3.3 Favored 'General case' 0 N--CA 1.452 -0.371 0 CA-C-O 117.41 -1.281 . . . . 4.3399999999999999 112.275 178.967 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 2.4 ttt180 -40.64 -47.97 2.84 Favored 'General case' 0 N--CA 1.47 0.556 0 CA-C-N 120.237 1.381 . . . . 6.0300000000000002 110.471 171.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 28.0 tp -41.7 -50.34 4.23 Favored 'General case' 0 N--CA 1.446 -0.638 0 C-N-CA 124.528 1.131 . . . . 1.47 111.524 176.132 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 85.5 mt -62.51 -30.7 49.76 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 N-CA-C 108.888 -0.782 . . . . 1.79 108.888 -172.271 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.543 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -74.67 -44.97 24.19 Favored Glycine 0 CA--C 1.491 -1.435 0 N-CA-C 109.996 -1.242 . . . . 1.3600000000000001 109.996 176.447 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -61.21 -31.03 70.8 Favored 'General case' 0 N--CA 1.436 -1.134 0 N-CA-C 107.752 -1.203 . . . . 2.1000000000000001 107.752 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 5.6 mt -71.08 -56.86 5.24 Favored 'General case' 0 CA--C 1.53 0.21 0 CA-C-N 119.266 0.939 . . . . 2.1899999999999999 110.826 172.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.45 -24.75 47.63 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 123.963 0.905 . . . . 1.3200000000000001 111.856 -179.534 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -80.41 -61.01 2.11 Favored 'General case' 0 N--CA 1.445 -0.707 0 C-N-CA 126.709 2.004 . . . . 1.5700000000000001 109.013 171.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -50.39 -40.92 51.13 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 124.978 1.311 . . . . 2.5499999999999998 111.237 -176.347 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 10.0 tt -54.85 -34.57 31.11 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.738 0 O-C-N 120.671 -1.268 . . . . 1.3700000000000001 112.345 177.071 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 2.1 tmt_? -93.07 -62.56 1.36 Allowed 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 125.46 1.504 . . . . 4.8600000000000003 108.588 -179.466 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 57.3 tttp -73.79 74.93 1.59 Allowed 'General case' 0 C--O 1.222 -0.377 0 C-N-CA 125.491 1.516 . . . . 4.0599999999999996 108.422 168.079 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . 0.495 65.5 mttt -37.34 -3.55 0.0 OUTLIER 'General case' 0 CA--C 1.551 0.996 1 C-N-CA 132.501 4.32 . . . . 10.65 121.606 -176.207 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . 0.289 1.5 tmtm? 118.24 -0.79 0.0 OUTLIER 'General case' 0 N--CA 1.475 0.819 1 C-N-CA 133.919 4.888 . . . . 10.029999999999999 109.652 179.001 . . . . . . . . 3 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.8 OUTLIER -61.24 72.03 0.01 OUTLIER 'General case' 0 N--CA 1.447 -0.588 0 C-N-CA 129.833 3.253 . . . . 5.7199999999999998 109.097 172.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 19.8 tp -115.8 -70.71 0.78 Allowed 'General case' 0 N--CA 1.45 -0.443 0 C-N-CA 126.006 1.722 . . . . 10.960000000000001 108.685 -177.188 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 61.4 mtpt -145.12 134.19 22.66 Favored 'General case' 0 N--CA 1.453 -0.281 0 N-CA-C 105.648 -1.982 . . . . 16.09 105.648 176.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 2.3 mp 69.01 138.77 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.613 0 C-N-CA 125.618 1.567 . . . . 14.56 109.566 -173.749 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -67.99 163.36 22.41 Favored 'General case' 0 CA--C 1.535 0.38 0 O-C-N 121.309 -0.869 . . . . 15.91 111.136 179.24 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . 0.417 ' HG2' ' HA ' ' A' ' 98' ' ' LYS 2.212 9.7 mtpp -179.73 138.34 0.13 Allowed 'General case' 0 CA--C 1.545 0.754 0 C-N-CA 128.414 2.686 . . . . 15.32 105.141 -152.295 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.42 ' H ' ' HD2' ' A' ' 98' ' ' LYS 2.39 0.2 OUTLIER . . . . . 0 C--O 1.257 1.489 2 C-N-CA 134.215 5.006 . . . . 12.68 110.412 4.016 . . . . . . . . 4 3 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.419 23.4 ptm . . . . . 0 CA--C 1.543 0.711 0 N-CA-C 112.185 0.439 . . . . 10.789999999999999 112.185 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.23 -165.15 0.07 Allowed 'General case' 0 N--CA 1.468 0.458 0 CA-C-N 119.249 0.931 . . . . 8.1300000000000008 111.727 170.041 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 103.92 107.68 0.01 OUTLIER 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 127.738 2.415 . . . . 5.1200000000000001 115.419 -179.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.432 ' HB3' ' CD ' ' B' ' 5' ' ' PRO 0.494 15.1 tt0 -157.56 -111.81 0.0 OUTLIER Pre-proline 0 CA--C 1.547 0.861 0 CA-C-O 115.475 -2.202 . . . . 6.2599999999999998 112.509 102.424 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . 0.432 ' CD ' ' HB3' ' B' ' 4' ' ' GLU . 91.8 Cg_endo -69.89 150.57 67.58 Favored 'Trans proline' 0 C--N 1.35 0.648 0 CA-C-N 124.038 2.478 . . . . 2.7200000000000002 111.669 -169.722 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 49.3 mt -120.97 -100.22 0.43 Allowed 'General case' 0 CA--C 1.547 0.839 0 N-CA-C 114.338 1.236 . . . . 2.6400000000000001 114.338 -162.402 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 2.0 t -166.28 -111.02 0.01 OUTLIER 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 120.944 1.702 . . . . 2.71 112.991 -166.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -125.28 -72.74 0.65 Allowed 'General case' 0 N--CA 1.468 0.436 0 C-N-CA 126.762 2.025 . . . . 2.3500000000000001 110.434 -179.345 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 5.9 mt -48.89 -49.51 39.42 Favored 'General case' 0 C--O 1.233 0.209 0 O-C-N 121.656 -0.653 . . . . 1.3200000000000001 110.798 175.59 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 7.7 mp0 -44.29 -52.74 7.3 Favored 'General case' 0 N--CA 1.442 -0.838 0 C-N-CA 124.185 0.994 . . . . 3.8900000000000001 112.515 171.287 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 1.7 mm-40 -57.38 -36.81 71.72 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 119.235 0.925 . . . . 4.6100000000000003 110.396 178.619 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 3.8 t -63.01 -50.14 71.9 Favored 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 122.947 0.499 . . . . 1.8600000000000001 110.606 178.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.3 2.6 pp -61.44 -35.24 65.37 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.375 0 O-C-N 121.335 -0.853 . . . . 0.94999999999999996 110.979 173.873 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.9 tm-20 -58.95 -57.78 11.57 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.874 -0.584 . . . . 3.1099999999999999 110.145 174.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.8 t -52.49 -38.54 59.71 Favored 'General case' 0 CA--C 1.54 0.592 0 CA-C-N 119.618 1.099 . . . . 1.3100000000000001 111.685 -170.756 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 26.2 m -73.93 -39.82 51.96 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.431 0 O-C-N 121.414 -0.804 . . . . 0.94999999999999996 111.492 175.499 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 38.4 t -57.73 -48.34 83.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.338 0 CA-C-N 119.092 0.86 . . . . 1.1000000000000001 111.015 173.339 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.1 t -64.38 -38.89 92.61 Favored 'General case' 0 CA--C 1.534 0.343 0 CA-C-N 119.567 1.076 . . . . 1.3200000000000001 110.856 177.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 85.8 m -58.16 -52.95 63.4 Favored 'General case' 0 CA--C 1.534 0.359 0 CA-C-N 120.022 1.283 . . . . 1.23 109.666 174.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -47.26 -54.76 10.07 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.208 1.003 . . . . 3.71 110.279 173.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 85.4 t80 -55.2 -46.47 75.87 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 124.809 1.244 . . . . 3.9100000000000001 111.329 -179.149 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 58.8 m -54.45 -44.27 72.36 Favored 'General case' 0 N--CA 1.456 -0.152 0 C-N-CA 123.403 0.681 . . . . 3.2000000000000002 110.052 178.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -68.04 -47.3 68.76 Favored 'General case' 0 C--O 1.223 -0.336 0 C-N-CA 120.457 -0.497 . . . . 3.0899999999999999 110.959 171.357 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.45 -30.68 65.21 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 125.77 1.628 . . . . 1.21 111.467 -170.147 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.16 -19.32 64.79 Favored 'General case' 0 N--CA 1.452 -0.327 0 CA-C-O 118.153 -0.927 . . . . 3.7799999999999998 112.665 179.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.456 ' HB3' ' HG3' ' B' ' 37' ' ' GLU . 2.3 tt0 -56.16 -68.13 0.24 Allowed 'General case' 0 N--CA 1.449 -0.479 0 CA-C-O 117.902 -1.047 . . . . 3.75 111.562 -160.753 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -90.16 -74.82 0.47 Allowed 'General case' 0 CA--C 1.53 0.194 0 N-CA-C 114.433 1.272 . . . . 4.4900000000000002 114.433 -162.847 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -90.77 160.16 27.37 Favored Glycine 0 N--CA 1.442 -0.924 0 C-N-CA 127.637 2.542 . . . . 1.8899999999999999 109.906 156.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 62.7 ttt180 36.56 104.95 0.0 OUTLIER 'General case' 0 C--O 1.237 0.42 0 N-CA-C 115.961 1.837 . . . . 5.2599999999999998 115.961 140.556 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 24.6 pttm -69.01 46.13 0.06 Allowed 'General case' 0 CA--C 1.546 0.795 0 C-N-CA 124.866 1.266 . . . . 3.4700000000000002 114.331 174.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 17.0 m-20 -128.29 -58.2 1.2 Allowed 'General case' 0 CA--C 1.527 0.076 0 C-N-CA 126.481 1.913 . . . . 3.5299999999999998 106.341 168.726 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 2.1 p -94.15 146.49 23.95 Favored 'General case' 0 C--O 1.244 0.779 0 C-N-CA 125.209 1.403 . . . . 2.21 112.463 -166.101 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -102.95 154.27 19.39 Favored 'General case' 0 N--CA 1.455 -0.19 0 C-N-CA 126.094 1.757 . . . . 2.1000000000000001 107.894 175.779 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 11.1 t -154.49 176.8 11.92 Favored 'General case' 0 N--CA 1.452 -0.374 0 N-CA-C 107.512 -1.292 . . . . 2.6099999999999999 107.512 169.105 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 11.3 p -84.47 53.74 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.227 0 CA-C-O 121.862 0.839 . . . . 2.73 111.188 -170.008 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.65 54.75 0.48 Allowed 'General case' 0 N--CA 1.452 -0.332 0 N-CA-C 105.895 -1.891 . . . . 2.5 105.895 149.153 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.456 ' HG3' ' HB3' ' B' ' 26' ' ' GLN . 1.8 tt0 -172.38 -52.61 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 126.292 1.837 . . . . 2.2200000000000002 106.532 -170.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.46 ' CZ ' HD13 ' B' ' 63' ' ' LEU . 3.7 t80 -55.96 -57.82 10.47 Favored 'General case' 0 N--CA 1.447 -0.606 0 CA-C-N 114.564 -1.198 . . . . 2.0299999999999998 109.771 173.375 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 63.2 tttm -56.22 -34.29 66.18 Favored 'General case' 0 N--CA 1.451 -0.382 0 CA-C-N 115.882 -0.599 . . . . 4.4299999999999997 111.302 -175.478 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 3.9 mm-40 -54.31 -38.25 65.75 Favored 'General case' 0 N--CA 1.449 -0.496 0 C-N-CA 123.337 0.655 . . . . 3.4500000000000002 110.765 -178.364 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 9.6 tt -67.15 -49.43 64.81 Favored 'General case' 0 C--O 1.235 0.334 0 N-CA-C 108.83 -0.804 . . . . 2.29 108.83 -175.19 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 10.7 m -70.27 -35.08 61.31 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.413 0 CA-C-N 115.295 -0.866 . . . . 0.93000000000000005 110.155 -174.054 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 86.7 m -69.93 -50.79 38.58 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 124.018 0.927 . . . . 0.93999999999999995 110.619 176.939 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 15.6 tt0 -75.65 -61.52 1.89 Allowed 'General case' 0 CA--C 1.531 0.222 0 C-N-CA 123.565 0.746 . . . . 2.4399999999999999 111.135 -169.696 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 5.6 mm-40 -80.79 -53.48 6.45 Favored 'General case' 0 C--O 1.227 -0.101 0 CA-C-O 121.343 0.592 . . . . 4.3899999999999997 109.715 -175.384 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -84.61 -16.37 0.23 Allowed Pre-proline 0 CA--C 1.541 0.633 1 N-CA-C 121.857 4.021 . . . . 2.4900000000000002 121.857 -144.985 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_endo -48.96 -43.22 36.38 Favored 'Trans proline' 0 C--N 1.349 0.576 0 CA-C-N 123.473 2.276 . . . . 3.1899999999999999 115.56 -149.387 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 65.4 t-80 -75.41 59.5 1.08 Allowed 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 118.938 0.79 . . . . 2.6200000000000001 110.669 173.432 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.566 HD23 ' HB2' ' B' ' 83' ' ' LEU . 10.3 tp -164.13 -91.57 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 125.209 1.404 . . . . 1.6699999999999999 107.227 175.414 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 80.5 mt -78.79 86.98 4.68 Favored 'General case' 0 N--CA 1.455 -0.22 0 O-C-N 120.968 -1.083 . . . . 2.0800000000000001 109.126 171.113 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.33 169.51 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 114.386 -1.279 . . . . 6.4199999999999999 111.566 153.041 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 15.1 m-20 88.78 5.12 0.19 Allowed 'General case' 0 N--CA 1.469 0.517 0 C-N-CA 127.446 2.299 . . . . 5.3200000000000003 112.025 178.783 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 24.7 m -50.6 -34.09 12.05 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 C-N-CA 123.96 0.904 . . . . 1.9299999999999999 112.543 -175.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -49.83 -33.62 20.45 Favored Glycine 0 CA--C 1.531 1.07 0 C-N-CA 124.623 1.106 . . . . 3.25 112.992 175.657 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 8.3 t -130.71 57.15 1.74 Allowed 'General case' 0 N--CA 1.455 -0.224 0 N-CA-C 108.444 -0.947 . . . . 3.9399999999999999 108.444 170.102 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.5 tm? -44.23 -39.18 4.25 Favored 'General case' 0 N--CA 1.451 -0.377 0 C-N-CA 124.645 1.178 . . . . 1.0600000000000001 109.878 167.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -30.81 -47.68 0.1 Allowed 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 128.331 2.653 . . . . 4.0599999999999996 113.134 168.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 45.6 tt0 -61.75 -52.47 64.08 Favored 'General case' 0 C--O 1.236 0.353 0 CA-C-O 121.073 0.464 . . . . 3.1699999999999999 110.505 179.672 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -57.97 -47.97 81.37 Favored 'General case' 0 N--CA 1.454 -0.253 0 N-CA-C 107.963 -1.125 . . . . 3.6000000000000001 107.963 177.618 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -50.15 -52.49 34.84 Favored 'General case' 0 CA--C 1.528 0.112 0 C-N-CA 123.464 0.706 . . . . 1.72 110.295 179.023 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 17.8 ttmm -60.13 -44.13 95.15 Favored 'General case' 0 CA--C 1.535 0.378 0 O-C-N 122.305 -0.247 . . . . 2.9399999999999999 110.911 178.717 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 16.1 m -63.22 -28.79 70.28 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.379 0.672 . . . . 2.29 112.394 178.863 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.46 HD13 ' CZ ' ' B' ' 38' ' ' PHE . 26.2 mt -80.04 -57.15 3.77 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.353 1.061 . . . . 1.1599999999999999 110.231 178.686 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 17.8 t0 -58.34 -9.76 1.72 Allowed 'General case' 0 C--O 1.222 -0.378 0 C-N-CA 126.96 2.104 . . . . 1.6299999999999999 116.487 -166.315 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . 0.403 HG13 ' H ' ' B' ' 65' ' ' VAL . 27.7 m -34.06 -19.47 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.631 0 C-N-CA 130.869 3.668 . . . . 1.5900000000000001 119.705 -140.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 7.8 p-10 -61.61 -22.71 65.48 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 121.314 1.87 . . . . 3.1200000000000001 111.397 162.076 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 30.9 mt-30 61.25 62.18 1.42 Allowed 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 125.979 1.712 . . . . 2.96 111.099 175.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 38.9 p30 -105.84 -15.94 14.79 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 125.662 1.585 . . . . 2.25 110.954 174.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 74.31 9.42 4.45 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.366 1.466 . . . . 2.6000000000000001 111.968 -173.3 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.5 tt0 -111.03 101.93 10.43 Favored 'General case' 0 N--CA 1.447 -0.592 0 N-CA-C 105.915 -1.883 . . . . 3.6499999999999999 105.915 171.098 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -75.66 108.93 8.84 Favored 'General case' 0 N--CA 1.45 -0.459 0 N-CA-C 106.653 -1.61 . . . . 1.0900000000000001 106.653 174.314 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 1.5 tpmt? -83.98 160.28 21.07 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.436 1.894 . . . . 4.1699999999999999 109.356 -176.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -86.05 52.68 2.55 Favored 'General case' 0 CA--C 1.538 0.506 0 O-C-N 121.775 -0.578 . . . . 4.2000000000000002 111.933 172.978 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -159.37 48.65 0.31 Allowed 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.881 -1.155 . . . . 2.2400000000000002 107.881 114.606 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 65.5 mt-10 -93.31 -61.72 1.51 Allowed 'General case' 0 N--CA 1.452 -0.34 0 C-N-CA 125.685 1.594 . . . . 2.1499999999999999 107.779 142.904 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 2.3 t80 -48.54 -46.05 38.28 Favored 'General case' 0 CA--C 1.516 -0.347 0 C-N-CA 125.816 1.646 . . . . 3.6899999999999999 111.011 -175.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.68 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 50.1 t90 -49.79 -36.48 26.41 Favored 'General case' 0 N--CA 1.447 -0.601 0 O-C-N 123.883 0.74 . . . . 3.5600000000000001 112.455 -169.812 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 99.0 mtt180 -42.24 -40.1 2.3 Favored 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 123.969 0.908 . . . . 4.3799999999999999 111.91 173.645 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 10.6 tp -53.59 -45.28 69.93 Favored 'General case' 0 N--CA 1.45 -0.472 0 C-N-CA 124.212 1.005 . . . . 0.82999999999999996 111.888 179.225 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 59.2 mt -64.3 -31.26 52.73 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.609 0 N-CA-C 107.211 -1.403 . . . . 1.46 107.211 178.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.559 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -64.59 -48.29 74.56 Favored Glycine 0 CA--C 1.492 -1.398 0 C-N-CA 125.894 1.711 . . . . 1.3300000000000001 112.079 178.487 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 4.3 mm-40 -66.59 -62.72 1.31 Allowed 'General case' 0 N--CA 1.425 -1.708 0 CA-C-O 117.294 -1.336 . . . . 2.3900000000000001 107.648 177.026 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.566 ' HB2' HD23 ' B' ' 49' ' ' LEU . 3.4 pp -54.47 -35.29 62.9 Favored 'General case' 0 CA--C 1.534 0.344 0 CA-C-N 120.48 1.491 . . . . 1.8300000000000001 113.041 -175.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.69 -61.63 2.38 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 118.347 0.522 . . . . 1.6399999999999999 110.435 170.394 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 5.9 ptpp? -65.96 -31.95 73.16 Favored 'General case' 0 C--O 1.22 -0.466 0 CA-C-O 117.763 -1.113 . . . . 1.6799999999999999 111.79 -171.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 21.3 mm-40 -42.73 -38.09 1.97 Allowed 'General case' 0 N--CA 1.466 0.346 0 C-N-CA 128.335 2.654 . . . . 2.7400000000000002 111.226 175.806 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 2.7 tt -50.56 -40.49 19.07 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.914 0 C-N-CA 122.622 0.369 . . . . 1.3100000000000001 110.216 177.099 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.4 -59.51 2.36 Favored 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 126.983 2.113 . . . . 5.2000000000000002 112.738 166.804 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 14.1 tttt -68.19 63.08 0.09 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 129.247 3.019 . . . . 6.8200000000000003 111.672 -172.022 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -80.94 -19.84 43.34 Favored 'General case' 0 CA--C 1.539 0.551 0 O-C-N 121.409 -0.807 . . . . 6.0199999999999996 111.05 169.053 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -108.19 -42.36 4.65 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.017 1.727 . . . . 10.51 110.699 -167.195 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 -79.03 72.46 5.55 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 124.909 1.284 . . . . 4.2800000000000002 111.357 -160.096 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 12.1 tp -104.05 -55.72 2.32 Favored 'General case' 0 N--CA 1.452 -0.371 0 C-N-CA 127.693 2.397 . . . . 7.3799999999999999 109.544 178.611 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 12.0 mttp -74.62 72.14 1.93 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.576 0.75 . . . . 9.2200000000000006 112.252 -170.435 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 2.3 pp -73.68 168.25 2.01 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.386 0 C-N-CA 123.044 0.537 . . . . 6.3499999999999996 110.567 167.529 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 2.7 tpm_? -163.52 166.24 22.8 Favored 'General case' 0 CA--C 1.535 0.373 0 N-CA-C 107.025 -1.472 . . . . 7.1799999999999997 107.025 -178.549 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 14.0 ptmm? -176.92 138.11 0.25 Allowed 'General case' 0 C--O 1.235 0.329 0 C-N-CA 126.372 1.869 . . . . 6.7699999999999996 108.381 178.607 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 14.7 tmtt? . . . . . 0 C--O 1.253 1.243 0 CA-C-O 117.486 -1.245 . . . . 10.140000000000001 107.767 159.636 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 51.8 mtt . . . . . 0 N--CA 1.473 0.725 0 N-CA-C 107.751 -1.203 . . . . 8.6199999999999992 107.751 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -67.88 -170.94 0.18 Allowed 'General case' 0 N--CA 1.456 -0.168 0 O-C-N 124.062 0.851 . . . . 4.04 110.24 163.289 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 102.37 80.29 0.0 OUTLIER 'General case' 0 N--CA 1.45 -0.428 0 C-N-CA 128.836 2.855 . . . . 3.2200000000000002 107.969 -159.527 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.7 pt-20 -81.78 147.45 58.75 Favored Pre-proline 0 N--CA 1.45 -0.427 0 C-N-CA 124.163 0.985 . . . . 5.3600000000000003 110.701 -173.658 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.24 103.62 1.43 Allowed 'Trans proline' 0 N--CA 1.449 -1.112 0 C-N-CA 122.761 2.308 . . . . 2.52 109.128 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 72.1 mt -61.41 152.82 28.67 Favored 'General case' 0 N--CA 1.454 -0.256 0 N-CA-C 108.124 -1.065 . . . . 1.3 108.124 169.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 13.4 t -71.25 173.51 7.64 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 119.867 -0.733 . . . . 1.77 109.564 179.233 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -65.45 -59.76 3.67 Favored 'General case' 0 N--CA 1.452 -0.349 0 O-C-N 121.536 -0.728 . . . . 3.0099999999999998 110.101 -171.937 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.6 mp -55.33 -42.26 73.55 Favored 'General case' 0 N--CA 1.453 -0.317 0 O-C-N 121.628 -0.67 . . . . 1.47 110.188 -176.817 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -53.25 -54.35 37.5 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 126.733 2.013 . . . . 2.1299999999999999 111.655 171.925 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -55.03 -49.94 70.31 Favored 'General case' 0 C--N 1.341 0.204 0 N-CA-C 108.877 -0.786 . . . . 5.4000000000000004 108.877 178.927 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.1 m -65.6 -46.85 77.78 Favored 'General case' 0 N--CA 1.451 -0.422 0 N-CA-C 111.765 0.283 . . . . 1.99 111.765 -175.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 pp -65.51 -34.77 72.65 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 O-C-N 120.969 -1.082 . . . . 0.91000000000000003 108.878 -178.969 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 -60.3 -55.0 38.99 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-N 118.864 0.757 . . . . 2.9900000000000002 109.351 170.118 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -51.53 -40.1 58.99 Favored 'General case' 0 CA--C 1.541 0.622 0 C-N-CA 123.857 0.863 . . . . 1.1299999999999999 111.686 -174.48 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 6.2 m -74.8 -41.18 47.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.428 0 O-C-N 120.971 -1.081 . . . . 0.70999999999999996 111.4 173.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 40.2 t -57.53 -48.24 83.45 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.241 0 CA-C-N 119.588 1.085 . . . . 0.70999999999999996 111.535 177.384 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -59.32 -43.1 92.73 Favored 'General case' 0 CA--C 1.536 0.436 0 CA-C-N 119.666 1.121 . . . . 0.63 110.455 178.126 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 60.1 m -59.22 -54.71 43.78 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.179 0.514 . . . . 0.72999999999999998 109.78 176.886 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.421 ' CE2' HD23 ' A' ' 33' ' ' LEU . 2.2 t80 -44.15 -52.15 7.53 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 124.994 1.318 . . . . 3.0699999999999998 110.676 171.144 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 26.9 t80 -66.2 -49.35 67.6 Favored 'General case' 0 C--O 1.233 0.208 0 C-N-CA 124.908 1.283 . . . . 2.79 110.691 -171.486 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.5 t -62.91 -36.95 85.07 Favored 'General case' 0 CA--C 1.534 0.339 0 N-CA-C 110.093 -0.336 . . . . 2.1000000000000001 110.093 -179.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 41.2 m-85 -64.52 -48.17 76.11 Favored 'General case' 0 C--O 1.217 -0.623 0 CA-C-N 118.539 0.608 . . . . 2.6099999999999999 111.236 169.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -52.76 -35.37 56.25 Favored 'General case' 0 C--N 1.327 -0.403 0 C-N-CA 125.235 1.414 . . . . 0.83999999999999997 110.998 -171.695 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 63.4 ttt180 -59.16 -34.29 71.93 Favored 'General case' 0 N--CA 1.449 -0.508 0 C-N-CA 126.427 1.891 . . . . 5.5300000000000002 112.818 177.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -46.17 -61.63 1.69 Allowed 'General case' 0 CA--C 1.537 0.469 0 CA-C-N 119.451 1.023 . . . . 2.3399999999999999 112.738 -167.054 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -104.92 114.02 27.97 Favored 'General case' 0 N--CA 1.443 -0.795 0 C-N-CA 128.524 2.73 . . . . 2.9199999999999999 106.375 177.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 40.17 99.99 0.01 OUTLIER Glycine 0 CA--C 1.533 1.204 0 C-N-CA 126.36 1.933 . . . . 1.76 116.432 162.232 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 90.7 mtt180 72.93 106.47 0.07 Allowed 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 123.554 0.742 . . . . 4.8700000000000001 112.899 168.744 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 61.0 pttt -66.59 18.78 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 115.913 1.82 . . . . 4.54 115.913 178.865 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.3 p-10 -89.16 -34.32 16.74 Favored 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 124.816 1.246 . . . . 4.2599999999999998 109.53 162.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.7 p -83.86 128.6 34.65 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.471 1.109 . . . . 3.2000000000000002 110.834 -171.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.421 HD23 ' CE2' ' A' ' 20' ' ' PHE . 2.7 mm? -86.09 123.6 31.58 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 107.338 -1.356 . . . . 1.98 107.338 151.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 15.1 m -109.53 176.05 5.22 Favored 'General case' 0 N--CA 1.446 -0.64 0 C-N-CA 126.318 1.847 . . . . 3.71 109.074 -171.935 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 71.4 t -63.69 -49.65 81.33 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.27 0 O-C-N 121.814 -0.554 . . . . 2.6899999999999999 111.519 -167.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 4.9 t30 -70.12 -48.89 55.65 Favored 'General case' 0 N--CA 1.453 -0.303 0 N-CA-C 108.272 -1.01 . . . . 2.2799999999999998 108.272 -176.612 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 89.6 mt-10 -42.67 -53.54 4.44 Favored 'General case' 0 N--CA 1.461 0.094 0 C-N-CA 124.672 1.189 . . . . 1.8100000000000001 112.343 173.682 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.6 OUTLIER -51.01 -56.05 14.41 Favored 'General case' 0 N--CA 1.452 -0.328 0 N-CA-C 109.184 -0.673 . . . . 2.4500000000000002 109.184 176.892 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 30.4 ttmt -58.61 -39.1 79.49 Favored 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 120.283 -0.567 . . . . 2.7799999999999998 111.766 -179.123 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -54.55 -38.85 67.11 Favored 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.615 0.643 . . . . 3.2000000000000002 111.755 176.302 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -61.07 -54.03 49.77 Favored 'General case' 0 C--O 1.232 0.17 0 N-CA-C 107.582 -1.266 . . . . 2.48 107.582 -177.173 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 16.4 m -68.98 -40.88 81.49 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.521 0 CA-C-N 114.581 -1.19 . . . . 1.1399999999999999 109.852 -170.245 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 98.1 m -59.99 -51.91 67.65 Favored 'General case' 0 N--CA 1.449 -0.5 0 C-N-CA 124.197 0.999 . . . . 1.8999999999999999 110.61 174.811 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -74.16 -57.18 4.13 Favored 'General case' 0 N--CA 1.452 -0.326 0 C-N-CA 122.425 0.29 . . . . 3.23 110.976 -170.375 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 -136.43 68.11 1.44 Allowed 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 122.669 0.387 . . . . 4.0700000000000003 111.907 -177.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.3 tp -155.9 56.32 1.28 Allowed Pre-proline 0 CA--C 1.54 0.562 0 O-C-N 121.538 -0.727 . . . . 1.8 111.062 161.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.1 Cg_endo -63.34 -61.12 0.14 Allowed 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 123.835 3.023 . . . . 1.8500000000000001 112.715 -170.526 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.7 OUTLIER -84.64 -51.62 6.71 Favored 'General case' 0 C--O 1.236 0.387 0 CA-C-N 119.351 0.978 . . . . 3.9100000000000001 110.38 -172.261 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -31.9 -62.3 0.21 Allowed 'General case' 0 C--O 1.234 0.28 0 C-N-CA 126.402 1.881 . . . . 1.54 113.506 -172.469 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.5 mt -125.59 54.5 1.48 Allowed 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 125.047 1.339 . . . . 2.0600000000000001 108.399 -179.097 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.75 3.6 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.635 0 N-CA-C 116.913 2.19 . . . . 5.1399999999999997 116.913 -175.145 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 72.0 m-20 -109.04 46.3 0.99 Allowed 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 125.543 1.537 . . . . 4.7999999999999998 107.331 178.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.9 m -55.85 -17.52 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.28 0 C-N-CA 125.766 1.627 . . . . 2.0699999999999998 112.567 -176.361 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -44.43 -44.91 8.22 Favored Glycine 0 CA--C 1.532 1.135 0 N-CA-C 110.912 -0.875 . . . . 1.4299999999999999 110.912 167.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.7 t -91.84 31.55 1.22 Allowed 'General case' 0 CA--C 1.537 0.475 0 CA-C-N 117.213 0.507 . . . . 2.25 112.088 -178.25 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.402 HD13 ' C ' ' A' ' 56' ' ' LEU . 3.0 tm? -52.61 -43.75 65.58 Favored 'General case' 0 N--CA 1.449 -0.478 0 O-C-N 121.419 -0.801 . . . . 1.3400000000000001 109.21 168.118 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -39.9 -57.35 1.61 Allowed 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.982 1.313 . . . . 3.5499999999999998 111.565 170.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 35.2 tp10 -60.12 -51.33 70.05 Favored 'General case' 0 N--CA 1.447 -0.603 0 CA-C-N 116.485 -0.325 . . . . 5.2599999999999998 110.253 -178.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -56.92 -39.88 75.28 Favored 'General case' 0 N--CA 1.447 -0.598 0 C-N-CA 118.92 -1.112 . . . . 6.3600000000000003 110.628 -179.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -57.3 -57.4 12.81 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 122.848 0.459 . . . . 1.51 110.673 176.277 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -62.13 -33.48 74.56 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 120.394 -0.522 . . . . 4.0 111.218 -176.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 8.3 t -59.45 -50.93 72.03 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 125.289 1.436 . . . . 1.79 110.997 172.102 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.8 mp -63.76 -50.09 70.4 Favored 'General case' 0 C--O 1.239 0.547 0 O-C-N 121.385 -0.822 . . . . 1.75 111.562 179.631 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 25.5 t0 -80.07 71.5 6.8 Favored 'General case' 0 N--CA 1.452 -0.37 0 C-N-CA 121.0 -0.28 . . . . 1.72 110.478 -167.369 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.8 m -49.53 -40.36 14.78 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.41 0 C-N-CA 124.644 1.177 . . . . 2.0600000000000001 113.525 -174.274 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 9.1 p30 -82.5 -8.64 59.61 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 123.519 0.728 . . . . 1.8999999999999999 112.504 178.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 55.92 50.39 14.03 Favored 'General case' 0 CA--C 1.534 0.365 0 C-N-CA 125.766 1.626 . . . . 3.4199999999999999 110.426 168.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 32.5 p30 -100.49 -12.46 19.3 Favored 'General case' 0 CA--C 1.536 0.414 0 C-N-CA 125.766 1.626 . . . . 2.0099999999999998 110.96 179.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 20.7 m 72.43 17.41 4.76 Favored 'General case' 0 N--CA 1.455 -0.204 0 C-N-CA 125.893 1.677 . . . . 1.5700000000000001 111.864 -179.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.2 tt0 -116.06 113.26 22.94 Favored 'General case' 0 N--CA 1.446 -0.673 0 N-CA-C 106.11 -1.811 . . . . 3.96 106.11 163.792 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -83.82 89.07 7.12 Favored 'General case' 0 N--CA 1.451 -0.403 0 N-CA-C 104.543 -2.391 . . . . 1.05 104.543 173.38 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 5.9 tttp -75.87 158.04 32.58 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.921 -0.77 . . . . 4.8300000000000001 108.921 -176.15 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -38.63 -61.07 0.75 Allowed 'General case' 0 CA--C 1.54 0.589 0 N-CA-C 114.099 1.148 . . . . 4.7599999999999998 114.099 -163.551 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 2.7 t30 -69.23 -26.55 64.85 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 121.684 -0.635 . . . . 2.2599999999999998 112.209 -177.156 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 64.1 mt-10 -68.52 -59.69 2.97 Favored 'General case' 0 N--CA 1.453 -0.311 0 N-CA-C 108.639 -0.874 . . . . 2.0699999999999998 108.639 171.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -56.37 -38.84 71.99 Favored 'General case' 0 CA--C 1.516 -0.365 0 CA-C-O 118.786 -0.626 . . . . 3.2799999999999998 111.057 -175.855 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.495 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.1 OUTLIER -38.19 -45.19 0.92 Allowed 'General case' 0 C--O 1.221 -0.402 0 CA-C-O 116.609 -1.662 . . . . 5.5599999999999996 107.85 174.75 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 48.3 mtm-85 -38.55 -44.96 1.01 Allowed 'General case' 0 C--O 1.22 -0.496 0 CA-C-N 120.85 1.659 . . . . 5.9000000000000004 112.529 -179.036 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 23.5 tp -52.05 -56.97 11.01 Favored 'General case' 0 CA--C 1.531 0.239 0 CA-C-N 120.593 1.542 . . . . 0.98999999999999999 111.75 174.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 19.1 mm -59.44 -38.97 77.87 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.166 0 C-N-CA 126.403 1.881 . . . . 1.8700000000000001 108.245 -179.172 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -50.58 -56.88 11.7 Favored Glycine 0 N--CA 1.437 -1.245 0 N-CA-C 108.497 -1.841 . . . . 1.9299999999999999 108.497 172.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -63.51 -49.67 72.62 Favored 'General case' 0 N--CA 1.438 -1.056 0 C-N-CA 125.804 1.642 . . . . 2.6499999999999999 108.617 -171.906 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 21.5 mt -42.34 -53.53 4.14 Favored 'General case' 0 CA--C 1.536 0.438 0 CA-C-N 119.451 1.023 . . . . 2.0 112.12 -173.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.32 -35.18 62.4 Favored 'General case' 0 CA--C 1.533 0.292 0 C-N-CA 124.97 1.308 . . . . 1.29 112.665 179.622 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 21.4 ttpp -77.7 -51.25 10.88 Favored 'General case' 0 N--CA 1.452 -0.35 0 O-C-N 121.461 -0.774 . . . . 1.79 110.233 172.958 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 52.6 mm-40 -60.99 -30.74 70.46 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.059 0.943 . . . . 4.1699999999999999 112.243 -171.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 5.2 tt -56.61 -40.21 67.62 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.437 0 CA-C-N 119.046 0.839 . . . . 1.29 110.736 170.473 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -74.92 -55.52 5.69 Favored 'General case' 0 N--CA 1.452 -0.327 0 N-CA-C 108.422 -0.955 . . . . 4.9800000000000004 108.422 179.768 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 3.8 tttm -85.11 47.33 1.39 Allowed 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 126.617 1.967 . . . . 3.5899999999999999 109.897 -170.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -41.61 -56.99 2.41 Favored 'General case' 0 C--O 1.232 0.159 0 C-N-CA 124.574 1.15 . . . . 7.0199999999999996 113.388 -163.954 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 62.5 mttt -156.47 53.85 0.54 Allowed 'General case' 0 CA--C 1.533 0.318 0 N-CA-C 105.565 -2.013 . . . . 8.9800000000000004 105.565 163.885 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -75.43 61.35 1.25 Allowed 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 125.415 1.486 . . . . 5.1500000000000004 112.085 -165.74 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 1.1 pt? -164.45 26.07 0.07 Allowed 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.353 1.061 . . . . 8.9299999999999997 111.402 174.001 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 5.6 ptpt 177.15 -170.2 0.08 Allowed 'General case' 0 CA--C 1.534 0.358 0 C-N-CA 126.071 1.748 . . . . 11.029999999999999 107.911 -176.269 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 0.402 11.3 tt 49.25 -129.14 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.517 0 CA-C-O 116.331 -1.795 . . . . 8.9100000000000001 110.799 -167.964 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 98.6 mtt180 -122.98 -67.1 0.97 Allowed 'General case' 0 C--N 1.342 0.28 0 CA-C-N 122.313 2.324 . . . . 13.470000000000001 111.768 -172.382 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 49.5 mtmt -175.85 48.81 0.01 OUTLIER 'General case' 0 N--CA 1.464 0.233 0 C-N-CA 128.194 2.598 . . . . 12.18 105.137 -167.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . 2.438 35.1 tttm . . . . . 0 C--O 1.259 1.599 0 N-CA-C 104.148 -2.538 . . . . 11.640000000000001 104.148 -142.55 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.475 0.788 0 N-CA-C 109.092 -0.707 . . . . 6.0300000000000002 109.092 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.432 . . 76.21 -159.0 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.355 0 N-CA-C 109.588 -0.523 . . . . 4.2199999999999998 109.588 -169.939 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.58 93.31 0.01 OUTLIER 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 128.458 2.703 . . . . 4.9299999999999997 110.222 -176.722 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.518 ' HB3' ' CD ' ' B' ' 5' ' ' PRO 0.271 30.8 tt0 -102.54 -97.12 0.0 OUTLIER Pre-proline 0 CA--C 1.553 1.078 0 CA-C-O 116.639 -1.648 . . . . 6.2199999999999998 111.902 -171.114 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . 0.518 ' CD ' ' HB3' ' B' ' 4' ' ' GLU . 62.4 Cg_endo -79.25 156.21 25.74 Favored 'Trans proline' 0 C--N 1.352 0.72 0 CA-C-N 123.92 2.436 . . . . 2.8300000000000001 111.085 -177.391 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 53.2 mt -140.75 163.7 32.19 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 124.638 1.175 . . . . 2.71 110.474 -166.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 14.0 t -94.39 -167.98 1.76 Allowed 'General case' 0 N--CA 1.467 0.389 0 C-N-CA 124.642 1.177 . . . . 1.8200000000000001 108.971 164.389 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 42.4 tt0 -71.83 -63.74 1.07 Allowed 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.598 0.759 . . . . 2.5299999999999998 112.765 -169.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 28.0 mt -50.77 -51.32 51.49 Favored 'General case' 0 N--CA 1.47 0.541 0 CA-C-N 120.62 1.554 . . . . 1.1599999999999999 111.26 173.481 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 7.7 tt0 -51.98 -41.37 62.08 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 127.897 2.479 . . . . 3.3900000000000001 110.416 -179.833 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.8 tp10 -64.73 -58.57 5.9 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 125.203 1.401 . . . . 4.3499999999999996 110.437 171.162 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 86.0 p -53.89 -36.07 62.28 Favored 'General case' 0 CA--C 1.537 0.479 0 O-C-N 121.409 -0.807 . . . . 1.3500000000000001 112.292 -172.447 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.7 pp -71.9 -32.95 46.22 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.296 0 O-C-N 121.952 -0.467 . . . . 1.0700000000000001 112.185 174.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.9 OUTLIER -62.97 -54.11 43.52 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-N 119.261 0.937 . . . . 3.6299999999999999 109.047 170.503 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.2 m -38.75 -51.69 1.7 Allowed 'General case' 0 CA--C 1.545 0.75 0 C-N-CA 124.498 1.119 . . . . 2.3100000000000001 111.663 -178.64 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 34.2 m -70.57 -39.46 76.08 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.432 0 O-C-N 121.098 -1.002 . . . . 0.85999999999999999 111.99 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 55.6 t -57.1 -54.11 34.52 Favored 'Isoleucine or valine' 0 C--N 1.339 0.114 0 CA-C-N 118.655 0.661 . . . . 1.1599999999999999 109.859 174.842 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 9.0 t -59.24 -46.42 88.53 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 118.47 0.577 . . . . 1.0900000000000001 110.798 -179.56 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 96.7 m -55.26 -51.52 66.37 Favored 'General case' 0 CA--C 1.534 0.349 0 O-C-N 121.014 -1.054 . . . . 1.1699999999999999 110.627 174.784 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.8 m-85 -51.47 -47.2 63.25 Favored 'General case' 0 CA--C 1.534 0.352 0 O-C-N 121.67 -0.644 . . . . 6.8899999999999997 111.442 173.795 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 80.7 t80 -57.68 -48.36 79.76 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.586 1.154 . . . . 2.6099999999999999 111.227 -179.235 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 81.4 p -57.27 -37.44 72.37 Favored 'General case' 0 CA--C 1.533 0.292 0 O-C-N 121.767 -0.583 . . . . 2.0899999999999999 111.143 178.482 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 10.9 m-85 -72.44 -40.67 66.89 Favored 'General case' 0 C--O 1.221 -0.422 0 CA-C-N 118.145 0.43 . . . . 3.1800000000000002 110.568 173.026 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -51.73 -37.56 51.54 Favored 'General case' 0 CA--C 1.515 -0.402 0 C-N-CA 125.868 1.667 . . . . 1.0900000000000001 110.025 -176.43 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 1.4 ppt_? -55.18 -29.72 58.44 Favored 'General case' 0 N--CA 1.453 -0.29 0 CA-C-O 118.081 -0.962 . . . . 4.0300000000000002 112.088 -178.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.431 ' HB2' ' HG2' ' B' ' 37' ' ' GLU . 0.0 OUTLIER -51.73 -65.61 0.53 Allowed 'General case' 0 N--CA 1.449 -0.492 0 N-CA-C 114.786 1.402 . . . . 1.8600000000000001 114.786 -151.921 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 54.2 mt-10 -91.02 -77.35 0.42 Allowed 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 119.082 -1.047 . . . . 3.98 113.521 -166.024 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.71 159.27 24.68 Favored Glycine 0 C--N 1.337 0.593 0 C-N-CA 127.279 2.371 . . . . 1.8899999999999999 109.86 153.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 80.4 mtt-85 49.51 102.91 0.01 OUTLIER 'General case' 0 C--O 1.242 0.706 0 N-CA-C 115.127 1.529 . . . . 3.7599999999999998 115.127 142.043 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 59.3 pttt -67.99 32.62 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.775 2.03 . . . . 3.1600000000000001 114.473 173.444 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -144.41 -58.47 0.37 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 106.911 -1.515 . . . . 4.1200000000000001 106.911 -164.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 32.4 p -79.18 111.68 15.64 Favored 'General case' 0 N--CA 1.438 -1.042 0 N-CA-C 107.345 -1.354 . . . . 2.02 107.345 168.6 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -57.55 135.16 56.62 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 106.993 -1.484 . . . . 1.96 106.993 162.061 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 13.0 m -109.65 152.36 25.68 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.84 1.256 . . . . 3.4700000000000002 108.952 -174.21 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 10.4 p -87.6 49.15 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 O-C-N 120.254 -1.529 . . . . 2.3999999999999999 110.83 -179.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 9.6 t30 -157.75 52.71 0.46 Allowed 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 106.08 -1.822 . . . . 2.1800000000000002 106.08 138.639 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.431 ' HG2' ' HB2' ' B' ' 26' ' ' GLN . 70.2 mt-10 -131.74 -49.32 0.96 Allowed 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 130.963 3.705 . . . . 1.73 105.233 161.958 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -50.28 -57.16 8.47 Favored 'General case' 0 C--N 1.343 0.312 0 C-N-CA 120.506 -0.478 . . . . 2.9100000000000001 110.09 171.587 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . 0.292 15.7 ttmt -59.73 -41.81 91.75 Favored 'General case' 0 C--N 1.343 0.296 0 CA-C-O 117.94 -1.029 . . . . 2.73 111.522 -178.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 73.9 mt-10 -50.5 -48.71 56.81 Favored 'General case' 0 C--O 1.225 -0.235 0 CA-C-N 119.461 1.028 . . . . 3.2599999999999998 110.267 173.365 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 tt -65.97 -46.58 77.55 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 108.507 -0.923 . . . . 1.73 108.507 -169.997 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.0 m -68.93 -44.41 81.54 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.36 0 C-N-CA 120.728 -0.389 . . . . 0.78000000000000003 110.294 -176.637 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 86.1 m -58.63 -50.27 74.45 Favored 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 123.567 0.747 . . . . 1.26 110.466 178.047 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 -80.14 -59.65 2.63 Favored 'General case' 0 N--CA 1.447 -0.582 0 C-N-CA 123.585 0.754 . . . . 2.0099999999999998 110.981 -169.286 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.2 mp0 -75.54 -50.58 15.22 Favored 'General case' 0 CA--C 1.528 0.134 0 N-CA-C 113.143 0.794 . . . . 3.23 113.143 -169.056 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER -55.08 -27.91 3.57 Favored Pre-proline 0 CA--C 1.539 0.523 0 N-CA-C 115.248 1.574 . . . . 1.79 115.248 -151.266 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -63.56 -12.1 29.4 Favored 'Trans proline' 0 CA--C 1.543 0.957 0 C-N-CA 121.824 -2.157 . . . . 2.3900000000000001 111.046 -68.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 35.2 t60 -113.64 -32.44 6.17 Favored 'General case' 0 C--N 1.344 0.347 0 C-N-CA 125.736 1.614 . . . . 2.5699999999999998 111.373 -174.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 23.3 tp -50.77 -51.99 45.09 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-N 118.399 0.545 . . . . 1.3700000000000001 110.22 -175.298 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 98.1 mt -99.89 140.77 33.62 Favored 'General case' 0 N--CA 1.45 -0.448 0 N-CA-C 105.694 -1.965 . . . . 2.1000000000000001 105.694 153.943 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -140.0 28.29 2.13 Favored 'General case' 0 CA--C 1.531 0.212 0 C-N-CA 126.756 2.022 . . . . 4.9800000000000004 108.273 -167.192 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -142.47 32.22 1.48 Allowed 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 125.858 1.663 . . . . 6.0999999999999996 108.562 -156.646 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 11.4 m -74.7 -10.58 13.8 Favored 'Isoleucine or valine' 0 C--O 1.235 0.307 0 C-N-CA 125.599 1.56 . . . . 1.7 112.711 -173.759 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -59.91 -65.32 3.48 Favored Glycine 0 CA--C 1.524 0.644 0 N-CA-C 107.165 -2.374 . . . . 2.4500000000000002 107.165 162.279 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 2.4 p -72.01 40.01 0.07 Allowed 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 127.016 2.126 . . . . 3.6899999999999999 112.724 175.986 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -64.26 -30.01 71.08 Favored 'General case' 0 N--CA 1.441 -0.887 0 O-C-N 120.986 -1.071 . . . . 1.23 108.205 165.876 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -50.1 -52.78 32.04 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.942 -0.551 . . . . 4.5 110.302 173.823 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 35.4 tt0 -47.17 -59.5 3.11 Favored 'General case' 0 C--N 1.342 0.244 0 C-N-CA 124.023 0.929 . . . . 3.2999999999999998 109.351 175.376 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 7.6 mmpt? -60.75 -51.38 69.57 Favored 'General case' 0 N--CA 1.448 -0.554 0 CA-C-N 116.047 -0.524 . . . . 4.6900000000000004 109.752 -172.234 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.5 ttp -56.0 -47.05 78.46 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 123.259 0.624 . . . . 2.0800000000000001 110.419 -179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 21.8 ttpt -60.62 -40.8 93.2 Favored 'General case' 0 CA--C 1.537 0.447 0 C-N-CA 124.738 1.215 . . . . 4.1299999999999999 110.355 179.257 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 20.0 m -71.43 -31.21 66.95 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.868 0.867 . . . . 1.48 112.269 175.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 22.2 mt -73.04 -55.33 6.67 Favored 'General case' 0 CA--C 1.533 0.308 0 C-N-CA 123.988 0.915 . . . . 1.52 109.54 179.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . 0.411 ' O ' ' N ' ' B' ' 66' ' ' ASN . 23.8 t70 -71.04 -10.45 59.77 Favored 'General case' 0 CA--C 1.531 0.233 0 C-N-CA 127.628 2.371 . . . . 1.55 116.892 -161.162 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 24.7 m -33.26 -17.51 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 C-N-CA 131.626 3.971 . . . . 1.6899999999999999 119.36 -142.222 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . 0.411 ' N ' ' O ' ' B' ' 64' ' ' ASP . 2.3 m120 -40.63 -43.69 1.97 Allowed 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 119.831 1.196 . . . . 2.27 110.559 151.366 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 32.0 mt-30 65.53 61.16 0.7 Allowed 'General case' 0 CA--C 1.533 0.294 0 C-N-CA 125.324 1.45 . . . . 2.8599999999999999 109.677 -170.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 18.0 p30 -119.63 -16.45 8.83 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 127.059 2.144 . . . . 2.27 113.0 179.69 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 8.2 t 74.44 5.24 4.55 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 126.384 1.874 . . . . 3.3999999999999999 114.47 -178.7 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 20.6 mt-10 -106.21 109.72 21.74 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 124.991 1.316 . . . . 3.52 107.791 166.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -90.63 89.36 7.5 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 123.681 0.792 . . . . 1.27 108.918 -179.015 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 3.3 ttpp -84.79 177.48 7.99 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 128.082 2.553 . . . . 3.5299999999999998 112.08 -171.552 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 57.7 m-85 -82.03 53.42 2.21 Favored 'General case' 0 CA--C 1.546 0.8 0 O-C-N 120.493 -1.38 . . . . 4.4800000000000004 113.869 -168.314 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 4.4 t30 -168.19 51.62 0.05 Allowed 'General case' 0 N--CA 1.469 0.511 0 CA-C-O 124.841 2.258 . . . . 2.6000000000000001 106.12 122.624 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 11.2 mt-10 -95.6 -63.25 1.18 Allowed 'General case' 0 N--CA 1.434 -1.231 0 C-N-CA 126.93 2.092 . . . . 2.0699999999999998 108.815 150.576 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 15.9 p90 -68.8 -26.34 65.14 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 114.308 -1.315 . . . . 6.5099999999999998 112.824 -165.409 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.504 ' C ' ' CD1' ' B' ' 77' ' ' TRP . 0.0 OUTLIER -45.13 -50.1 11.46 Favored 'General case' 0 C--N 1.347 0.472 0 N-CA-C 107.58 -1.267 . . . . 4.7800000000000002 107.58 170.7 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 75.5 mtm-85 -48.12 -36.41 13.27 Favored 'General case' 0 C--O 1.219 -0.537 0 CA-C-O 117.203 -1.379 . . . . 6.0199999999999996 113.402 -165.054 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 5.4 tp -53.63 -51.42 63.16 Favored 'General case' 0 C--O 1.223 -0.328 0 CA-C-N 120.923 1.692 . . . . 0.98999999999999999 111.299 174.733 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 24.5 mt -63.74 -40.18 88.09 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 C-N-CA 126.045 1.738 . . . . 1.4199999999999999 107.587 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -45.27 -54.79 7.04 Favored Glycine 0 N--CA 1.443 -0.85 0 N-CA-C 108.891 -1.683 . . . . 1.9399999999999999 108.891 171.51 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . 0.411 ' OE2' ' NZ ' ' B' ' 85' ' ' LYS . 1.1 mm-40 -68.0 -53.71 23.97 Favored 'General case' 0 N--CA 1.437 -1.077 0 C-N-CA 125.964 1.706 . . . . 2.1800000000000002 109.004 -172.812 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 18.3 mt -40.31 -49.18 2.74 Favored 'General case' 0 N--CA 1.463 0.224 0 C-N-CA 125.18 1.392 . . . . 2.2400000000000002 111.401 -177.104 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -47.1 -45.17 21.89 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 123.489 0.716 . . . . 1.6599999999999999 111.687 177.241 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . 0.411 ' NZ ' ' OE2' ' B' ' 82' ' ' GLU . 0.7 OUTLIER -81.06 -37.98 28.14 Favored 'General case' 0 CA--C 1.541 0.618 0 N-CA-C 112.651 0.612 . . . . 1.3899999999999999 112.651 172.324 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 24.4 mm-40 -65.68 -21.14 66.52 Favored 'General case' 0 CA--C 1.535 0.392 0 CA-C-N 119.388 0.994 . . . . 3.2999999999999998 112.508 -172.388 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 1.9 tp -45.33 -45.31 3.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.695 0 O-C-N 120.92 -1.113 . . . . 1.28 109.217 165.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.4 -54.29 5.59 Favored 'General case' 0 C--O 1.238 0.456 0 C-N-CA 124.191 0.996 . . . . 6.0099999999999998 111.035 174.609 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 68.1 mttt -87.9 122.49 31.59 Favored 'General case' 0 C--O 1.219 -0.509 0 C-N-CA 125.454 1.502 . . . . 4.7300000000000004 112.072 -171.563 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 11.0 mptt -83.98 -36.93 22.84 Favored 'General case' 0 CA--C 1.531 0.235 0 O-C-N 120.494 -1.379 . . . . 7.8399999999999999 110.728 -176.283 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 20.3 pttp -148.89 -1.5 0.49 Allowed 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 124.692 1.197 . . . . 6.0700000000000003 111.72 -176.351 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 4.0 m-20 -97.68 53.54 1.13 Allowed 'General case' 0 N--CA 1.453 -0.314 0 O-C-N 121.527 -0.733 . . . . 5.5700000000000003 110.361 -138.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.419 ' HG ' ' N ' ' B' ' 94' ' ' LYS . 1.6 pt? -125.02 -73.87 0.63 Allowed 'General case' 0 CA--C 1.53 0.177 0 N-CA-C 113.333 0.864 . . . . 5.5700000000000003 113.333 -175.556 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . 0.419 ' N ' ' HG ' ' B' ' 93' ' ' LEU . 13.5 mptt 23.65 52.71 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 127.038 2.135 . . . . 8.8300000000000001 113.517 -161.127 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 20.0 tt -76.02 110.05 10.64 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.276 0 N-CA-C 109.207 -0.664 . . . . 8.7300000000000004 109.207 179.392 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -155.69 102.61 2.22 Favored 'General case' 0 CA--C 1.531 0.224 0 C-N-CA 123.326 0.651 . . . . 7.9199999999999999 109.447 -177.484 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 24.7 tptt -176.01 135.06 0.27 Allowed 'General case' 0 N--CA 1.456 -0.148 0 N-CA-C 106.845 -1.539 . . . . 6.79 106.845 -174.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 1.3 tmtm? . . . . . 0 C--O 1.254 1.298 0 N-CA-C 103.187 -2.894 . . . . 7.0099999999999998 103.187 168.22 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 65.1 mtt . . . . . 0 N--CA 1.472 0.638 0 N-CA-C 105.913 -1.884 . . . . 8.2799999999999994 105.913 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -69.11 167.81 15.3 Favored 'General case' 0 C--O 1.232 0.158 0 CA-C-N 118.932 0.787 . . . . 3.7200000000000002 109.245 164.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 89.32 57.73 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.253 0 C-N-CA 127.931 2.492 . . . . 4.5700000000000003 108.75 -171.32 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . 0.4 ' CD ' ' H ' ' A' ' 4' ' ' GLU . 1.7 pm0 -68.75 114.74 24.61 Favored Pre-proline 0 CA--C 1.538 0.489 0 C-N-CA 125.397 1.479 . . . . 4.3499999999999996 108.747 -175.213 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -75.77 105.48 2.09 Favored 'Trans proline' 0 N--CA 1.451 -1.015 0 C-N-CA 122.407 2.071 . . . . 3.0299999999999998 110.0 -173.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER -79.72 160.71 26.14 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 108.206 -1.035 . . . . 2.8199999999999998 108.206 168.427 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.456 HG23 ' H ' ' A' ' 10' ' ' GLU . 0.0 OUTLIER -64.15 154.99 32.99 Favored 'General case' 0 N--CA 1.467 0.417 0 O-C-N 121.056 -1.027 . . . . 2.8700000000000001 110.388 -174.812 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 38.7 mt-10 -33.47 -48.29 0.25 Allowed 'General case' 0 N--CA 1.456 -0.144 0 C-N-CA 125.287 1.435 . . . . 2.1099999999999999 112.297 160.666 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.2 mt -67.15 -45.01 78.35 Favored 'General case' 0 N--CA 1.447 -0.619 0 CA-C-O 118.257 -0.878 . . . . 1.27 110.223 -175.068 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.456 ' H ' HG23 ' A' ' 7' ' ' THR . 63.6 mt-10 -58.12 -53.35 59.24 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 125.519 1.527 . . . . 2.46 111.013 172.486 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 23.3 mm-40 -47.29 -60.35 2.55 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.366 1.066 . . . . 3.3599999999999999 109.017 176.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 60.4 p -60.67 -49.12 78.79 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 112.732 0.642 . . . . 1.3999999999999999 112.732 -177.347 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.254 2.4 pp -62.38 -38.79 82.13 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.219 0 O-C-N 120.854 -1.154 . . . . 0.58999999999999997 109.99 -177.074 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 22.1 tt0 -62.32 -48.79 78.28 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 119.736 -0.785 . . . . 3.3599999999999999 110.699 173.226 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -55.98 -40.66 73.63 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-O 121.755 0.788 . . . . 1.22 111.652 -176.953 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 14.8 m -75.2 -36.94 38.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 O-C-N 120.573 -1.329 . . . . 0.78000000000000003 111.088 176.417 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 27.4 t -56.42 -46.69 82.14 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.319 0 CA-C-N 119.592 1.087 . . . . 0.60999999999999999 110.648 174.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.3 t -64.76 -43.08 94.47 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 121.565 -0.709 . . . . 0.79000000000000004 110.877 178.435 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 30.8 m -57.55 -51.99 67.25 Favored 'General case' 0 CA--C 1.536 0.435 0 CA-C-N 118.487 0.585 . . . . 0.93000000000000005 110.068 176.88 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 19.2 t80 -45.74 -56.6 5.1 Favored 'General case' 0 C--O 1.226 -0.159 0 C-N-CA 124.052 0.941 . . . . 3.1899999999999999 109.883 170.456 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 40.4 t80 -53.14 -51.61 61.4 Favored 'General case' 0 C--O 1.233 0.229 0 C-N-CA 123.441 0.696 . . . . 3.5099999999999998 111.543 -175.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 13.9 t -60.38 -36.72 78.72 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 120.1 -0.64 . . . . 2.3999999999999999 111.571 -178.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 62.9 m-85 -69.92 -39.91 75.86 Favored 'General case' 0 C--O 1.222 -0.37 0 CA-C-N 119.901 1.228 . . . . 2.5 111.096 171.22 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -61.02 -31.7 71.32 Favored 'General case' 0 C--N 1.326 -0.415 0 O-C-N 121.072 -1.017 . . . . 1.1399999999999999 111.525 -168.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 3.4 ppt_? -80.02 -18.33 50.49 Favored 'General case' 0 CA--C 1.529 0.171 0 CA-C-O 117.494 -1.241 . . . . 4.1200000000000001 113.537 -178.6 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -45.24 -60.97 1.84 Allowed 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 119.848 1.204 . . . . 1.6899999999999999 113.787 -170.732 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -111.42 92.09 3.91 Favored 'General case' 0 C--O 1.244 0.777 0 C-N-CA 127.408 2.283 . . . . 2.9300000000000002 106.116 -177.848 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 46.14 -168.21 0.05 OUTLIER Glycine 0 CA--C 1.527 0.821 0 C-N-CA 125.697 1.618 . . . . 1.5900000000000001 112.693 179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 48.7 mtm-85 27.65 91.79 0.01 OUTLIER 'General case' 0 C--O 1.24 0.574 0 C-N-CA 126.456 1.902 . . . . 6.1600000000000001 112.525 166.282 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 15.9 pttp -79.6 53.28 1.55 Allowed 'General case' 0 C--O 1.232 0.142 0 C-N-CA 128.483 2.713 . . . . 4.4800000000000004 108.662 -172.683 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -175.51 -60.79 0.01 OUTLIER 'General case' 0 N--CA 1.45 -0.443 0 N-CA-C 106.945 -1.502 . . . . 4.0199999999999996 106.945 -156.404 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 36.2 p -84.52 134.12 34.44 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-O 122.34 1.066 . . . . 2.1499999999999999 112.141 170.671 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 71' ' ' LEU . 1.5 mm? -95.55 124.59 39.65 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 124.857 1.263 . . . . 2.4700000000000002 108.506 176.803 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 40.6 t -82.61 173.83 11.59 Favored 'General case' 0 CA--C 1.531 0.235 0 C-N-CA 125.355 1.462 . . . . 2.3300000000000001 109.058 173.252 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 32.9 m -70.21 -42.86 79.07 Favored 'Isoleucine or valine' 0 C--N 1.333 -0.126 0 O-C-N 122.014 -0.429 . . . . 2.9300000000000002 110.82 -175.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.1 t30 -67.45 -49.05 65.37 Favored 'General case' 0 C--O 1.223 -0.307 0 CA-C-O 118.272 -0.871 . . . . 1.8200000000000001 109.643 176.224 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -39.77 -50.64 2.37 Favored 'General case' 0 N--CA 1.465 0.299 0 C-N-CA 125.119 1.367 . . . . 2.2200000000000002 110.307 168.506 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -57.67 -59.11 5.69 Favored 'General case' 0 N--CA 1.446 -0.665 0 CA-C-N 115.861 -0.609 . . . . 2.6699999999999999 110.95 175.21 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 62.7 tttm -52.09 -42.17 63.02 Favored 'General case' 0 N--CA 1.449 -0.496 0 CA-C-N 116.522 -0.308 . . . . 3.4900000000000002 111.18 -176.095 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 71.0 mt-10 -51.89 -42.37 62.66 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 123.256 0.622 . . . . 3.1699999999999999 111.459 177.941 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -63.08 -50.14 71.73 Favored 'General case' 0 C--O 1.233 0.21 0 CA-C-N 119.303 0.956 . . . . 2.9500000000000002 108.788 -176.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 7.2 m -72.48 -32.24 41.08 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.168 0 CA-C-N 115.804 -0.635 . . . . 1.3400000000000001 110.3 -172.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 92.7 m -75.42 -38.71 59.67 Favored 'General case' 0 N--CA 1.45 -0.445 0 C-N-CA 124.169 0.987 . . . . 1.4099999999999999 110.735 178.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -79.86 -55.67 4.81 Favored 'General case' 0 N--CA 1.454 -0.231 0 C-N-CA 123.285 0.634 . . . . 2.1800000000000002 110.239 -173.127 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 5.0 tp-100 -92.47 -126.74 0.09 Allowed 'General case' 0 CA--C 1.54 0.59 0 N-CA-C 108.446 -0.946 . . . . 4.3300000000000001 108.446 179.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.447 HD22 ' H ' ' A' ' 46' ' ' LEU . 2.9 mm? 29.5 63.46 0.82 Allowed Pre-proline 0 CA--C 1.544 0.715 0 C-N-CA 127.578 2.351 . . . . 2.5 114.499 179.136 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 60.5 Cg_endo -71.58 -44.59 1.0 Allowed 'Trans proline' 0 N--CA 1.452 -0.934 0 C-N-CA 122.602 2.202 . . . . 1.74 112.298 -179.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 42.5 t-80 -146.05 61.36 1.25 Allowed 'General case' 0 C--N 1.341 0.233 0 CA-C-N 118.907 0.776 . . . . 3.3700000000000001 109.956 -172.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.497 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 3.8 tp -144.33 -113.67 0.1 Allowed 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 107.726 -1.213 . . . . 1.3600000000000001 107.726 -176.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 76.9 mt -59.0 162.12 4.49 Favored 'General case' 0 CA--C 1.531 0.222 0 CA-C-N 118.776 0.716 . . . . 2.2200000000000002 109.186 162.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.38 -159.13 0.56 Allowed 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 123.889 0.875 . . . . 6.4199999999999999 109.211 -166.018 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER 55.07 37.15 28.45 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 124.828 1.251 . . . . 3.77 108.866 -175.178 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -58.43 -24.42 24.98 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.335 0 C-N-CA 126.124 1.77 . . . . 3.1200000000000001 112.505 -167.679 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -61.93 -53.72 40.79 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 110.298 -1.121 . . . . 1.77 110.298 171.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 34.0 t -84.17 46.63 1.22 Allowed 'General case' 0 CA--C 1.53 0.177 0 C-N-CA 123.554 0.742 . . . . 2.29 110.098 -174.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -53.68 -32.54 52.12 Favored 'General case' 0 N--CA 1.448 -0.535 0 C-N-CA 124.07 0.948 . . . . 1.4399999999999999 110.116 -176.494 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -38.04 -47.72 1.13 Allowed 'General case' 0 N--CA 1.454 -0.24 0 C-N-CA 127.321 2.248 . . . . 3.71 113.158 175.329 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -64.21 -46.24 84.72 Favored 'General case' 0 CA--C 1.536 0.438 0 O-C-N 121.861 -0.524 . . . . 4.0199999999999996 109.992 -175.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.29 -52.66 63.78 Favored 'General case' 0 N--CA 1.451 -0.391 0 N-CA-C 108.037 -1.097 . . . . 3.4700000000000002 108.037 175.417 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -46.52 -56.72 5.57 Favored 'General case' 0 C--O 1.225 -0.196 0 C-N-CA 123.406 0.683 . . . . 1.8300000000000001 111.061 177.759 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 51.6 mtmt -66.19 -37.57 85.92 Favored 'General case' 0 CA--C 1.531 0.237 0 CA-C-N 118.103 0.411 . . . . 3.3500000000000001 111.329 -176.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.7 t -58.64 -45.17 89.86 Favored 'General case' 0 CA--C 1.538 0.494 0 O-C-N 121.982 -0.449 . . . . 1.97 110.602 173.711 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 19.2 mt -70.2 -58.93 3.23 Favored 'General case' 0 C--O 1.236 0.373 0 C-N-CA 123.726 0.81 . . . . 1.5800000000000001 110.417 -176.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -78.61 75.64 5.12 Favored 'General case' 0 N--CA 1.445 -0.683 0 C-N-CA 124.074 0.949 . . . . 1.8799999999999999 109.057 179.238 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 35.5 m -51.32 -28.16 7.45 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 123.417 0.687 . . . . 2.3100000000000001 112.184 176.606 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.1 m120 -70.08 -33.6 72.1 Favored 'General case' 0 CA--C 1.529 0.156 0 O-C-N 121.989 -0.444 . . . . 3.1099999999999999 110.91 178.003 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 40.3 mt-30 53.15 53.67 11.54 Favored 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.739 1.215 . . . . 4.04 109.29 -161.149 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -102.35 -13.18 17.42 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 126.429 1.891 . . . . 1.8600000000000001 111.525 176.1 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 25.9 m 66.17 17.57 10.77 Favored 'General case' 0 CA--C 1.531 0.226 0 C-N-CA 125.073 1.349 . . . . 1.96 112.837 -177.0 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 4.1 mt-10 -111.56 112.12 23.62 Favored 'General case' 0 N--CA 1.448 -0.57 0 N-CA-C 106.751 -1.574 . . . . 3.1200000000000001 106.751 158.351 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.402 ' HB2' ' HB2' ' A' ' 33' ' ' LEU . 2.6 mm? -82.97 93.7 7.6 Favored 'General case' 0 N--CA 1.447 -0.602 0 N-CA-C 104.256 -2.498 . . . . 1.1699999999999999 104.256 166.227 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -68.14 161.96 25.81 Favored 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 108.346 -0.983 . . . . 3.1800000000000002 108.346 176.383 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 0.0 OUTLIER -39.63 -60.54 0.95 Allowed 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 124.57 1.148 . . . . 5.5899999999999999 112.955 -169.073 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -69.15 -22.3 63.95 Favored 'General case' 0 CA--C 1.537 0.48 0 C-N-CA 123.666 0.786 . . . . 1.9199999999999999 111.68 -175.242 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 28.6 mt-10 -72.69 -56.67 4.95 Favored 'General case' 0 C--N 1.342 0.244 0 CA-C-N 118.448 0.567 . . . . 2.3999999999999999 109.597 173.017 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 5.2 t80 -52.72 -48.77 66.44 Favored 'General case' 0 CA--C 1.517 -0.326 0 N-CA-C 109.301 -0.629 . . . . 2.7000000000000002 109.301 178.097 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.669 ' HZ2' HG23 ' B' ' 80' ' ' ILE . 58.8 t-105 -46.66 -35.87 6.45 Favored 'General case' 0 N--CA 1.441 -0.89 0 CA-C-N 114.693 -1.139 . . . . 5.1799999999999997 111.257 -179.02 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 77.9 mtt-85 -41.47 -45.86 3.31 Favored 'General case' 0 N--CA 1.474 0.73 0 CA-C-N 120.182 1.356 . . . . 4.6200000000000001 111.568 176.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 7.9 tp -49.94 -40.8 44.76 Favored 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 122.764 0.426 . . . . 0.93000000000000005 110.408 -177.586 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.487 HG21 ' HZ3' ' A' ' 77' ' ' TRP . 25.7 mt -74.79 -26.14 19.37 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.396 0 N-CA-C 109.09 -0.707 . . . . 1.3200000000000001 109.09 -174.915 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.434 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -56.37 -43.69 89.89 Favored Glycine 0 CA--C 1.501 -0.786 0 N-CA-C 109.83 -1.308 . . . . 1.1699999999999999 109.83 164.453 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.411 ' OE2' ' NZ ' ' A' ' 85' ' ' LYS . 24.8 mm-40 -80.6 -30.77 36.83 Favored 'General case' 0 N--CA 1.437 -1.095 0 CA-C-O 117.687 -1.149 . . . . 3.1099999999999999 110.546 -178.201 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.497 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 8.6 mp -54.38 -59.86 4.12 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 122.189 2.268 . . . . 2.4199999999999999 108.391 167.756 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -54.58 -53.66 51.65 Favored 'General case' 0 C--O 1.234 0.243 0 CA-C-O 121.978 0.894 . . . . 1.3500000000000001 110.6 -178.766 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.464 ' O ' ' HB2' ' A' ' 89' ' ' LYS . 4.6 ttpp -63.36 -40.71 98.02 Favored 'General case' 0 C--O 1.211 -0.954 0 CA-C-O 116.683 -1.627 . . . . 1.6799999999999999 110.746 -178.261 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.1 mm-40 -51.09 -51.15 56.19 Favored 'General case' 0 N--CA 1.463 0.177 0 CA-C-N 122.233 2.288 . . . . 3.23 108.834 178.091 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.8 mt -52.57 -47.39 48.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 N-CA-C 111.417 0.154 . . . . 2.0099999999999998 111.417 171.529 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . 2.144 41.6 mtt85 -38.98 -58.38 1.12 Allowed 'General case' 0 CA--C 1.548 0.891 0 N-CA-C 115.462 1.653 . . . . 7.5999999999999996 115.462 161.393 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . 0.464 ' HB2' ' O ' ' A' ' 85' ' ' LYS . 75.3 tttt -81.05 162.02 23.94 Favored 'General case' 0 N--CA 1.467 0.412 0 C-N-CA 127.374 2.27 . . . . 4.2300000000000004 113.737 -127.496 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -45.26 -47.43 12.86 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 127.544 2.338 . . . . 15.15 113.163 -167.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 30.6 ttpt -133.49 22.97 4.02 Favored 'General case' 0 CA--C 1.532 0.267 0 CA-C-O 117.74 -1.124 . . . . 9.1300000000000008 111.165 -174.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 16.0 t70 24.36 -114.16 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 127.033 2.133 . . . . 8.3599999999999994 111.854 173.323 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 24.9 tp -86.85 -39.23 16.05 Favored 'General case' 0 N--CA 1.448 -0.527 0 C-N-CA 125.614 1.565 . . . . 12.73 107.878 160.885 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -141.51 178.67 7.29 Favored 'General case' 0 N--CA 1.454 -0.272 0 C-N-CA 125.482 1.513 . . . . 11.25 107.483 171.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 47.0 mm -55.82 130.14 17.99 Favored 'Isoleucine or valine' 0 C--O 1.24 0.572 0 N-CA-C 107.191 -1.411 . . . . 9.1199999999999992 107.191 147.058 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -162.69 -174.94 4.18 Favored 'General case' 0 N--CA 1.452 -0.361 0 C-N-CA 126.867 2.067 . . . . 13.789999999999999 105.449 -178.166 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 3.4 tmtt? -174.13 135.17 0.46 Allowed 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 105.032 -2.21 . . . . 12.85 105.032 -174.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 32.3 tptt . . . . . 0 C--O 1.251 1.133 0 N-CA-C 102.915 -2.994 . . . . 11.970000000000001 102.915 159.28 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.393 0.0 OUTLIER . . . . . 0 N--CA 1.48 1.054 0 N-CA-C 109.866 -0.42 . . . . 6.6500000000000004 109.866 . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -171.69 -169.07 0.65 Allowed 'General case' 0 C--O 1.235 0.296 0 C-N-CA 126.984 2.114 . . . . 5.1399999999999997 107.613 -169.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 106.24 101.64 0.01 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 129.374 3.069 . . . . 5.8200000000000003 114.605 -172.714 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.482 ' HB3' ' CD ' ' B' ' 5' ' ' PRO 0.338 8.0 tt0 179.53 -147.65 0.0 OUTLIER Pre-proline 0 CA--C 1.542 0.652 1 C-N-CA 132.227 4.211 . . . . 9.0700000000000003 107.255 153.397 . . . . . . . . 4 3 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . 0.482 ' CD ' ' HB3' ' B' ' 4' ' ' GLU . 67.2 Cg_endo -56.29 135.25 69.1 Favored 'Trans proline' 0 C--N 1.353 0.795 0 CA-C-N 125.023 2.83 . . . . 2.8900000000000001 112.88 -151.27 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -167.08 166.35 15.19 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.912 0.885 . . . . 5.04 109.398 -155.897 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.427 HG22 ' CD ' ' B' ' 10' ' ' GLU . 13.4 t -82.49 -165.45 1.04 Allowed 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 119.306 0.957 . . . . 1.72 111.016 -179.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -72.62 -60.76 2.08 Favored 'General case' 0 N--CA 1.448 -0.526 0 C-N-CA 123.633 0.773 . . . . 2.1299999999999999 111.41 -167.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 10.6 mt -56.68 -37.74 71.27 Favored 'General case' 0 CA--C 1.532 0.27 0 O-C-N 120.492 -1.38 . . . . 1.05 110.617 177.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.427 ' CD ' HG22 ' B' ' 7' ' ' THR . 89.1 mt-10 -59.5 -43.48 93.34 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.757 0.823 . . . . 2.9399999999999999 111.848 174.325 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -64.01 -46.06 86.2 Favored 'General case' 0 C--N 1.339 0.146 0 O-C-N 120.79 -1.194 . . . . 5.1100000000000003 108.917 177.531 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -59.03 -46.29 88.58 Favored 'General case' 0 N--CA 1.45 -0.435 0 CA-C-N 115.742 -0.663 . . . . 1.72 110.816 -176.877 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.2 pp -66.98 -40.49 85.74 Favored 'Isoleucine or valine' 0 CA--C 1.528 0.132 0 O-C-N 121.529 -0.732 . . . . 0.79000000000000004 110.997 174.853 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -60.51 -55.14 37.07 Favored 'General case' 0 CA--C 1.532 0.261 0 CA-C-N 119.179 0.899 . . . . 3.2000000000000002 110.541 179.846 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 5.8 t -52.84 -36.56 58.99 Favored 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 119.103 0.865 . . . . 1.1499999999999999 111.593 -173.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 24.3 m -78.01 -38.29 24.1 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.245 0 O-C-N 121.237 -0.914 . . . . 0.78000000000000003 111.746 175.046 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 26.0 t -56.5 -51.0 70.42 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.216 0 CA-C-N 119.395 0.998 . . . . 0.81999999999999995 110.466 173.333 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 15.3 t -61.36 -40.09 93.02 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 119.421 1.009 . . . . 1.0700000000000001 110.85 178.918 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 68.1 m -57.23 -54.63 44.65 Favored 'General case' 0 CA--C 1.536 0.418 0 O-C-N 121.421 -0.799 . . . . 0.87 110.278 173.491 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 2.5 t80 -45.53 -53.3 9.16 Favored 'General case' 0 C--O 1.222 -0.345 0 C-N-CA 123.814 0.846 . . . . 4.0099999999999998 109.654 172.663 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -58.73 -52.33 66.14 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 125.194 1.398 . . . . 2.5499999999999998 110.721 -174.485 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 4.6 t -66.41 -26.57 67.3 Favored 'General case' 0 CA--C 1.533 0.31 0 CA-C-O 118.995 -0.526 . . . . 2.6299999999999999 111.684 -177.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -80.15 -36.95 34.43 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 120.033 1.288 . . . . 2.7599999999999998 111.422 168.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.32 -32.17 72.89 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 120.833 -1.167 . . . . 1.1799999999999999 109.927 -173.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.03 -19.54 65.27 Favored 'General case' 0 C--N 1.333 -0.147 0 CA-C-O 117.421 -1.276 . . . . 4.3200000000000003 113.44 178.936 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.455 ' HB3' ' HG3' ' B' ' 37' ' ' GLU . 0.8 OUTLIER -51.1 -64.7 0.73 Allowed 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 115.168 1.544 . . . . 1.6899999999999999 115.168 -158.909 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -91.27 -77.37 0.42 Allowed 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 119.757 -0.777 . . . . 2.8300000000000001 112.581 -169.902 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.99 156.92 23.15 Favored Glycine 0 C--N 1.338 0.652 0 C-N-CA 127.77 2.605 . . . . 2.04 110.368 158.146 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 90.6 mtt180 48.3 101.32 0.01 OUTLIER 'General case' 0 C--O 1.244 0.81 0 N-CA-C 115.772 1.767 . . . . 3.71 115.772 142.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 7.1 pttt -67.73 55.44 0.06 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 128.113 2.565 . . . . 3.5499999999999998 112.121 172.952 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 9.4 m-20 -155.86 -49.05 0.08 Allowed 'General case' 0 C--N 1.326 -0.455 0 C-N-CA 126.465 1.906 . . . . 3.5099999999999998 107.156 -157.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 49.0 p -99.75 149.22 23.56 Favored 'General case' 0 N--CA 1.444 -0.749 0 C-N-CA 125.524 1.53 . . . . 2.2200000000000002 111.203 -179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -93.08 117.68 30.34 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 107.168 -1.419 . . . . 2.2599999999999998 107.168 139.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 4.6 t -83.2 -170.65 3.15 Favored 'General case' 0 C--N 1.326 -0.429 0 C-N-CA 126.054 1.741 . . . . 2.52 108.648 161.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.454 ' C ' ' H ' ' B' ' 37' ' ' GLU . 0.1 OUTLIER -64.83 -103.83 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.236 0.362 0 C-N-CA 130.252 3.421 . . . . 3.1600000000000001 102.475 -166.798 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -75.5 55.96 0.85 Allowed 'General case' 0 CA--C 1.551 0.995 0 O-C-N 118.918 -2.364 . . . . 2.7599999999999998 111.45 -178.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.455 ' HG3' ' HB3' ' B' ' 26' ' ' GLN . 2.3 tt0 -116.43 -56.89 2.25 Favored 'General case' 0 N--CA 1.448 -0.561 1 C-N-CA 132.68 4.392 . . . . 2.0 103.716 158.404 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -52.58 -48.58 66.13 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 123.757 0.823 . . . . 2.4500000000000002 109.221 173.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 2.4 ttmp? -51.18 -42.53 60.91 Favored 'General case' 0 C--N 1.341 0.229 0 C-N-CA 120.635 -0.426 . . . . 3.7200000000000002 111.118 -178.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 83.2 mt-10 -59.26 -37.87 78.68 Favored 'General case' 0 N--CA 1.45 -0.473 0 CA-C-N 118.111 0.414 . . . . 2.9100000000000001 111.778 177.463 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.5 tt -68.76 -48.96 62.38 Favored 'General case' 0 N--CA 1.455 -0.212 0 CA-C-N 118.939 0.79 . . . . 1.98 109.639 -179.649 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 2.4 m -66.57 -39.5 84.03 Favored 'Isoleucine or valine' 0 N--CA 1.463 0.186 0 CA-C-O 120.877 0.37 . . . . 0.71999999999999997 110.039 -175.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 97.0 m -63.43 -56.5 15.71 Favored 'General case' 0 N--CA 1.45 -0.468 0 C-N-CA 123.455 0.702 . . . . 0.89000000000000001 110.727 174.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 11.1 tt0 -80.36 -57.4 3.62 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 122.749 0.419 . . . . 1.78 111.617 -164.794 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 -79.46 -46.78 16.82 Favored 'General case' 0 CA--C 1.53 0.211 0 N-CA-C 111.826 0.306 . . . . 3.1000000000000001 111.826 -164.178 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . 0.406 HD13 ' HA ' ' B' ' 46' ' ' LEU . 4.5 mm? -59.25 -37.55 53.48 Favored Pre-proline 0 CA--C 1.533 0.311 0 N-CA-C 113.505 0.928 . . . . 2.21 113.505 -166.102 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 67.3 Cg_endo -60.11 -33.82 94.89 Favored 'Trans proline' 0 N--CA 1.45 -1.048 0 C-N-CA 121.706 -2.206 . . . . 1.99 110.083 -62.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 56.7 t60 -84.64 -46.41 11.53 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.254 1.021 . . . . 3.52 112.871 -164.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.412 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 3.5 tp -42.02 -59.15 1.83 Allowed 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.085 1.354 . . . . 1.23 111.428 -176.99 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 29.7 mt -79.74 66.09 5.1 Favored 'General case' 0 C--N 1.34 0.165 0 CA-C-O 122.111 0.958 . . . . 1.76 110.867 172.108 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 1.3 pttt -30.32 137.05 0.03 OUTLIER 'General case' 0 N--CA 1.451 -0.41 0 C-N-CA 125.647 1.579 . . . . 5.6900000000000004 112.257 152.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 27.1 t0 56.2 71.25 0.57 Allowed 'General case' 0 N--CA 1.45 -0.467 0 C-N-CA 125.924 1.689 . . . . 3.52 110.121 -167.262 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 24.8 m -72.4 -1.37 2.4 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.621 0 CA-C-N 112.262 -2.245 . . . . 1.5700000000000001 111.462 159.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -80.7 -56.65 3.07 Favored Glycine 0 C--N 1.342 0.898 0 N-CA-C 109.389 -1.485 . . . . 2.3500000000000001 109.389 -174.171 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -76.29 52.04 0.73 Allowed 'General case' 0 CA--C 1.535 0.383 0 CA-C-O 122.362 1.077 . . . . 2.3999999999999999 110.618 179.348 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.0 tm? -61.3 -40.18 93.22 Favored 'General case' 0 N--CA 1.439 -0.992 0 O-C-N 120.891 -1.13 . . . . 1.3799999999999999 108.933 179.251 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 20.8 p-10 -54.09 -53.17 56.88 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.398 1.079 . . . . 3.48 111.547 175.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -50.13 -60.16 3.22 Favored 'General case' 0 C--O 1.233 0.188 0 C-N-CA 124.862 1.265 . . . . 2.4100000000000001 109.226 176.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.42 -57.31 13.51 Favored 'General case' 0 N--CA 1.454 -0.227 0 N-CA-C 109.427 -0.583 . . . . 4.2800000000000002 109.427 -175.581 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -43.52 -54.89 4.57 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 125.912 1.685 . . . . 2.0600000000000001 110.733 178.372 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 16.1 mtpp -56.61 -47.13 80.32 Favored 'General case' 0 CA--C 1.532 0.274 0 C-N-CA 122.767 0.427 . . . . 3.6099999999999999 111.454 175.429 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.2 t -60.71 -31.9 71.16 Favored 'General case' 0 CA--C 1.534 0.336 0 CA-C-O 118.979 -0.534 . . . . 1.6399999999999999 112.253 179.843 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 7.0 mp -75.54 -53.73 8.15 Favored 'General case' 0 CA--C 1.53 0.177 0 CA-C-N 119.06 0.845 . . . . 2.0099999999999998 110.061 174.458 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 16.2 t0 -53.65 -9.29 0.2 Allowed 'General case' 0 C--O 1.222 -0.374 0 N-CA-C 117.462 2.393 . . . . 2.1899999999999999 117.462 -167.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.6 m -35.54 -23.04 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.542 0.664 0 C-N-CA 129.649 3.18 . . . . 1.9199999999999999 119.119 -127.674 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 2.0 p30 -51.38 -32.36 25.78 Favored 'General case' 0 N--CA 1.465 0.311 0 CA-C-N 120.429 1.468 . . . . 3.4399999999999999 111.544 159.072 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 12.2 tt0 64.01 55.05 1.61 Allowed 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 123.579 0.751 . . . . 2.6899999999999999 109.155 177.342 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 51.7 p30 -91.83 -17.67 24.96 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 124.519 1.128 . . . . 2.1699999999999999 110.562 173.836 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER 79.95 13.11 1.01 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.455 1.502 . . . . 2.2000000000000002 112.544 179.949 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 8.1 mt-10 -124.33 101.81 7.37 Favored 'General case' 0 CA--C 1.54 0.574 0 N-CA-C 106.857 -1.534 . . . . 3.0 106.857 167.117 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -76.13 106.6 7.82 Favored 'General case' 0 C--N 1.339 0.145 0 N-CA-C 106.684 -1.598 . . . . 1.46 106.684 175.854 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 48.9 tttt -83.78 178.84 7.76 Favored 'General case' 0 CA--C 1.537 0.457 0 C-N-CA 125.506 1.522 . . . . 3.5699999999999998 110.652 -162.652 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -83.53 80.19 9.19 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 124.994 1.318 . . . . 4.8099999999999996 110.553 177.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . 0.363 28.4 t-20 123.9 -164.79 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.445 0 CA-C-O 113.37 -3.205 . . . . 4.8399999999999999 103.915 -110.082 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -31.86 -37.7 0.02 OUTLIER 'General case' 0 CA--C 1.544 0.744 0 CA-C-N 124.519 3.327 . . . . 2.3900000000000001 116.798 -148.762 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 68.0 t80 -40.53 -53.97 2.59 Favored 'General case' 0 N--CA 1.47 0.539 0 CA-C-N 121.112 1.778 . . . . 3.8799999999999999 111.503 166.307 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.47 ' CH2' ' CD1' ' A' ' 77' ' ' TRP . 58.6 t90 -40.1 -32.03 0.15 Allowed 'General case' 0 N--CA 1.439 -1.005 0 C-N-CA 126.768 2.027 . . . . 3.73 114.838 173.542 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 5.9 mmp_? -46.54 -45.22 18.51 Favored 'General case' 0 N--CA 1.466 0.354 0 CA-C-N 121.114 1.779 . . . . 6.7999999999999998 110.276 170.532 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 8.7 tp -44.82 -49.74 10.61 Favored 'General case' 0 N--CA 1.446 -0.656 0 C-N-CA 124.725 1.21 . . . . 1.0700000000000001 111.497 177.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . 0.669 HG23 ' HZ2' ' A' ' 77' ' ' TRP 0.322 8.7 tt -75.35 -21.84 16.43 Favored 'Isoleucine or valine' 0 N--CA 1.44 -0.951 0 N-CA-C 106.569 -1.641 . . . . 2.6000000000000001 106.569 -166.789 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.56 ' HA2' ' CE2' ' A' ' 77' ' ' TRP . . . -59.03 -50.62 65.88 Favored Glycine 0 CA--C 1.491 -1.408 0 C-N-CA 125.003 1.287 . . . . 1.49 110.46 167.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -67.62 -47.39 69.75 Favored 'General case' 0 N--CA 1.43 -1.453 0 N-CA-C 106.871 -1.529 . . . . 2.1899999999999999 106.871 -176.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.412 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 10.6 mp -44.0 -61.06 1.58 Allowed 'General case' 0 CA--C 1.544 0.729 0 CA-C-N 120.678 1.581 . . . . 2.02 111.803 171.296 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.31 -44.42 84.12 Favored 'General case' 0 N--CA 1.461 0.112 0 C-N-CA 123.84 0.856 . . . . 1.2 111.561 -177.152 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -65.3 -54.04 35.03 Favored 'General case' 0 N--CA 1.448 -0.545 0 C-N-CA 124.977 1.311 . . . . 1.51 110.227 -177.756 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 23.8 mm-40 -57.01 -38.91 73.79 Favored 'General case' 0 N--CA 1.453 -0.309 0 C-N-CA 125.582 1.553 . . . . 2.46 110.931 -173.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 2.0 tt -51.38 -36.46 17.45 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.528 0 CA-C-N 118.814 0.733 . . . . 1.0800000000000001 111.082 175.293 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.45 -49.82 10.17 Favored 'General case' 0 CA--C 1.54 0.583 0 C-N-CA 123.736 0.815 . . . . 5.7800000000000002 109.754 174.615 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 67.1 mttt -115.58 97.0 5.9 Favored 'General case' 0 C--O 1.223 -0.296 0 C-N-CA 126.264 1.826 . . . . 5.9000000000000004 111.927 -160.168 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . 0.415 ' NZ ' ' OD2' ' B' ' 92' ' ' ASP . 18.0 pttp -39.49 -43.51 1.27 Allowed 'General case' 0 CA--C 1.545 0.783 0 C-N-CA 124.726 1.211 . . . . 5.4000000000000004 114.038 -179.729 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 2.0 ttpm? -162.58 42.63 0.12 Allowed 'General case' 0 N--CA 1.471 0.584 0 CA-C-N 119.715 1.143 . . . . 5.7000000000000002 109.606 154.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . 0.415 ' OD2' ' NZ ' ' B' ' 90' ' ' LYS . 1.0 OUTLIER -106.57 78.72 1.29 Allowed 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 122.981 0.512 . . . . 4.8099999999999996 110.054 -155.968 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 21.8 tp -139.85 -64.46 0.48 Allowed 'General case' 0 N--CA 1.443 -0.781 0 C-N-CA 124.001 0.921 . . . . 6.6900000000000004 108.64 170.151 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.55 171.83 7.36 Favored 'General case' 0 N--CA 1.465 0.313 0 CA-C-N 118.532 0.605 . . . . 8.2100000000000009 110.235 -178.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 40.7 pt -140.77 28.39 0.45 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.469 0 C-N-CA 125.334 1.454 . . . . 8.3900000000000006 109.984 169.433 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 10.4 tpt85 -161.66 168.41 23.43 Favored 'General case' 0 C--O 1.236 0.373 0 N-CA-C 108.33 -0.989 . . . . 6.0999999999999996 108.33 -175.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 5.4 tmtm? -176.27 137.92 0.31 Allowed 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 129.952 3.301 . . . . 6.6699999999999999 103.171 -168.208 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 13.8 tmtt? . . . . . 0 C--O 1.256 1.413 0 N-CA-C 102.887 -3.005 . . . . 6.1500000000000004 102.887 158.264 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 66.6 mtt . . . . . 0 N--CA 1.472 0.641 0 N-CA-C 106.169 -1.789 . . . . 6.6900000000000004 106.169 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -73.7 171.27 13.59 Favored 'General case' 0 C--O 1.232 0.16 0 O-C-N 124.049 0.843 . . . . 4.0 109.769 168.492 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.66 86.5 0.0 OUTLIER 'General case' 0 C--N 1.332 -0.161 0 C-N-CA 129.059 2.944 . . . . 3.1899999999999999 108.843 -176.334 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 22.2 mp0 -85.8 123.09 72.76 Favored Pre-proline 0 N--CA 1.448 -0.557 0 C-N-CA 123.864 0.866 . . . . 4.2400000000000002 110.26 -156.449 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.52 104.81 1.64 Allowed 'Trans proline' 0 N--CA 1.45 -1.032 0 C-N-CA 122.313 2.009 . . . . 2.52 109.564 -179.208 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 64.5 mt -59.28 152.11 21.7 Favored 'General case' 0 CA--C 1.534 0.334 0 N-CA-C 108.951 -0.759 . . . . 1.3300000000000001 108.951 170.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 12.3 t -70.17 171.76 9.19 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 120.436 -0.505 . . . . 1.76 110.188 -178.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 3.5 mt-10 -63.77 -55.58 22.06 Favored 'General case' 0 CA--C 1.513 -0.451 0 O-C-N 121.109 -0.995 . . . . 2.8900000000000001 110.914 -172.634 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.1 mp -57.13 -41.33 78.86 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 118.833 -1.147 . . . . 1.6399999999999999 110.148 -176.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 33.4 tt0 -57.59 -51.15 70.68 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 127.835 2.454 . . . . 2.0099999999999998 111.284 175.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -59.2 -52.87 63.83 Favored 'General case' 0 C--O 1.232 0.178 0 N-CA-C 108.665 -0.865 . . . . 5.1200000000000001 108.665 177.887 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 13.9 m -61.09 -46.93 88.65 Favored 'General case' 0 N--CA 1.452 -0.365 0 N-CA-C 111.805 0.298 . . . . 2.0299999999999998 111.805 -175.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.42 ' CD1' HG13 ' B' ' 87' ' ' ILE . 2.3 pp -64.1 -41.72 93.33 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 O-C-N 120.822 -1.174 . . . . 0.76000000000000001 109.923 178.524 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -59.47 -49.25 78.51 Favored 'General case' 0 CA--C 1.533 0.323 0 CA-C-N 119.402 1.001 . . . . 3.5800000000000001 110.494 177.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -56.2 -40.52 74.15 Favored 'General case' 0 CA--C 1.542 0.655 0 CA-C-O 121.597 0.713 . . . . 1.3500000000000001 111.032 -175.785 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 13.4 m -75.45 -36.33 35.13 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 O-C-N 120.696 -1.252 . . . . 0.62 111.413 175.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 45.7 t -58.56 -46.56 89.93 Favored 'Isoleucine or valine' 0 C--N 1.342 0.24 0 CA-C-N 119.684 1.129 . . . . 0.76000000000000001 110.064 175.984 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -63.43 -44.07 95.61 Favored 'General case' 0 CA--C 1.533 0.302 0 CA-C-O 118.54 -0.743 . . . . 1.04 110.47 177.397 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 76.6 m -54.75 -48.32 72.74 Favored 'General case' 0 C--N 1.344 0.359 0 CA-C-N 119.01 0.823 . . . . 0.77000000000000002 110.262 177.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 20.4 t80 -54.92 -61.19 2.47 Favored 'General case' 0 C--O 1.226 -0.148 0 N-CA-C 109.818 -0.438 . . . . 3.3599999999999999 109.818 172.243 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -60.88 -48.76 80.32 Favored 'General case' 0 N--CA 1.455 -0.223 0 C-N-CA 123.261 0.624 . . . . 3.2000000000000002 110.996 -163.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -62.64 -25.4 68.1 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 119.333 -0.365 . . . . 2.5499999999999998 111.154 179.815 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 5.2 t80 -82.7 -58.97 2.67 Favored 'General case' 0 C--O 1.219 -0.534 0 C-N-CA 123.407 0.683 . . . . 2.8900000000000001 111.114 178.381 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -45.12 -24.28 0.23 Allowed 'General case' 0 C--O 1.238 0.472 1 C-N-CA 132.647 4.379 . . . . 0.92000000000000004 115.55 178.776 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -57.53 -23.62 51.38 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 123.918 0.761 . . . . 3.8700000000000001 112.082 169.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -38.49 -66.76 0.24 Allowed 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 127.231 2.213 . . . . 1.6599999999999999 113.435 -163.7 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.8 mt-10 -99.99 34.25 2.36 Favored 'General case' 0 N--CA 1.446 -0.647 0 N-CA-C 108.755 -0.831 . . . . 3.1099999999999999 108.755 -174.357 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 65.0 -168.04 29.72 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-O 122.374 0.985 . . . . 1.8799999999999999 110.707 -164.202 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? 53.66 72.96 0.4 Allowed 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.194 -1.039 . . . . 9.8699999999999992 108.194 -178.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 54.2 pttt -61.81 -34.9 76.74 Favored 'General case' 0 C--O 1.224 -0.284 0 C-N-CA 123.491 0.717 . . . . 4.4500000000000002 111.876 -170.424 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -83.93 14.1 4.37 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-O 118.494 -0.765 . . . . 3.54 111.669 177.341 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 5.3 p -125.69 145.45 50.17 Favored 'General case' 0 C--N 1.348 0.542 0 C-N-CA 124.279 1.032 . . . . 2.7200000000000002 111.601 175.851 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.6 mt -102.75 123.41 46.37 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 108.769 -0.826 . . . . 2.5699999999999998 108.769 149.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -83.33 177.74 8.37 Favored 'General case' 0 C--O 1.225 -0.231 0 O-C-N 121.223 -0.923 . . . . 2.4900000000000002 110.15 167.574 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 93.2 t -46.44 -59.31 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.375 0 C-N-CA 123.754 0.822 . . . . 2.2400000000000002 111.167 178.855 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 1.7 t30 -58.19 -59.17 5.71 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-O 118.757 -0.639 . . . . 2.23 109.687 -177.23 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 22.0 mt-10 -39.19 -47.94 1.69 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 124.777 1.231 . . . . 2.23 111.998 171.555 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . 0.4 ' CE2' ' HG ' ' A' ' 71' ' ' LEU . 0.2 OUTLIER -58.86 -58.06 10.28 Favored 'General case' 0 N--CA 1.452 -0.358 0 C-N-CA 123.707 0.803 . . . . 3.4700000000000002 110.492 177.813 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.409 ' O ' HG22 ' A' ' 42' ' ' VAL . 21.6 ttmt -61.03 -38.66 86.92 Favored 'General case' 0 N--CA 1.451 -0.387 0 C-N-CA 120.874 -0.33 . . . . 2.96 110.691 -174.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 64.0 mt-10 -51.86 -35.05 43.51 Favored 'General case' 0 N--CA 1.451 -0.395 0 CA-C-O 118.687 -0.673 . . . . 2.5800000000000001 111.367 173.574 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 3.3 tm? -68.82 -43.33 75.77 Favored 'General case' 0 C--O 1.232 0.175 0 CA-C-N 119.978 1.263 . . . . 2.1899999999999999 108.352 -176.475 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . 0.409 HG22 ' O ' ' A' ' 39' ' ' LYS . 13.8 m -65.57 -42.97 94.17 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.347 0 N-CA-C 109.542 -0.54 . . . . 1.5900000000000001 109.542 -175.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.0 m -57.7 -49.34 76.86 Favored 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 123.807 0.843 . . . . 2.02 111.261 170.743 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -65.24 -56.46 12.66 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.769 1.228 . . . . 4.3399999999999999 111.933 -171.046 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 60.6 mt-30 -152.48 70.85 0.92 Allowed 'General case' 0 N--CA 1.466 0.336 0 CA-C-N 119.02 0.827 . . . . 3.7400000000000002 111.278 -175.719 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.414 ' N ' ' CD ' ' A' ' 47' ' ' PRO . 2.7 tp -156.5 31.41 0.04 OUTLIER Pre-proline 0 CA--C 1.542 0.668 0 N-CA-C 114.855 1.428 . . . . 1.79 114.855 174.372 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.414 ' CD ' ' N ' ' A' ' 46' ' ' LEU . 39.0 Cg_endo -63.03 -64.99 0.06 OUTLIER 'Trans proline' 0 N--CA 1.455 -0.778 0 C-N-CA 121.916 1.744 . . . . 2.1800000000000002 113.586 -172.074 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.5 t60 -87.04 41.63 0.98 Allowed 'General case' 0 CA--C 1.532 0.283 0 O-C-N 121.096 -1.003 . . . . 3.7799999999999998 111.611 -160.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.538 HD12 ' HE3' ' A' ' 90' ' ' LYS . 1.5 tp -141.95 -82.5 0.2 Allowed 'General case' 0 C--O 1.236 0.343 0 C-N-CA 124.172 0.989 . . . . 1.3100000000000001 110.844 -172.85 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 32.0 mt -87.96 75.39 8.8 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 107.736 -1.209 . . . . 1.95 107.736 -178.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . 0.407 ' NZ ' ' OE1' ' A' ' 86' ' ' GLU . 0.0 OUTLIER -43.13 143.61 0.77 Allowed 'General case' 0 N--CA 1.451 -0.407 0 CA-C-N 114.568 -1.196 . . . . 6.9800000000000004 110.33 160.437 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 16.1 t0 65.31 81.5 0.2 Allowed 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 125.537 1.535 . . . . 4.4000000000000004 110.042 -159.985 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -88.57 3.7 5.37 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.588 0 CA-C-N 113.539 -1.664 . . . . 2.3900000000000001 110.681 163.972 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -94.77 -57.78 1.22 Allowed Glycine 0 C--N 1.342 0.897 0 N-CA-C 109.777 -1.329 . . . . 1.8600000000000001 109.777 -170.013 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.5 t -90.9 30.19 1.24 Allowed 'General case' 0 CA--C 1.535 0.387 0 C-N-CA 125.096 1.359 . . . . 2.5600000000000001 110.007 173.212 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -40.59 -38.25 0.84 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 126.244 1.818 . . . . 1.8300000000000001 110.963 166.507 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -42.44 -41.92 3.08 Favored 'General case' 0 CA--C 1.541 0.601 0 C-N-CA 127.328 2.251 . . . . 4.5099999999999998 111.157 175.906 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -56.42 -54.65 43.09 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 124.548 1.139 . . . . 2.79 111.089 173.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.433 ' HE3' ' H ' ' A' ' 59' ' ' LYS . 0.0 OUTLIER -58.1 -53.79 54.24 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 106.735 -1.58 . . . . 3.1800000000000002 106.735 -179.291 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.5 tmt? -45.62 -52.12 11.14 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.081 0.953 . . . . 1.8200000000000001 111.147 178.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 96.7 mttt -64.52 -29.86 70.89 Favored 'General case' 0 CA--C 1.534 0.344 0 O-C-N 121.611 -0.68 . . . . 3.8700000000000001 112.493 178.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.8 t -67.83 -48.14 67.05 Favored 'General case' 0 CA--C 1.537 0.48 0 CA-C-N 118.373 0.533 . . . . 1.79 110.438 173.917 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 7.1 mp -57.97 -48.45 79.95 Favored 'General case' 0 C--O 1.233 0.214 0 O-C-N 121.729 -0.607 . . . . 1.97 110.167 177.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 3.3 t70 -71.8 81.65 0.88 Allowed 'General case' 0 N--CA 1.45 -0.44 0 CA-C-N 116.515 -0.311 . . . . 2.7200000000000002 110.272 -172.702 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.1 m -47.8 -36.57 5.42 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 C-N-CA 124.032 0.933 . . . . 1.78 113.499 -174.119 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 21.0 p-10 -98.52 -0.12 43.95 Favored 'General case' 0 CA--C 1.535 0.401 0 N-CA-C 113.295 0.85 . . . . 2.3100000000000001 113.295 -179.784 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 72.8 mt-30 44.2 58.6 3.64 Favored 'General case' 0 CA--C 1.53 0.187 0 C-N-CA 126.985 2.114 . . . . 4.2999999999999998 112.517 178.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 45.4 p30 -100.14 -3.48 31.66 Favored 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 124.888 1.275 . . . . 1.6899999999999999 112.317 178.271 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 28.1 m 65.17 21.92 12.18 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 124.977 1.311 . . . . 1.8300000000000001 113.144 -174.466 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 -129.43 100.6 5.62 Favored 'General case' 0 N--CA 1.449 -0.521 0 N-CA-C 105.329 -2.1 . . . . 4.0899999999999999 105.329 171.652 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . 0.4 ' HG ' ' CE2' ' A' ' 38' ' ' PHE . 0.2 OUTLIER -81.62 88.16 6.24 Favored 'General case' 0 CA--C 1.514 -0.433 0 N-CA-C 103.151 -2.907 . . . . 1.0900000000000001 103.151 176.142 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 78.6 tttt -54.2 155.59 3.61 Favored 'General case' 0 N--CA 1.448 -0.562 0 N-CA-C 107.746 -1.205 . . . . 4.25 107.746 176.577 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 28.5 t80 -37.18 -55.77 0.96 Allowed 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.239 1.016 . . . . 5.0800000000000001 112.815 -173.095 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -76.31 -18.27 59.03 Favored 'General case' 0 CA--C 1.541 0.626 0 N-CA-C 113.191 0.812 . . . . 4.04 113.191 -175.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 48.4 mt-10 -73.79 -60.05 2.43 Favored 'General case' 0 CA--C 1.529 0.161 0 O-C-N 121.364 -0.835 . . . . 2.0699999999999998 108.905 166.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 3.2 t80 -43.09 -47.79 6.11 Favored 'General case' 0 CA--C 1.52 -0.205 0 C-N-CA 124.387 1.075 . . . . 3.5 110.435 176.587 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.626 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 39.8 t90 -39.77 -41.14 1.06 Allowed 'General case' 0 N--CA 1.445 -0.704 0 C-N-CA 124.641 1.176 . . . . 4.4199999999999999 112.613 -179.575 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -46.45 -38.33 8.98 Favored 'General case' 0 C--N 1.343 0.306 0 CA-C-O 117.976 -1.012 . . . . 5.5700000000000003 112.557 179.057 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 21.0 tp -53.2 -48.11 68.35 Favored 'General case' 0 C--O 1.226 -0.181 0 CA-C-N 120.082 1.31 . . . . 0.80000000000000004 110.346 -179.429 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 53.0 mt -59.14 -30.02 42.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 N-CA-C 108.161 -1.051 . . . . 1.6399999999999999 108.161 -179.576 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.569 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -67.13 -50.81 43.09 Favored Glycine 0 CA--C 1.491 -1.444 0 C-N-CA 125.922 1.725 . . . . 1.26 111.399 177.012 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -67.9 -23.84 65.15 Favored 'General case' 0 N--CA 1.427 -1.591 0 N-CA-C 107.651 -1.24 . . . . 2.21 107.651 -179.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.492 HD22 HD23 ' A' ' 49' ' ' LEU . 13.4 mt -68.01 -54.11 20.88 Favored 'General case' 0 CA--C 1.532 0.269 0 CA-C-N 120.636 1.562 . . . . 1.9399999999999999 111.647 166.237 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.95 -28.4 62.15 Favored 'General case' 0 CA--C 1.533 0.299 0 C-N-CA 123.906 0.883 . . . . 1.1000000000000001 111.527 -178.386 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 39.4 ttmt -79.87 -52.67 7.59 Favored 'General case' 0 N--CA 1.447 -0.619 0 C-N-CA 125.727 1.611 . . . . 1.72 107.459 173.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . 0.407 ' OE1' ' NZ ' ' A' ' 51' ' ' LYS 2.099 11.0 pt-20 -31.79 -61.05 0.24 Allowed 'General case' 0 CA--C 1.512 -0.491 0 C-N-CA 129.414 3.085 . . . . 2.4900000000000002 113.42 171.916 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 8.3 tt -56.27 -32.33 34.74 Favored 'Isoleucine or valine' 0 N--CA 1.443 -0.811 0 CA-C-N 115.748 -0.66 . . . . 1.26 112.277 -172.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -91.33 -57.15 2.88 Favored 'General case' 0 CA--C 1.533 0.29 0 C-N-CA 123.737 0.815 . . . . 4.6500000000000004 109.506 176.097 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 56.8 tttp -46.99 -34.5 5.64 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 128.866 2.866 . . . . 2.7400000000000002 113.065 -179.818 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . 0.538 ' HE3' HD12 ' A' ' 49' ' ' LEU . 11.0 tttt -29.98 -27.82 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.637 0 N-CA-C 120.01 3.337 . . . . 8.8399999999999999 120.01 -128.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.0 tttt -174.53 35.4 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 126.134 1.774 . . . . 8.8300000000000001 111.844 163.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 29.9 m-20 -74.08 77.73 1.73 Allowed 'General case' 0 N--CA 1.465 0.315 0 O-C-N 120.882 -1.136 . . . . 6.0899999999999999 109.076 176.541 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.0 pt? -153.62 -34.35 0.11 Allowed 'General case' 0 CA--C 1.532 0.274 0 N-CA-C 113.778 1.029 . . . . 8.6600000000000001 113.778 170.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -159.12 178.03 10.46 Favored 'General case' 0 CA--C 1.531 0.215 0 N-CA-C 108.473 -0.936 . . . . 11.34 108.473 175.37 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 71.9 mt 67.77 -80.22 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.531 0.221 0 C-N-CA 125.313 1.445 . . . . 10.83 108.997 -170.96 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 2.4 mmm-85 158.24 174.46 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 128.838 2.855 . . . . 12.19 107.004 -175.284 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 43.8 tttt -177.64 108.35 0.06 Allowed 'General case' 0 C--O 1.235 0.299 0 C-N-CA 126.26 1.824 . . . . 11.43 106.392 -178.329 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.33 0 N-CA-C 103.915 -2.624 . . . . 10.119999999999999 103.915 179.781 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 77.4 mtm . . . . . 0 N--CA 1.478 0.965 0 CA-C-O 117.658 -1.163 . . . . 6.2400000000000002 109.471 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 76.54 -177.85 0.13 Allowed 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 125.274 1.43 . . . . 5.0800000000000001 113.29 -175.965 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.48 67.44 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 129.547 3.139 . . . . 6.5300000000000002 112.771 179.595 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -76.74 -71.68 0.18 Allowed Pre-proline 0 N--CA 1.444 -0.728 0 C-N-CA 126.967 2.107 . . . . 7.1200000000000001 114.531 -169.728 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 9.2 Cg_endo -42.15 133.37 4.53 Favored 'Trans proline' 0 C--N 1.355 0.898 1 C-N-CA 126.398 4.732 . . . . 3.2599999999999998 115.358 -150.381 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -145.45 149.22 34.3 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 122.56 0.344 . . . . 3.2400000000000002 110.99 -148.48 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.555 HG22 ' HG3' ' B' ' 10' ' ' GLU . 4.7 t -74.17 -168.35 0.63 Allowed 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.107 1.363 . . . . 1.8600000000000001 111.286 174.452 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.516 ' HA ' ' HG2' ' B' ' 11' ' ' GLU . 62.0 tt0 -67.5 -59.99 2.93 Favored 'General case' 0 CA--C 1.538 0.493 0 CA-C-O 122.176 0.989 . . . . 2.4399999999999999 111.989 -173.799 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.6 mt -53.47 -40.73 65.54 Favored 'General case' 0 CA--C 1.534 0.337 0 O-C-N 120.552 -1.342 . . . . 1.04 110.676 176.49 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.555 ' HG3' HG22 ' B' ' 7' ' ' THR . 42.1 mt-10 -57.81 -49.83 75.31 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.365 0.666 . . . . 2.8799999999999999 112.208 173.528 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . 0.516 ' HG2' ' HA ' ' B' ' 8' ' ' GLU . 13.6 pt-20 -61.44 -38.0 85.56 Favored 'General case' 0 CA--C 1.537 0.475 0 O-C-N 120.463 -1.398 . . . . 3.98 110.552 177.433 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 9.4 t -59.73 -49.29 78.33 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.066 0.546 . . . . 1.76 110.981 177.385 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.268 2.4 pp -62.49 -35.2 68.78 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.262 0 O-C-N 121.035 -1.041 . . . . 0.88 111.069 173.121 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -54.79 -59.93 4.06 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 118.077 -0.963 . . . . 2.8100000000000001 111.063 174.027 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 12.8 t -50.65 -43.33 57.15 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 119.758 1.163 . . . . 1.3600000000000001 112.052 -171.676 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.3 m -69.74 -43.81 79.71 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.257 0 O-C-N 120.967 -1.083 . . . . 0.89000000000000001 110.887 177.115 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 41.1 t -55.06 -53.4 34.59 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.234 0 CA-C-O 118.669 -0.682 . . . . 1.02 110.465 175.933 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 9.3 t -58.86 -45.97 88.87 Favored 'General case' 0 CA--C 1.531 0.221 0 CA-C-N 119.334 0.97 . . . . 1.0900000000000001 110.801 178.732 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 94.6 m -52.95 -55.29 24.48 Favored 'General case' 0 CA--C 1.534 0.331 0 CA-C-N 118.71 0.686 . . . . 0.97999999999999998 110.266 177.011 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -54.54 -44.04 72.5 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.751 -0.593 . . . . 7.0999999999999996 111.482 174.762 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 28.0 t80 -64.95 -26.9 68.5 Favored 'General case' 0 C--O 1.234 0.268 0 C-N-CA 124.621 1.168 . . . . 2.3599999999999999 112.299 -177.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 67.2 p -69.88 -61.29 1.84 Allowed 'General case' 0 CA--C 1.532 0.252 0 CA-C-N 119.366 0.985 . . . . 2.3700000000000001 108.644 167.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 32.2 m-85 -54.45 -29.55 49.94 Favored 'General case' 0 C--O 1.221 -0.409 0 N-CA-C 113.105 0.78 . . . . 2.96 113.105 -177.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -51.0 -33.02 23.03 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 126.209 1.804 . . . . 1.22 111.017 176.114 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.28 -37.95 76.03 Favored 'General case' 0 N--CA 1.447 -0.583 0 CA-C-O 117.337 -1.316 . . . . 5.3600000000000003 110.825 178.616 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.556 ' CB ' ' HG2' ' B' ' 37' ' ' GLU . 1.5 tp60 -39.69 -65.82 0.35 Allowed 'General case' 0 C--O 1.24 0.582 0 O-C-N 124.962 1.414 . . . . 2.5899999999999999 111.974 -143.542 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 77.2 mt-10 -95.24 -73.47 0.58 Allowed 'General case' 0 N--CA 1.45 -0.437 0 O-C-N 125.531 1.769 . . . . 3.7200000000000002 113.473 179.331 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.11 123.43 7.48 Favored Glycine 0 C--N 1.338 0.67 0 CA-C-O 115.584 -2.787 . . . . 2.3399999999999999 112.811 178.137 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 53.2 ttt85 52.44 102.83 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 121.752 2.776 . . . . 4.8899999999999997 115.08 149.694 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.61 50.32 0.18 Allowed 'General case' 0 CA--C 1.542 0.645 0 N-CA-C 116.231 1.937 . . . . 6.1500000000000004 116.231 -172.604 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 64.6 t0 -137.08 -54.09 0.7 Allowed 'General case' 0 C--N 1.33 -0.247 0 C-N-CA 126.243 1.817 . . . . 3.3300000000000001 107.618 177.006 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 56.4 p -73.38 145.84 45.59 Favored 'General case' 0 N--CA 1.447 -0.581 0 C-N-CA 124.834 1.253 . . . . 2.1600000000000001 110.568 175.001 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -85.04 -173.3 4.65 Favored 'General case' 0 CA--C 1.543 0.674 0 N-CA-C 108.496 -0.927 . . . . 2.04 108.496 157.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . 0.273 3.9 t -157.4 -167.98 2.46 Favored 'General case' 0 N--CA 1.464 0.263 0 CA-C-O 122.771 1.272 . . . . 2.4199999999999999 113.581 -158.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 15.9 t -68.17 -131.09 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.446 -0.651 1 N-CA-C 98.204 -4.739 . . . . 3.2999999999999998 98.204 151.319 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 15.2 t30 -75.26 56.1 0.8 Allowed 'General case' 0 CA--C 1.557 1.217 0 O-C-N 118.062 -2.899 . . . . 2.8700000000000001 112.323 -160.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.556 ' HG2' ' CB ' ' B' ' 26' ' ' GLN . 58.0 mt-10 -102.85 -50.81 3.43 Favored 'General case' 0 N--CA 1.453 -0.284 0 C-N-CA 128.971 2.908 . . . . 1.77 107.688 139.966 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.5 OUTLIER -56.07 -52.16 65.27 Favored 'General case' 0 CA--C 1.512 -0.483 0 N-CA-C 108.223 -1.028 . . . . 2.8599999999999999 108.223 174.023 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . 0.433 ' HA ' HG22 ' B' ' 42' ' ' VAL 0.266 53.5 tttm -54.28 -45.7 72.54 Favored 'General case' 0 N--CA 1.451 -0.423 0 C-N-CA 118.602 -1.239 . . . . 3.9500000000000002 110.24 -175.113 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -57.93 -39.62 78.48 Favored 'General case' 0 N--CA 1.448 -0.573 0 CA-C-O 119.116 -0.468 . . . . 2.8300000000000001 112.219 176.873 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 4.7 tt -66.87 -46.01 76.33 Favored 'General case' 0 C--O 1.236 0.385 0 CA-C-N 119.626 1.103 . . . . 1.6799999999999999 109.699 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.433 HG22 ' HA ' ' B' ' 39' ' ' LYS . 27.4 m -69.94 -44.27 78.76 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.232 0 CA-C-O 121.551 0.691 . . . . 0.66000000000000003 109.219 -173.566 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 86.8 m -66.0 -49.98 65.88 Favored 'General case' 0 N--CA 1.447 -0.615 0 C-N-CA 124.262 1.025 . . . . 1.22 109.855 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 12.8 tt0 -80.52 -62.46 1.67 Allowed 'General case' 0 CA--C 1.532 0.264 0 C-N-CA 122.256 0.222 . . . . 1.98 111.173 -171.471 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 18.4 tt0 -83.9 -44.12 14.59 Favored 'General case' 0 CA--C 1.529 0.146 0 C-N-CA 122.897 0.479 . . . . 2.7000000000000002 112.14 -167.867 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.8 tp -82.71 -18.79 0.26 Allowed Pre-proline 0 CA--C 1.548 0.869 0 N-CA-C 118.768 2.877 . . . . 1.78 118.768 -167.54 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -46.2 -44.6 19.53 Favored 'Trans proline' 0 CA--C 1.534 0.495 0 C-N-CA 124.091 3.194 . . . . 2.4700000000000002 117.158 -133.813 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 30.0 t-80 -62.47 -44.26 96.82 Favored 'General case' 0 CA--C 1.534 0.344 0 N-CA-C 113.182 0.808 . . . . 2.2000000000000002 113.182 -172.222 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.5 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 12.0 tp -57.34 -77.04 0.03 OUTLIER 'General case' 0 CA--C 1.534 0.336 0 C-N-CA 124.604 1.162 . . . . 1.1799999999999999 112.6 -163.654 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 5.8 mt -67.06 -40.75 87.17 Favored 'General case' 0 C--N 1.339 0.144 0 O-C-N 121.728 -0.608 . . . . 3.9700000000000002 110.336 179.569 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 12.1 tptp 62.82 171.28 0.14 Allowed 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.194 0.998 . . . . 7.5999999999999996 111.611 -174.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 12.9 t0 46.66 62.41 2.34 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-O 123.812 1.768 . . . . 3.7000000000000002 108.623 -160.418 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 26.9 m -84.19 28.17 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 112.446 -2.161 . . . . 2.2200000000000002 109.933 162.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -104.61 -63.75 0.66 Allowed Glycine 0 C--N 1.341 0.821 0 N-CA-C 107.654 -2.178 . . . . 2.5699999999999998 107.654 172.093 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -79.75 54.4 1.82 Allowed 'General case' 0 CA--C 1.535 0.368 0 C-N-CA 124.851 1.261 . . . . 3.3399999999999999 110.315 -174.73 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -61.26 -35.68 77.94 Favored 'General case' 0 N--CA 1.445 -0.718 0 C-N-CA 125.134 1.373 . . . . 1.1799999999999999 110.224 -172.443 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -29.26 -57.88 0.15 Allowed 'General case' 0 N--CA 1.464 0.225 0 C-N-CA 126.367 1.867 . . . . 4.0 114.125 171.178 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -49.09 -60.29 2.91 Favored 'General case' 0 C--O 1.233 0.234 0 C-N-CA 124.053 0.941 . . . . 2.3199999999999998 109.528 -179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 2.9 mtmt -61.1 -49.04 78.91 Favored 'General case' 0 N--CA 1.446 -0.661 0 CA-C-N 114.893 -1.049 . . . . 4.5300000000000002 109.672 -176.948 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 13.8 tmm? -51.8 -51.96 52.61 Favored 'General case' 0 CA--C 1.53 0.205 0 CA-C-N 118.953 0.797 . . . . 2.1400000000000001 110.83 178.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 73.9 mttt -64.94 -34.73 79.11 Favored 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 122.729 0.412 . . . . 3.8300000000000001 110.978 -178.593 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 5.3 t -67.72 -37.17 81.85 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.387 0.675 . . . . 1.6399999999999999 111.774 174.796 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 79.5 mt -69.13 -58.81 3.57 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 124.019 0.928 . . . . 1.4399999999999999 109.482 177.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . 0.417 ' O ' ' N ' ' B' ' 66' ' ' ASN 0.314 2.1 t70 -55.8 -9.51 0.57 Allowed 'General case' 0 C--O 1.221 -0.407 0 N-CA-C 117.461 2.393 . . . . 2.8399999999999999 117.461 -165.638 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 28.1 m -34.54 -24.92 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.473 0.685 0 C-N-CA 129.172 2.989 . . . . 1.4399999999999999 118.717 -127.627 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . 0.417 ' N ' ' O ' ' B' ' 64' ' ' ASP . 0.3 OUTLIER -53.2 -34.56 57.54 Favored 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 119.816 1.189 . . . . 3.6499999999999999 111.232 160.784 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 86.4 mt-30 66.07 56.12 0.86 Allowed 'General case' 0 C--N 1.34 0.195 0 C-N-CA 125.751 1.621 . . . . 4.0999999999999996 111.727 171.078 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -89.96 -33.05 16.53 Favored 'General case' 0 CA--C 1.537 0.459 0 CA-C-N 114.651 -1.159 . . . . 3.5499999999999998 109.374 158.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 4.1 m 101.3 -4.27 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.414 0 C-N-CA 128.154 2.581 . . . . 2.3999999999999999 114.005 175.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -101.22 132.54 46.67 Favored 'General case' 0 C--O 1.237 0.445 0 N-CA-C 106.401 -1.703 . . . . 5.2800000000000002 106.401 164.905 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -99.79 118.5 36.39 Favored 'General case' 0 N--CA 1.444 -0.759 0 N-CA-C 106.61 -1.626 . . . . 1.1499999999999999 106.61 -167.75 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 6.9 tptm -79.74 176.37 9.78 Favored 'General case' 0 C--O 1.237 0.404 0 C-N-CA 123.841 0.856 . . . . 3.1200000000000001 109.104 -171.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 8.6 t80 -80.4 76.1 7.23 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 107.911 -1.144 . . . . 4.4199999999999999 107.911 -174.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 97.91 53.98 0.0 OUTLIER 'General case' 0 CA--C 1.533 0.304 1 C-N-CA 133.589 4.756 . . . . 2.1499999999999999 108.922 -164.812 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 37.5 mt-10 -87.89 -61.84 1.63 Allowed 'General case' 0 N--CA 1.449 -0.513 0 O-C-N 121.092 -1.005 . . . . 1.73 108.6 107.655 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 9.2 p90 -45.11 -43.64 9.84 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.651 1.18 . . . . 6.0099999999999998 114.076 -162.176 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.626 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 16.9 t-105 -39.94 -36.62 0.48 Allowed 'General case' 0 N--CA 1.449 -0.492 0 C-N-CA 125.416 1.487 . . . . 4.7699999999999996 112.495 177.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 10.4 mtt180 -38.36 -51.06 1.52 Allowed 'General case' 0 N--CA 1.468 0.459 0 CA-C-N 119.434 1.016 . . . . 4.6299999999999999 111.601 175.025 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 2.7 tp -53.36 -38.77 63.6 Favored 'General case' 0 N--CA 1.45 -0.426 0 O-C-N 123.099 0.25 . . . . 1.1299999999999999 110.627 -175.356 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 70.7 mt -63.42 -25.47 38.48 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.378 0 CA-C-O 121.729 0.776 . . . . 1.55 109.604 -174.063 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.552 ' CA ' ' CE2' ' A' ' 77' ' ' TRP . . . -74.48 -40.88 38.24 Favored Glycine 0 CA--C 1.49 -1.531 0 N-CA-C 109.674 -1.37 . . . . 1.3300000000000001 109.674 179.076 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.4 mm-40 -64.94 -52.93 53.67 Favored 'General case' 0 N--CA 1.43 -1.465 0 N-CA-C 105.559 -2.015 . . . . 2.3399999999999999 105.559 178.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.5 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 9.5 mp -42.22 -61.56 1.14 Allowed 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 119.646 1.112 . . . . 2.1000000000000001 111.709 172.232 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.44 -44.38 92.95 Favored 'General case' 0 CA--C 1.531 0.249 0 CA-C-O 121.771 0.796 . . . . 1.1599999999999999 111.805 -175.614 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 28.8 ttmt -62.69 -55.0 30.87 Favored 'General case' 0 N--CA 1.449 -0.487 0 C-N-CA 125.246 1.419 . . . . 1.6200000000000001 110.426 -179.061 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 -57.62 -44.62 85.65 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 124.056 0.942 . . . . 2.3999999999999999 109.834 -170.922 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . 0.42 HG13 ' CD1' ' A' ' 13' ' ' ILE . 0.2 OUTLIER -39.89 -48.34 0.56 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.466 0 C-N-CA 125.433 1.493 . . . . 1.5700000000000001 112.67 166.149 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.54 -34.05 31.38 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 124.234 1.014 . . . . 3.9300000000000002 110.606 -179.079 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 43.4 mttm -132.36 103.46 6.22 Favored 'General case' 0 C--O 1.223 -0.305 0 C-N-CA 126.353 1.861 . . . . 5.8899999999999997 110.731 -163.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 54.7 pttt -38.95 -44.3 1.06 Allowed 'General case' 0 CA--C 1.541 0.598 0 C-N-CA 124.326 1.05 . . . . 6.4699999999999998 113.139 173.09 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 32.2 tttt -168.85 28.85 0.02 OUTLIER 'General case' 0 N--CA 1.475 0.8 0 CA-C-O 121.648 0.737 . . . . 6.5700000000000003 111.889 162.06 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -85.3 59.43 5.63 Favored 'General case' 0 C--O 1.235 0.296 0 C-N-CA 124.881 1.272 . . . . 4.7300000000000004 110.122 -155.459 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 18.0 tp -116.43 -77.02 0.57 Allowed 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 124.776 1.23 . . . . 6.2300000000000004 108.635 -177.367 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 173.86 177.8 0.12 Allowed 'General case' 0 N--CA 1.464 0.236 0 C-N-CA 126.412 1.885 . . . . 7.5899999999999999 108.295 179.06 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -128.74 110.43 21.04 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 N-CA-C 105.881 -1.896 . . . . 7.4900000000000002 105.881 161.2 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 4.9 ttt-85 -177.82 167.72 2.11 Favored 'General case' 0 C--O 1.236 0.354 0 C-N-CA 125.464 1.506 . . . . 6.7000000000000002 107.891 179.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 27.7 tptp -177.33 138.78 0.24 Allowed 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 105.051 -2.203 . . . . 10.1 105.051 -158.621 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.252 1.19 0 N-CA-C 105.52 -2.03 . . . . 7.5899999999999999 105.52 160.938 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.1 mtt . . . . . 0 N--CA 1.474 0.742 0 N-CA-C 109.676 -0.49 . . . . 6.5599999999999996 109.676 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -151.55 176.73 11.04 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.681 1.192 . . . . 2.7799999999999998 108.007 -178.851 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.0 92.45 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.228 0 C-N-CA 129.142 2.977 . . . . 3.4100000000000001 109.866 -173.83 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 6.8 tp10 -73.76 131.14 82.3 Favored Pre-proline 0 N--CA 1.443 -0.822 0 C-N-CA 124.834 1.254 . . . . 6.2199999999999998 109.967 -172.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -71.97 96.85 0.79 Allowed 'Trans proline' 0 N--CA 1.454 -0.827 0 C-N-CA 122.575 2.183 . . . . 2.75 110.308 179.206 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 93.4 mt -57.83 157.52 7.44 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 123.574 0.75 . . . . 1.71 111.033 173.614 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.407 HG23 ' H ' ' A' ' 10' ' ' GLU . 4.4 t -75.24 159.79 31.13 Favored 'General case' 0 CA--C 1.53 0.176 0 N-CA-C 108.806 -0.813 . . . . 2.4900000000000002 108.806 176.426 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 68.2 tt0 -51.1 -45.95 61.68 Favored 'General case' 0 C--O 1.226 -0.143 0 C-N-CA 123.481 0.712 . . . . 4.2800000000000002 110.803 -177.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.4 mt -64.74 -55.97 16.56 Favored 'General case' 0 CA--C 1.536 0.406 0 CA-C-O 118.396 -0.811 . . . . 1.5900000000000001 111.028 -177.929 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.407 ' H ' HG23 ' A' ' 7' ' ' THR . 97.9 mt-10 -49.24 -54.29 17.44 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 125.155 1.382 . . . . 2.1899999999999999 110.678 176.846 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 8.4 tp10 -50.26 -59.89 3.51 Favored 'General case' 0 N--CA 1.448 -0.567 0 C-N-CA 124.377 1.071 . . . . 3.8999999999999999 109.609 174.997 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 82.1 p -56.61 -43.75 80.49 Favored 'General case' 0 CA--C 1.533 0.312 0 O-C-N 121.558 -0.714 . . . . 1.5600000000000001 111.296 -174.494 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.308 2.7 pp -66.81 -42.94 89.94 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.4 0 CA-C-O 118.743 -0.646 . . . . 0.68999999999999995 110.44 -178.921 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -61.04 -49.95 75.3 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 119.435 -0.906 . . . . 3.4100000000000001 109.912 175.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 m -46.02 -51.38 13.69 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 126.005 1.722 . . . . 1.7 112.64 175.157 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 30.1 m -71.64 -40.33 70.59 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.265 0 O-C-N 120.335 -1.478 . . . . 0.73999999999999999 110.163 178.634 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 36.2 t -55.07 -43.03 68.03 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.23 0 C-N-CA 123.024 0.53 . . . . 0.72999999999999998 110.586 178.294 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 8.7 t -61.99 -52.61 63.3 Favored 'General case' 0 CA--C 1.536 0.409 0 CA-C-N 119.276 0.944 . . . . 0.92000000000000004 110.716 178.027 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.9 m -57.69 -50.71 72.29 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 119.584 1.084 . . . . 1.1200000000000001 110.529 -179.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -45.21 -55.59 5.66 Favored 'General case' 0 CA--C 1.528 0.122 0 C-N-CA 124.965 1.306 . . . . 2.9900000000000002 110.517 171.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -58.16 -51.93 67.69 Favored 'General case' 0 N--CA 1.453 -0.281 0 C-N-CA 123.953 0.901 . . . . 3.9500000000000002 110.58 -177.527 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 12.4 p -56.69 -38.74 72.69 Favored 'General case' 0 CA--C 1.531 0.219 0 CA-C-O 119.41 -0.329 . . . . 2.3100000000000001 111.306 -179.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 27.0 m-85 -65.32 -52.88 51.01 Favored 'General case' 0 C--O 1.223 -0.327 0 CA-C-O 121.386 0.612 . . . . 2.52 110.983 171.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.2 -19.88 65.64 Favored 'General case' 0 N--CA 1.45 -0.436 0 C-N-CA 125.143 1.377 . . . . 0.85999999999999999 112.062 -170.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.31 -33.32 75.57 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-O 117.977 -1.011 . . . . 6.0199999999999996 110.148 173.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.421 ' HB3' ' HG3' ' A' ' 27' ' ' GLU . 0.0 OUTLIER -38.99 -77.17 0.02 OUTLIER 'General case' 0 N--CA 1.468 0.469 0 C-N-CA 123.86 0.864 . . . . 2.52 112.411 -173.11 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . 0.421 ' HG3' ' HB3' ' A' ' 26' ' ' GLN . 71.9 mt-10 -100.96 173.38 6.51 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 127.203 2.201 . . . . 2.4900000000000002 106.663 -174.777 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -33.42 141.29 0.08 OUTLIER Glycine 0 CA--C 1.538 1.49 0 C-N-CA 125.978 1.752 . . . . 1.49 115.214 -173.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 1.8 mpt_? 62.2 105.32 0.03 OUTLIER 'General case' 0 C--O 1.237 0.438 0 C-N-CA 125.22 1.408 . . . . 4.6500000000000004 111.753 -177.996 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 65.1 pttt -73.34 50.6 0.31 Allowed 'General case' 0 CA--C 1.539 0.521 0 N-CA-C 113.281 0.845 . . . . 3.6000000000000001 113.281 176.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.7 p-10 -172.31 -32.6 0.01 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 127.429 2.292 . . . . 3.4700000000000002 109.346 171.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 10.7 m -78.11 130.08 35.96 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 108.755 -0.831 . . . . 2.2999999999999998 108.755 170.85 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -83.54 154.12 24.0 Favored 'General case' 0 CA--C 1.533 0.29 0 N-CA-C 106.449 -1.686 . . . . 2.0699999999999998 106.449 162.659 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.4 m -122.46 170.88 9.53 Favored 'General case' 0 C--N 1.328 -0.332 0 N-CA-C 107.204 -1.406 . . . . 2.98 107.204 161.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 12.1 p -48.48 -52.1 9.28 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.279 0 N-CA-C 112.804 0.668 . . . . 2.0899999999999999 112.804 -165.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 11.8 t30 -62.82 -57.74 9.83 Favored 'General case' 0 N--CA 1.455 -0.211 0 CA-C-O 118.555 -0.736 . . . . 2.5299999999999998 109.798 -178.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -38.47 -51.1 1.57 Allowed 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 125.08 1.352 . . . . 1.6599999999999999 111.413 174.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -61.77 -49.02 78.03 Favored 'General case' 0 N--CA 1.445 -0.691 0 CA-C-N 114.966 -1.016 . . . . 3.1499999999999999 109.716 179.431 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 22.3 tttt -59.95 -39.57 86.03 Favored 'General case' 0 N--CA 1.448 -0.553 0 CA-C-O 118.671 -0.68 . . . . 4.0099999999999998 110.33 -176.574 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.6 mm-40 -53.66 -44.05 69.33 Favored 'General case' 0 CA--C 1.531 0.225 0 CA-C-N 118.259 0.481 . . . . 3.6800000000000002 110.753 171.755 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 9.2 tt -63.12 -49.61 73.75 Favored 'General case' 0 CA--C 1.518 -0.271 0 N-CA-C 108.523 -0.917 . . . . 3.21 108.523 -173.154 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 5.5 m -68.95 -52.21 36.63 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.505 0 N-CA-C 108.852 -0.796 . . . . 1.24 108.852 -175.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.9 m -52.79 -51.56 60.25 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.5 1.12 . . . . 1.6899999999999999 111.199 -179.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 18.3 tt0 -72.43 -50.89 23.05 Favored 'General case' 0 N--CA 1.447 -0.603 0 C-N-CA 122.543 0.337 . . . . 3.5899999999999999 110.268 -175.041 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.1 tp60 -94.69 -26.63 16.23 Favored 'General case' 0 CA--C 1.533 0.294 0 N-CA-C 113.094 0.776 . . . . 4.1200000000000001 113.094 -161.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 10.8 mp -107.96 93.42 10.76 Favored Pre-proline 0 CA--C 1.538 0.498 0 CA-C-N 119.167 0.894 . . . . 2.2599999999999998 110.11 -175.879 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 69.6 Cg_endo -72.07 -44.34 0.91 Allowed 'Trans proline' 0 N--CA 1.455 -0.773 0 C-N-CA 122.24 1.96 . . . . 2.3599999999999999 111.453 -177.97 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.2 t-160 -150.63 44.33 0.84 Allowed 'General case' 0 CA--C 1.532 0.269 0 CA-C-O 121.161 0.505 . . . . 3.8399999999999999 110.692 -174.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 19.8 tp -95.48 -80.98 0.41 Allowed 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 107.01 -1.478 . . . . 1.95 107.01 167.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 60.3 mt -75.73 84.24 2.72 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.279 -0.637 . . . . 2.2999999999999998 109.279 172.829 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -44.01 143.48 1.12 Allowed 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.664 -0.698 . . . . 5.7300000000000004 110.718 163.38 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 1.7 m-20 67.43 39.11 3.0 Favored 'General case' 0 CA--C 1.53 0.198 0 C-N-CA 125.774 1.63 . . . . 4.1900000000000004 110.475 177.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -49.83 -25.59 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.452 0 C-N-CA 125.96 1.704 . . . . 3.1499999999999999 113.991 -177.941 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -47.53 -44.08 21.85 Favored Glycine 0 CA--C 1.532 1.143 0 N-CA-C 111.183 -0.767 . . . . 1.9099999999999999 111.183 170.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 47.1 t -74.66 45.79 0.26 Allowed 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 126.113 1.765 . . . . 2.8500000000000001 111.038 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.7 tm? -66.04 -49.92 66.0 Favored 'General case' 0 N--CA 1.445 -0.725 0 O-C-N 120.846 -1.159 . . . . 1.5700000000000001 108.347 174.585 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -52.12 -38.15 56.49 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.797 1.639 . . . . 4.1100000000000003 111.904 -167.429 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 44.2 tt0 -55.41 -53.69 53.03 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 121.755 -0.591 . . . . 3.2599999999999998 110.925 170.993 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -59.45 -46.06 89.82 Favored 'General case' 0 N--CA 1.453 -0.276 0 N-CA-C 108.974 -0.75 . . . . 2.75 108.974 175.789 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . 0.432 ' HA ' HD12 ' A' ' 63' ' ' LEU . 18.7 tmm? -44.91 -52.72 8.38 Favored 'General case' 0 C--N 1.343 0.303 0 C-N-CA 123.875 0.87 . . . . 1.8799999999999999 109.158 179.584 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 24.3 mtpp -68.82 -39.89 79.79 Favored 'General case' 0 CA--C 1.539 0.527 0 CA-C-N 115.843 -0.617 . . . . 4.6600000000000001 111.423 -179.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 22.1 t -58.73 -30.04 67.17 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 112.895 0.702 . . . . 2.5899999999999999 112.895 175.644 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.542 HD23 ' HB2' ' A' ' 78' ' ' ARG . 0.1 OUTLIER -88.43 -45.26 10.11 Favored 'General case' 0 CA--C 1.534 0.357 0 O-C-N 121.536 -0.727 . . . . 1.96 109.431 175.717 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 47.9 t0 -75.2 61.25 1.13 Allowed 'General case' 0 C--N 1.342 0.256 0 C-N-CA 124.775 1.23 . . . . 1.6399999999999999 111.012 -178.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 25.7 m -58.67 -34.11 50.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.286 0 C-N-CA 123.934 0.894 . . . . 1.79 112.281 -174.558 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.4 p-10 -82.74 -8.4 59.59 Favored 'General case' 0 CA--C 1.533 0.325 0 N-CA-C 112.347 0.499 . . . . 2.4900000000000002 112.347 177.189 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . 0.266 2.9 tp60 50.93 66.55 1.14 Allowed 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 126.878 2.071 . . . . 4.4100000000000001 113.407 178.25 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.8 p30 -113.17 -4.98 13.69 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 124.685 1.194 . . . . 2.4500000000000002 111.774 176.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 16.4 m 62.53 15.38 7.84 Favored 'General case' 0 CA--C 1.539 0.537 0 C-N-CA 124.304 1.041 . . . . 1.98 113.454 -171.995 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 14.4 mt-10 -112.11 109.6 19.42 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 125.602 1.561 . . . . 3.4700000000000002 107.066 165.046 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -88.35 74.86 8.58 Favored 'General case' 0 N--CA 1.442 -0.85 0 N-CA-C 105.472 -2.047 . . . . 1.3600000000000001 105.472 170.68 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.68 159.91 33.57 Favored 'General case' 0 CA--C 1.532 0.254 0 CA-C-O 121.008 0.433 . . . . 3.3199999999999998 110.886 177.488 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 15.5 p90 -37.59 -55.96 1.07 Allowed 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.888 1.675 . . . . 5.4100000000000001 114.057 -162.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -66.11 -40.27 90.59 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-N 118.85 0.75 . . . . 2.3100000000000001 111.721 -177.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 5.0 pt-20 -76.46 -44.0 37.52 Favored 'General case' 0 C--N 1.33 -0.258 0 CA-C-N 120.087 1.312 . . . . 2.1200000000000001 109.686 -179.175 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 24.6 t80 -44.55 -50.16 9.73 Favored 'General case' 0 N--CA 1.465 0.294 0 CA-C-N 118.551 0.614 . . . . 3.3500000000000001 109.961 167.784 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.634 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 1.2 t-105 -46.51 -32.23 3.23 Favored 'General case' 0 N--CA 1.448 -0.534 0 CA-C-O 116.938 -1.506 . . . . 4.0300000000000002 112.418 179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.542 ' HB2' HD23 ' A' ' 63' ' ' LEU . 0.5 OUTLIER -38.69 -49.08 1.55 Allowed 'General case' 0 N--CA 1.478 0.946 0 CA-C-N 120.694 1.588 . . . . 4.6799999999999997 109.939 172.621 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.8 tp -48.42 -46.04 37.0 Favored 'General case' 0 N--CA 1.449 -0.509 0 C-N-CA 123.834 0.854 . . . . 0.81999999999999995 110.251 -176.545 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 91.3 mt -62.99 -31.77 53.74 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.299 0 N-CA-C 109.12 -0.696 . . . . 1.74 109.12 -171.137 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.556 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -67.99 -45.71 71.19 Favored Glycine 0 CA--C 1.488 -1.624 0 N-CA-C 109.656 -1.378 . . . . 1.23 109.656 178.046 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.0 mm-40 -69.33 -49.03 59.51 Favored 'General case' 0 N--CA 1.422 -1.873 0 N-CA-C 105.825 -1.917 . . . . 2.3900000000000001 105.825 -173.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 9.5 mt -41.26 -59.1 1.62 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-N 120.881 1.673 . . . . 2.4500000000000002 111.631 166.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.36 -30.74 63.05 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.513 0.725 . . . . 1.29 111.716 -179.654 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.63 -57.23 4.93 Favored 'General case' 0 N--CA 1.448 -0.533 0 C-N-CA 123.228 0.611 . . . . 1.8 110.439 171.001 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -50.25 -48.05 54.86 Favored 'General case' 0 N--CA 1.453 -0.297 0 C-N-CA 128.689 2.796 . . . . 2.2200000000000002 108.968 -174.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 4.8 tt -61.6 -21.22 24.97 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.666 0 N-CA-C 113.849 1.055 . . . . 1.96 113.849 179.055 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 49.8 ttt85 -96.8 -60.37 1.61 Allowed 'General case' 0 CA--C 1.537 0.476 0 C-N-CA 125.303 1.441 . . . . 5.3099999999999996 109.129 178.861 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 40.5 pttt -70.76 7.12 1.21 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.432 1.093 . . . . 3.9199999999999999 113.799 -179.381 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 23.1 tttt -50.46 -27.48 6.57 Favored 'General case' 0 N--CA 1.469 0.502 0 C-N-CA 125.561 1.544 . . . . 8.5600000000000005 114.472 -164.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 43.5 tttp -160.95 -35.27 0.05 OUTLIER 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.68 0.792 . . . . 8.6699999999999999 111.065 171.875 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.7 t0 20.27 63.48 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 128.873 2.869 . . . . 6.3300000000000001 115.083 -178.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 3.2 pp -129.24 -44.53 1.26 Allowed 'General case' 0 C--N 1.333 -0.139 0 C-N-CA 125.46 1.504 . . . . 10.039999999999999 107.288 163.822 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 33.7 mttm -64.42 81.55 0.03 OUTLIER 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 106.887 -1.523 . . . . 13.41 106.887 149.759 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 9.1 tp -48.03 152.26 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.471 0 C-N-CA 129.921 3.288 . . . . 12.960000000000001 114.441 -167.358 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . 0.286 15.9 ptt180 56.9 -160.25 0.23 Allowed 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 127.023 2.129 . . . . 17.800000000000001 112.907 167.213 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -177.78 68.54 0.02 OUTLIER 'General case' 0 N--CA 1.461 0.086 0 N-CA-C 106.943 -1.503 . . . . 13.81 106.943 -161.772 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . 2.406 50.8 mtmt . . . . . 0 C--O 1.252 1.208 0 N-CA-C 105.701 -1.963 . . . . 12.19 105.701 -144.329 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.438 34.2 ttm . . . . . 0 N--CA 1.473 0.72 0 N-CA-C 108.808 -0.812 . . . . 10.17 108.808 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -149.2 -167.63 2.88 Favored 'General case' 0 CA--C 1.523 -0.093 0 C-N-CA 124.497 1.119 . . . . 5.9299999999999997 110.001 -165.078 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 103.67 100.68 0.01 OUTLIER 'General case' 0 N--CA 1.452 -0.363 0 C-N-CA 129.721 3.209 . . . . 6.8700000000000001 111.375 -171.486 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 26.8 tt0 -75.75 -48.37 3.79 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 126.808 2.043 . . . . 10.07 115.065 -173.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 66.4 Cg_endo -71.56 107.62 2.21 Favored 'Trans proline' 0 C--N 1.35 0.616 0 C-N-CA 121.503 1.469 . . . . 3.3500000000000001 110.869 -168.795 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 42.3 mt -135.75 -168.22 2.17 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.419 1.488 . . . . 3.7400000000000002 109.097 -172.569 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 11.6 t -75.57 178.62 5.87 Favored 'General case' 0 N--CA 1.464 0.275 0 CA-C-N 119.123 0.874 . . . . 2.3399999999999999 109.94 -177.704 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 40.8 tt0 -61.59 -63.09 1.38 Allowed 'General case' 0 N--CA 1.452 -0.341 0 CA-C-O 121.526 0.679 . . . . 3.4100000000000001 110.508 -172.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 1.3 mp -56.48 -44.13 80.33 Favored 'General case' 0 N--CA 1.451 -0.415 0 O-C-N 121.447 -0.783 . . . . 2.0800000000000001 109.783 -175.613 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 23.8 tt0 -53.41 -46.03 69.59 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 126.541 1.936 . . . . 3.8199999999999998 112.244 173.75 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.65 -51.44 69.37 Favored 'General case' 0 CA--C 1.53 0.205 0 O-C-N 121.468 -0.77 . . . . 4.7300000000000004 109.225 176.353 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 91.7 p -65.98 -41.01 91.7 Favored 'General case' 0 N--CA 1.453 -0.313 0 CA-C-N 116.074 -0.512 . . . . 2.0699999999999998 110.721 -171.833 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.279 2.4 pp -64.16 -39.46 85.56 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.549 0 CA-C-O 118.264 -0.874 . . . . 1.26 109.299 174.482 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tp10 -62.0 -45.92 91.48 Favored 'General case' 0 CA--C 1.534 0.355 0 C-N-CA 117.564 -1.655 . . . . 4.8799999999999999 112.469 173.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . 0.266 1.1 t -56.43 -35.27 67.65 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 120.313 1.415 . . . . 1.4199999999999999 110.98 -174.428 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 20.7 m -77.0 -34.12 21.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.508 0 O-C-N 120.684 -1.26 . . . . 1.1599999999999999 112.34 171.328 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 60.2 t -53.82 -51.22 46.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.52 0 CA-C-N 120.722 1.601 . . . . 1.27 110.496 169.835 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.3 t -65.03 -43.19 93.23 Favored 'General case' 0 CA--C 1.534 0.337 0 CA-C-N 118.819 0.736 . . . . 1.21 110.348 -177.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 72.0 m -55.94 -53.47 56.42 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 118.512 0.596 . . . . 1.1499999999999999 110.28 174.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 10.0 t80 -47.28 -55.34 8.88 Favored 'General case' 0 CA--C 1.532 0.275 0 C-N-CA 123.975 0.91 . . . . 4.21 109.951 172.652 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -56.41 -52.89 62.95 Favored 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 125.764 1.626 . . . . 2.5499999999999998 110.819 -173.757 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 3.8 t -63.99 -25.2 68.02 Favored 'General case' 0 CA--C 1.534 0.355 0 O-C-N 122.134 -0.354 . . . . 2.5600000000000001 111.42 -175.332 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 21.9 m-85 -80.95 -44.1 18.74 Favored 'General case' 0 C--O 1.222 -0.371 0 CA-C-N 119.159 0.89 . . . . 2.9199999999999999 110.921 168.18 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.52 -32.59 70.44 Favored 'General case' 0 N--CA 1.45 -0.474 0 C-N-CA 124.712 1.205 . . . . 1.6399999999999999 110.572 -172.363 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -61.72 -20.05 63.08 Favored 'General case' 0 N--CA 1.454 -0.248 0 CA-C-O 117.315 -1.326 . . . . 4.4299999999999997 113.366 177.721 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -55.98 -67.16 0.32 Allowed 'General case' 0 CA--C 1.536 0.442 0 N-CA-C 115.462 1.653 . . . . 2.2799999999999998 115.462 -155.413 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -91.92 -77.03 0.44 Allowed 'General case' 0 CA--C 1.531 0.227 0 C-N-CA 119.394 -0.922 . . . . 2.77 113.062 -168.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -92.18 169.05 31.62 Favored Glycine 0 C--N 1.336 0.575 0 C-N-CA 127.555 2.502 . . . . 2.52 110.604 160.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 12.1 mmt180 48.29 98.54 0.01 OUTLIER 'General case' 0 CA--C 1.541 0.599 0 N-CA-C 113.949 1.092 . . . . 4.6299999999999999 113.949 137.219 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 18.0 pttm -77.9 51.18 0.93 Allowed 'General case' 0 CA--C 1.54 0.561 0 C-N-CA 126.318 1.847 . . . . 4.46 112.804 -174.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 19.5 p30 -172.36 -51.17 0.02 OUTLIER 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 126.102 1.761 . . . . 3.5600000000000001 108.387 -163.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 53.7 p -74.23 150.06 40.5 Favored 'General case' 0 C--O 1.237 0.434 0 C-N-CA 123.045 0.538 . . . . 1.79 110.306 170.711 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.3 mp -123.71 119.73 30.63 Favored 'General case' 0 C--O 1.225 -0.202 0 C-N-CA 123.17 0.588 . . . . 2.8799999999999999 110.044 161.748 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 50.1 m -90.35 175.63 7.03 Favored 'General case' 0 C--O 1.233 0.229 0 N-CA-C 108.869 -0.789 . . . . 2.5600000000000001 108.869 170.71 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 11.0 p -84.03 51.77 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 O-C-N 121.004 -1.06 . . . . 2.6600000000000001 110.709 -175.58 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 53.2 t30 -159.93 55.1 0.36 Allowed 'General case' 0 N--CA 1.451 -0.381 0 N-CA-C 106.084 -1.821 . . . . 3.0800000000000001 106.084 159.365 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -178.49 -56.12 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.163 0 C-N-CA 127.9 2.48 . . . . 1.9399999999999999 104.546 -166.151 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 2.0 t80 -60.1 -59.38 5.51 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 108.604 -0.887 . . . . 3.4500000000000002 108.604 165.228 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 54.3 tttt -58.18 -35.83 72.17 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 119.903 -0.719 . . . . 2.4700000000000002 111.365 -174.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 75.8 mt-10 -49.56 -42.8 45.15 Favored 'General case' 0 CA--C 1.532 0.263 0 CA-C-O 119.302 -0.38 . . . . 4.2699999999999996 111.9 172.694 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.4 tp -66.42 -49.15 67.73 Favored 'General case' 0 N--CA 1.456 -0.171 0 N-CA-C 108.773 -0.825 . . . . 1.9199999999999999 108.773 -172.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.424 ' HA ' HD23 ' B' ' 46' ' ' LEU . 9.4 m -69.09 -38.16 77.79 Favored 'Isoleucine or valine' 0 C--O 1.226 -0.163 0 CA-C-N 116.083 -0.508 . . . . 0.72999999999999998 110.016 -174.182 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 94.1 m -61.1 -54.86 39.41 Favored 'General case' 0 N--CA 1.448 -0.557 0 CA-C-N 116.124 -0.489 . . . . 1.26 110.134 173.717 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 7.9 tt0 -82.01 -60.35 2.26 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 123.686 0.794 . . . . 2.0299999999999998 112.884 -167.724 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -81.23 -38.95 26.12 Favored 'General case' 0 C--O 1.232 0.15 0 N-CA-C 114.276 1.213 . . . . 2.8900000000000001 114.276 -160.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' B' ' 42' ' ' VAL . 1.4 mm? -48.93 -44.3 70.23 Favored Pre-proline 0 CA--C 1.532 0.271 0 N-CA-C 114.922 1.453 . . . . 2.1200000000000001 114.922 -155.287 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_endo -77.51 -36.13 1.35 Allowed 'Trans proline' 0 N--CA 1.448 -1.177 0 N-CA-C 108.92 -1.223 . . . . 2.4700000000000002 108.92 -44.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 1.2 t-80 -88.79 -35.74 16.47 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 125.231 1.412 . . . . 2.6200000000000001 110.373 -173.375 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.544 HD23 ' HB2' ' B' ' 83' ' ' LEU . 15.9 tp -42.14 -63.53 0.73 Allowed 'General case' 0 CA--C 1.536 0.426 0 N-CA-C 114.043 1.127 . . . . 1.1899999999999999 114.043 -172.593 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 35.4 mt -83.39 162.57 21.0 Favored 'General case' 0 C--N 1.338 0.107 0 CA-C-O 121.459 0.647 . . . . 2.04 109.4 175.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' B' ' 86' ' ' GLU . 0.0 OUTLIER -142.44 154.03 44.21 Favored 'General case' 0 N--CA 1.447 -0.586 0 C-N-CA 124.762 1.225 . . . . 5.5899999999999999 108.002 178.315 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 30.2 t0 66.68 82.11 0.19 Allowed 'General case' 0 N--CA 1.452 -0.348 0 C-N-CA 126.486 1.914 . . . . 3.75 109.461 -164.557 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 34.7 m -93.93 11.5 3.69 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.579 0 CA-C-N 113.735 -1.575 . . . . 1.9299999999999999 109.485 162.96 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -81.57 -71.17 1.3 Allowed Glycine 0 C--N 1.339 0.738 0 N-CA-C 106.703 -2.559 . . . . 2.5099999999999998 106.703 174.807 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -80.33 55.11 2.16 Favored 'General case' 0 CA--C 1.531 0.226 0 CA-C-O 123.13 1.443 . . . . 3.0600000000000001 109.652 -179.154 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -60.66 -34.33 74.15 Favored 'General case' 0 N--CA 1.439 -1.018 0 C-N-CA 124.235 1.014 . . . . 1.1799999999999999 108.774 176.237 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -44.69 -46.28 10.23 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.4 1.48 . . . . 4.2400000000000002 112.075 171.841 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 39.7 tt0 -55.49 -48.54 74.42 Favored 'General case' 0 C--O 1.233 0.215 0 CA-C-N 118.635 0.652 . . . . 2.6699999999999999 110.215 177.309 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.6 mmpt? -59.15 -51.67 69.0 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 107.36 -1.348 . . . . 3.3799999999999999 107.36 177.385 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 9.9 tmm? -50.26 -60.57 2.85 Favored 'General case' 0 C--O 1.227 -0.081 0 C-N-CA 124.841 1.256 . . . . 2.8900000000000001 110.233 -174.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 1.4 ptpt -59.19 -36.85 76.07 Favored 'General case' 0 N--CA 1.453 -0.276 0 CA-C-O 119.591 -0.242 . . . . 4.9800000000000004 111.6 -175.647 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 23.1 t -68.93 -38.2 79.36 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 123.943 0.897 . . . . 1.7 111.348 178.53 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 24.0 mt -73.4 -54.26 8.74 Favored 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 124.28 1.032 . . . . 1.53 109.992 -179.307 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 22.1 t0 -62.88 -10.2 12.45 Favored 'General case' 0 C--O 1.223 -0.298 0 C-N-CA 128.009 2.524 . . . . 2.5299999999999998 116.244 -166.291 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 21.4 m -33.73 -24.71 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.483 0 N-CA-C 119.384 3.105 . . . . 1.6699999999999999 119.384 -134.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.6 p-10 -55.17 -27.43 45.66 Favored 'General case' 0 CA--C 1.536 0.418 0 CA-C-N 120.894 1.679 . . . . 2.8500000000000001 111.106 165.063 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 3.0 tp-100 74.35 61.15 0.08 Allowed 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 124.557 1.143 . . . . 3.6099999999999999 110.548 164.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 46.8 p30 -117.92 -16.29 9.92 Favored 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 126.053 1.741 . . . . 1.9099999999999999 112.587 -177.323 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 1.3 t 69.57 21.33 6.74 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-N 119.715 1.143 . . . . 2.5800000000000001 112.209 -173.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 7.4 mt-10 -122.14 99.7 6.57 Favored 'General case' 0 N--CA 1.451 -0.402 0 N-CA-C 106.124 -1.806 . . . . 3.1200000000000001 106.124 158.844 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -71.41 98.09 1.74 Allowed 'General case' 0 N--CA 1.449 -0.478 0 N-CA-C 105.99 -1.856 . . . . 1.21 105.99 172.089 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 19.7 ptmt -84.65 174.99 9.52 Favored 'General case' 0 N--CA 1.464 0.256 0 CA-C-N 118.412 0.551 . . . . 4.6200000000000001 110.484 -179.648 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -92.45 58.8 3.26 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 123.306 0.642 . . . . 5.6200000000000001 111.768 -173.701 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -158.28 51.02 0.41 Allowed 'General case' 0 CA--C 1.54 0.577 0 N-CA-C 108.008 -1.108 . . . . 2.2999999999999998 108.008 101.248 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -91.04 -62.47 1.44 Allowed 'General case' 0 N--CA 1.449 -0.507 0 N-CA-C 107.043 -1.465 . . . . 2.3199999999999998 107.043 145.869 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 66.4 t80 -52.17 -46.98 65.71 Favored 'General case' 0 CA--C 1.512 -0.509 0 C-N-CA 124.595 1.158 . . . . 4.46 111.163 -167.681 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.634 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 56.2 t90 -45.08 -37.54 4.32 Favored 'General case' 0 N--CA 1.442 -0.864 0 CA-C-N 114.437 -1.256 . . . . 3.8999999999999999 111.724 -175.341 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 34.6 mtt180 -39.69 -45.19 1.65 Allowed 'General case' 0 C--N 1.344 0.33 0 C-N-CA 124.031 0.933 . . . . 4.1500000000000004 112.483 173.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 17.4 tp -49.59 -45.83 48.44 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 124.017 0.927 . . . . 1.23 111.551 -178.859 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 70.3 mt -64.53 -26.18 39.66 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.625 0 N-CA-C 108.052 -1.092 . . . . 1.4299999999999999 108.052 -177.426 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.528 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -70.14 -45.28 56.9 Favored Glycine 0 CA--C 1.503 -0.691 0 C-N-CA 127.066 2.269 . . . . 1.47 112.44 177.549 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -68.53 -53.41 23.27 Favored 'General case' 0 N--CA 1.437 -1.088 0 N-CA-C 106.73 -1.581 . . . . 2.0099999999999998 106.73 -177.637 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.544 ' HB2' HD23 ' B' ' 49' ' ' LEU 0.254 3.8 pp -58.22 -37.19 74.38 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 119.962 -0.695 . . . . 1.76 111.585 174.614 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -58.78 -57.91 10.95 Favored 'General case' 0 C--N 1.34 0.155 0 O-C-N 121.119 -0.988 . . . . 1.5 111.655 175.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 4.5 ptpt -63.08 -36.71 84.48 Favored 'General case' 0 CA--C 1.53 0.192 0 CA-C-O 118.407 -0.806 . . . . 1.8999999999999999 110.504 -178.449 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' B' ' 51' ' ' LYS . 2.2 mm-40 -44.22 -39.26 4.29 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 124.716 1.206 . . . . 4.9000000000000004 111.908 -173.449 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 5.2 tt -47.1 -45.32 8.4 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 123.118 0.567 . . . . 1.0700000000000001 111.677 178.589 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 13.9 ptm180 -84.34 -50.63 7.65 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.034 0.534 . . . . 5.1299999999999999 111.957 166.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 27.8 mttp -82.61 86.29 6.85 Favored 'General case' 0 N--CA 1.452 -0.356 0 O-C-N 121.263 -0.898 . . . . 5.1600000000000001 111.638 -169.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 82.3 tttt -39.57 -45.99 1.7 Allowed 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 125.229 1.412 . . . . 5.6600000000000001 112.754 176.445 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 4.9 pttt 162.47 68.15 0.0 OUTLIER 'General case' 0 N--CA 1.47 0.564 0 C-N-CA 127.786 2.435 . . . . 6.8200000000000003 110.356 163.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . 0.404 ' OD2' ' NZ ' ' B' ' 94' ' ' LYS . 2.9 t0 -146.81 154.27 41.16 Favored 'General case' 0 N--CA 1.45 -0.451 0 N-CA-C 108.382 -0.97 . . . . 6.4299999999999997 108.382 157.71 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.532 ' HG ' ' N ' ' B' ' 94' ' ' LYS . 1.8 pt? 167.73 -61.25 0.01 OUTLIER 'General case' 0 C--N 1.332 -0.195 0 C-N-CA 129.099 2.96 . . . . 5.0899999999999999 107.695 -171.35 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . 0.532 ' N ' ' HG ' ' B' ' 93' ' ' LEU . 0.0 OUTLIER 40.6 -171.94 0.0 OUTLIER 'General case' 0 CA--C 1.546 0.809 0 C-N-CA 126.893 2.077 . . . . 7.4000000000000004 112.519 -158.11 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 6.7 tp -169.32 137.96 0.51 Allowed 'Isoleucine or valine' 0 CA--C 1.53 0.198 0 N-CA-C 106.467 -1.679 . . . . 8.4700000000000006 106.467 171.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -163.71 96.35 0.83 Allowed 'General case' 0 CA--C 1.536 0.416 0 N-CA-C 107.907 -1.145 . . . . 7.46 107.907 176.931 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -175.79 135.4 0.3 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 106.742 -1.577 . . . . 8.5800000000000001 106.742 -162.847 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 10.5 tptp . . . . . 0 C--O 1.254 1.332 0 N-CA-C 105.033 -2.21 . . . . 8.6500000000000004 105.033 170.052 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 59.6 mtt . . . . . 0 N--CA 1.473 0.721 0 N-CA-C 107.562 -1.273 . . . . 7.4500000000000002 107.562 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -169.1 174.41 6.27 Favored 'General case' 0 N--CA 1.456 -0.17 0 C-N-CA 126.436 1.894 . . . . 2.96 106.48 -176.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 85.22 81.45 0.02 OUTLIER 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 126.743 2.017 . . . . 3.0499999999999998 110.316 -176.826 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.4 pm0 -58.27 124.57 71.49 Favored Pre-proline 0 N--CA 1.448 -0.537 0 C-N-CA 125.766 1.627 . . . . 4.5599999999999996 110.111 179.967 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.65 107.65 2.36 Favored 'Trans proline' 0 N--CA 1.452 -0.97 0 C-N-CA 122.467 2.111 . . . . 2.4399999999999999 109.511 -179.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 77.8 mt -65.47 159.71 23.78 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 123.554 0.742 . . . . 1.3100000000000001 110.25 175.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.634 HG22 ' CD ' ' A' ' 10' ' ' GLU . 6.1 t -76.85 170.0 17.29 Favored 'General case' 0 N--CA 1.458 -0.037 0 N-CA-C 109.271 -0.64 . . . . 2.1299999999999999 109.271 -179.466 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 54.9 tt0 -64.49 -42.85 95.62 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 108.477 -0.934 . . . . 2.8599999999999999 108.477 -171.058 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.8 mp -63.99 -57.52 9.48 Favored 'General case' 0 N--CA 1.447 -0.62 0 CA-C-O 118.422 -0.799 . . . . 2.0 111.522 176.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.634 ' CD ' HG22 ' A' ' 7' ' ' THR . 67.4 mt-10 -48.61 -52.6 22.21 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 125.4 1.48 . . . . 2.7599999999999998 109.943 178.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 7.3 tp10 -51.99 -59.62 4.14 Favored 'General case' 0 N--CA 1.448 -0.548 0 C-N-CA 124.794 1.238 . . . . 3.1699999999999999 109.527 175.011 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 78.0 p -55.38 -43.35 75.06 Favored 'General case' 0 CA--C 1.536 0.425 0 O-C-N 121.489 -0.757 . . . . 1.6000000000000001 111.771 -175.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.311 2.7 pp -65.37 -44.23 94.66 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.211 0 CA-C-O 118.687 -0.673 . . . . 0.63 110.57 179.162 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 27.2 tt0 -60.57 -48.79 80.22 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 119.484 1.038 . . . . 3.8700000000000001 110.104 176.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.4 m -45.65 -46.26 14.51 Favored 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 125.836 1.654 . . . . 2.0 112.613 175.026 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 23.7 m -80.46 -33.55 13.95 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.396 0 O-C-N 120.817 -1.177 . . . . 0.75 111.712 177.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.5 t -57.7 -39.32 69.68 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 121.467 -0.77 . . . . 0.77000000000000002 110.434 175.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 10.1 t -64.81 -43.14 94.11 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.975 0.807 . . . . 0.64000000000000001 111.15 175.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.0 m -55.48 -51.55 66.6 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 120.925 -1.109 . . . . 1.1399999999999999 110.161 173.41 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 17.1 t80 -48.23 -60.17 2.86 Favored 'General case' 0 C--O 1.221 -0.414 0 N-CA-C 109.698 -0.482 . . . . 3.8500000000000001 109.698 173.221 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 87.9 t80 -54.16 -53.31 55.2 Favored 'General case' 0 CA--C 1.53 0.193 0 C-N-CA 123.636 0.774 . . . . 3.8900000000000001 111.225 -173.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 22.0 p -57.08 -60.39 3.66 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 122.551 0.341 . . . . 2.3799999999999999 110.451 -178.578 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 24.7 m-85 -56.15 -40.58 74.06 Favored 'General case' 0 C--O 1.222 -0.343 0 CA-C-O 121.178 0.513 . . . . 2.6699999999999999 111.231 178.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.2 -26.92 68.35 Favored 'General case' 0 CA--C 1.513 -0.47 0 O-C-N 121.093 -1.005 . . . . 0.84999999999999998 110.735 -174.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 52.6 ttp180 -79.62 -19.21 49.78 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-O 117.724 -1.131 . . . . 6.6399999999999997 112.448 -177.616 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -41.16 -67.34 0.26 Allowed 'General case' 0 CA--C 1.538 0.498 0 CA-C-N 119.505 1.048 . . . . 1.9399999999999999 113.623 -173.867 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 48.5 mt-10 -98.43 79.81 2.55 Favored 'General case' 0 C--O 1.243 0.751 0 N-CA-C 104.138 -2.541 . . . . 2.5600000000000001 104.138 178.474 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 38.86 -155.51 0.02 OUTLIER Glycine 0 CA--C 1.525 0.709 0 C-N-CA 127.01 2.243 . . . . 2.7799999999999998 112.586 -176.364 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 74.9 mtp85 31.66 87.37 0.01 OUTLIER 'General case' 0 C--O 1.24 0.558 0 C-N-CA 126.681 1.992 . . . . 4.8700000000000001 110.716 165.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . 0.55 ' H ' ' HD3' ' A' ' 30' ' ' LYS . 0.0 OUTLIER -82.21 43.87 0.83 Allowed 'General case' 0 N--CA 1.462 0.174 0 C-N-CA 127.517 2.327 . . . . 4.96 109.025 -168.603 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.5 m-20 -155.51 -52.84 0.09 Allowed 'General case' 0 N--CA 1.448 -0.541 0 N-CA-C 105.521 -2.029 . . . . 4.0599999999999996 105.521 -142.322 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 16.5 p -106.72 136.78 45.93 Favored 'General case' 0 C--O 1.244 0.787 0 C-N-CA 125.732 1.613 . . . . 1.97 109.917 169.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -83.82 130.31 34.93 Favored 'General case' 0 CA--C 1.534 0.346 0 N-CA-C 105.98 -1.859 . . . . 1.9099999999999999 105.98 157.816 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 21.2 t -81.32 177.39 9.02 Favored 'General case' 0 C--N 1.327 -0.409 0 C-N-CA 125.332 1.453 . . . . 2.4700000000000002 107.62 169.069 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 76.5 t -62.2 -52.1 64.36 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.293 0 O-C-N 121.728 -0.607 . . . . 2.6400000000000001 110.03 -174.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.3 t30 -60.67 -55.74 29.58 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-O 118.701 -0.666 . . . . 2.1600000000000001 109.62 177.056 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 3.6 mt-10 -39.0 -54.24 1.69 Allowed 'General case' 0 N--CA 1.464 0.242 0 C-N-CA 126.028 1.731 . . . . 1.99 111.968 173.601 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 30.2 t80 -57.0 -54.18 49.63 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 123.434 0.693 . . . . 2.8999999999999999 109.291 177.516 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 48.4 tttt -56.81 -39.19 73.71 Favored 'General case' 0 CA--C 1.535 0.369 0 N-CA-C 112.258 0.466 . . . . 2.5699999999999998 112.258 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 89.2 mt-10 -49.9 -33.07 16.16 Favored 'General case' 0 CA--C 1.53 0.198 0 CA-C-N 119.41 1.005 . . . . 3.0 111.882 177.568 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.6 tm? -63.38 -46.13 87.88 Favored 'General case' 0 N--CA 1.453 -0.29 0 N-CA-C 108.256 -1.016 . . . . 2.21 108.256 -178.549 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.4 m -75.77 -38.9 38.07 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.41 0 CA-C-N 115.771 -0.65 . . . . 1.3200000000000001 109.913 -174.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 50.0 m -61.45 -44.47 97.05 Favored 'General case' 0 N--CA 1.45 -0.462 0 C-N-CA 123.875 0.87 . . . . 1.8300000000000001 111.378 174.994 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 13.9 tt0 -76.44 -57.88 3.61 Favored 'General case' 0 N--CA 1.454 -0.272 0 N-CA-C 109.88 -0.415 . . . . 2.9700000000000002 109.88 -170.262 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 30.6 mt-30 -100.81 -124.65 0.17 Allowed 'General case' 0 N--CA 1.454 -0.254 0 N-CA-C 109.074 -0.713 . . . . 3.52 109.074 -175.852 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 5.4 mp 24.22 64.21 0.41 Allowed Pre-proline 0 CA--C 1.545 0.783 0 C-N-CA 127.625 2.37 . . . . 1.99 113.762 179.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 67.0 Cg_endo -78.59 -49.49 0.08 OUTLIER 'Trans proline' 0 N--CA 1.454 -0.809 0 C-N-CA 122.221 1.947 . . . . 1.77 111.331 -171.655 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 11.9 t-160 -112.48 -28.68 7.77 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.277 1.431 . . . . 3.3300000000000001 111.335 -173.998 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.684 HD13 ' HG2' ' B' ' 10' ' ' GLU . 6.5 tp -65.03 -79.52 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.061 1.344 . . . . 1.23 110.997 -171.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 6.1 mt -78.46 165.34 23.88 Favored 'General case' 0 N--CA 1.449 -0.487 0 N-CA-C 108.345 -0.983 . . . . 2.7400000000000002 108.345 165.236 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -169.74 161.1 9.09 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 105.816 -1.92 . . . . 6.5099999999999998 105.816 -166.635 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 46.7 t0 60.11 78.27 0.28 Allowed 'General case' 0 N--CA 1.452 -0.369 0 CA-C-O 123.057 1.408 . . . . 5.0099999999999998 108.82 -163.492 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.1 m -85.3 12.42 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.445 -0.701 0 CA-C-N 113.552 -1.658 . . . . 2.6600000000000001 110.089 166.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -79.97 -66.48 1.66 Allowed Glycine 0 C--N 1.34 0.779 0 N-CA-C 106.444 -2.662 . . . . 2.02 106.444 167.426 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 3.3 t -78.23 61.0 2.62 Favored 'General case' 0 CA--C 1.532 0.258 0 CA-C-O 122.291 1.043 . . . . 2.5899999999999999 110.841 -179.794 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -79.77 -39.68 30.42 Favored 'General case' 0 N--CA 1.442 -0.874 0 C-N-CA 125.471 1.508 . . . . 1.3600000000000001 108.513 169.728 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 t70 -40.7 -53.2 2.84 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 125.853 1.661 . . . . 4.8799999999999999 112.167 171.045 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 30.1 tt0 -48.81 -56.61 8.18 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.193 1.397 . . . . 3.02 111.094 174.258 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.56 -51.94 65.4 Favored 'General case' 0 C--O 1.225 -0.235 0 N-CA-C 108.406 -0.961 . . . . 3.0299999999999998 108.406 177.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -47.75 -52.24 19.3 Favored 'General case' 0 C--O 1.226 -0.17 0 C-N-CA 123.941 0.896 . . . . 1.6699999999999999 110.12 -176.151 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 12.5 mtmt -62.95 -39.4 94.51 Favored 'General case' 0 CA--C 1.534 0.355 0 CA-C-N 118.08 0.4 . . . . 2.9300000000000002 111.685 178.183 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 4.4 t -60.13 -37.06 78.92 Favored 'General case' 0 CA--C 1.541 0.625 0 O-C-N 121.934 -0.479 . . . . 1.77 111.567 175.762 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.6 mp -77.42 -55.56 5.29 Favored 'General case' 0 CA--C 1.528 0.103 0 O-C-N 121.141 -0.975 . . . . 1.9399999999999999 110.93 177.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 49.9 t0 -76.45 69.72 2.94 Favored 'General case' 0 N--CA 1.451 -0.388 0 C-N-CA 124.076 0.95 . . . . 1.78 110.035 -174.963 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 20.5 m -49.36 -33.09 6.55 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.277 0 C-N-CA 124.534 1.134 . . . . 1.72 112.827 -176.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 6.0 p-10 -96.44 0.78 50.91 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 113.196 0.813 . . . . 2.75 113.196 -176.752 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 1.2 mm-40 44.93 65.49 1.08 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 125.885 1.674 . . . . 5.1100000000000003 112.541 176.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 30.6 p30 -107.48 -8.34 16.28 Favored 'General case' 0 CA--C 1.535 0.373 0 C-N-CA 124.614 1.166 . . . . 2.0899999999999999 111.089 171.49 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 44.0 m 61.08 23.82 13.97 Favored 'General case' 0 CA--C 1.531 0.223 0 C-N-CA 124.523 1.129 . . . . 1.5700000000000001 112.438 -171.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 8.8 mt-10 -120.39 108.94 14.74 Favored 'General case' 0 N--CA 1.447 -0.589 0 N-CA-C 106.691 -1.596 . . . . 3.25 106.691 163.703 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.4 mm? -80.53 89.16 5.64 Favored 'General case' 0 N--CA 1.45 -0.469 0 N-CA-C 103.686 -2.709 . . . . 1.24 103.686 177.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.8 ttpm? -68.49 161.17 28.35 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 124.734 1.214 . . . . 3.9100000000000001 108.945 -174.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 69.4 m-85 -37.7 -62.04 0.57 Allowed 'General case' 0 CA--C 1.535 0.379 0 C-N-CA 124.403 1.081 . . . . 5.3700000000000001 113.279 -168.054 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.5 t30 -70.25 -33.33 71.49 Favored 'General case' 0 CA--C 1.536 0.417 0 N-CA-C 111.701 0.26 . . . . 1.9199999999999999 111.701 -176.597 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 67.8 mt-10 -61.84 -60.01 4.29 Favored 'General case' 0 CA--C 1.532 0.259 0 N-CA-C 108.826 -0.805 . . . . 1.99 108.826 177.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 27.0 t80 -48.34 -52.92 19.41 Favored 'General case' 0 CA--C 1.516 -0.338 0 C-N-CA 124.048 0.939 . . . . 2.6200000000000001 109.505 174.496 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.554 ' CE2' ' CZ2' ' B' ' 77' ' ' TRP . 12.8 t-105 -51.01 -29.38 12.34 Favored 'General case' 0 N--CA 1.441 -0.878 0 CA-C-O 117.498 -1.239 . . . . 4.8899999999999997 111.435 -178.195 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 36.6 ttt180 -43.75 -43.81 6.27 Favored 'General case' 0 C--N 1.351 0.659 0 CA-C-N 120.471 1.487 . . . . 5.6299999999999999 110.712 171.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.5 tp -44.53 -45.54 9.38 Favored 'General case' 0 N--CA 1.452 -0.351 0 C-N-CA 122.851 0.46 . . . . 1.0 110.854 178.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . 0.404 ' N ' HD12 ' A' ' 80' ' ' ILE . 1.5 mp -69.51 -32.74 54.07 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.409 0 N-CA-C 108.961 -0.755 . . . . 1.9299999999999999 108.961 -175.615 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.431 ' CA ' ' CE2' ' B' ' 77' ' ' TRP . . . -58.74 -44.84 95.55 Favored Glycine 0 CA--C 1.506 -0.469 0 N-CA-C 110.175 -1.17 . . . . 1.51 110.175 169.346 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.1 mm-40 -76.53 -33.61 58.57 Favored 'General case' 0 N--CA 1.438 -1.029 0 N-CA-C 108.653 -0.869 . . . . 2.3500000000000001 108.653 -169.698 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.414 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 9.1 mp -52.77 -54.71 30.07 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.042 0.837 . . . . 2.25 109.786 161.078 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -60.36 -26.88 66.94 Favored 'General case' 0 CA--C 1.532 0.268 0 C-N-CA 122.889 0.475 . . . . 1.8500000000000001 111.9 -178.048 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.409 ' HB2' ' HE3' ' A' ' 85' ' ' LYS . 0.0 OUTLIER -68.63 -61.1 1.97 Allowed 'General case' 0 C--O 1.217 -0.628 0 O-C-N 121.579 -0.701 . . . . 2.29 109.628 162.894 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -53.14 -43.61 67.13 Favored 'General case' 0 N--CA 1.451 -0.405 0 C-N-CA 125.634 1.574 . . . . 3.5099999999999998 112.062 -164.977 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . 0.428 HD12 ' OE2' ' B' ' 10' ' ' GLU . 11.7 tt -53.29 -37.12 27.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-O 121.816 0.817 . . . . 1.6699999999999999 111.366 173.978 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -90.08 -63.51 1.27 Allowed 'General case' 0 N--CA 1.445 -0.702 0 C-N-CA 126.288 1.835 . . . . 5.5099999999999998 110.167 -171.294 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 35.6 tttp -77.28 49.1 0.67 Allowed 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 126.609 1.964 . . . . 4.3799999999999999 113.585 -162.447 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 71.1 tttt -68.91 -19.61 64.21 Favored 'General case' 0 CA--C 1.537 0.47 0 O-C-N 121.095 -1.003 . . . . 8.2100000000000009 112.127 -176.267 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 37.6 tptt -165.82 -35.07 0.03 OUTLIER 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.045 0.538 . . . . 9.75 112.218 176.055 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 77.6 m-20 68.54 -32.47 0.22 Allowed 'General case' 0 N--CA 1.469 0.492 0 C-N-CA 126.63 1.972 . . . . 7.3700000000000001 113.723 -175.702 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 64.1 tp -64.88 -86.07 0.01 OUTLIER 'General case' 0 N--CA 1.442 -0.858 0 C-N-CA 124.918 1.287 . . . . 10.27 110.935 -176.076 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 64.7 mttm -163.03 75.75 0.41 Allowed 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 118.707 0.685 . . . . 16.780000000000001 110.128 -167.87 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 10.4 tp -152.35 70.26 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.563 0 CA-C-N 119.517 1.053 . . . . 9.3499999999999996 113.295 179.796 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . 0.405 6.4 ptm180 173.11 -114.64 0.0 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 127.838 2.455 . . . . 12.710000000000001 107.54 144.944 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -176.79 138.5 0.27 Allowed 'General case' 0 CA--C 1.533 0.317 0 CA-C-N 120.637 1.562 . . . . 12.98 108.594 -173.859 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 96.3 mttt . . . . . 0 C--O 1.25 1.082 0 C-N-CA 127.338 2.255 . . . . 14.380000000000001 113.427 171.741 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 3.9 mpp? . . . . . 0 N--CA 1.469 0.522 0 CA-C-O 118.258 -0.877 . . . . 6.5499999999999998 109.69 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . 0.483 ' HA ' ' CB ' ' B' ' 3' ' ' ALA . . . -50.56 146.23 5.77 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-O 117.116 -1.421 . . . . 5.4000000000000004 110.56 171.898 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . 0.483 ' CB ' ' HA ' ' B' ' 2' ' ' ALA . . . 100.86 98.36 0.01 OUTLIER 'General case' 0 N--CA 1.475 0.778 1 C-N-CA 135.725 5.61 . . . . 5.3499999999999996 110.163 11.838 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 68.3 mt-10 -144.5 132.48 10.69 Favored Pre-proline 0 CA--C 1.546 0.816 0 C-N-CA 126.664 1.986 . . . . 5.5700000000000003 107.019 -173.451 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 92.1 Cg_endo -78.43 149.48 24.42 Favored 'Trans proline' 0 CA--C 1.537 0.637 0 C-N-CA 123.924 3.082 . . . . 4.2699999999999996 111.212 -176.393 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 13.1 mt -138.62 -112.55 0.16 Allowed 'General case' 0 CA--C 1.544 0.733 0 C-N-CA 124.791 1.237 . . . . 3.5099999999999998 112.714 -160.666 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 4.7 t -110.68 -80.83 0.58 Allowed 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 114.619 1.34 . . . . 2.5099999999999998 114.619 -161.508 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -162.58 -72.23 0.05 OUTLIER 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.935 0.894 . . . . 3.25 108.658 -173.134 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 7.5 mt -56.41 -50.03 72.79 Favored 'General case' 0 C--N 1.338 0.102 0 N-CA-C 109.215 -0.661 . . . . 1.1799999999999999 109.215 171.554 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.684 ' HG2' HD13 ' A' ' 49' ' ' LEU . 3.3 tm-20 -43.66 -62.6 1.04 Allowed 'General case' 0 N--CA 1.446 -0.67 0 C-N-CA 124.269 1.028 . . . . 4.7199999999999998 111.092 167.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 9.1 mm-40 -48.42 -42.61 32.65 Favored 'General case' 0 CA--C 1.538 0.501 0 CA-C-O 121.262 0.553 . . . . 4.0 109.768 -177.181 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 14.7 m -62.84 -36.92 84.83 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.154 0.981 . . . . 1.54 112.617 -179.504 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.272 1.9 pp -75.7 -37.39 35.91 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 CA-C-N 118.913 0.779 . . . . 1.02 111.029 171.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . 0.4 ' HG2' HD11 ' A' ' 87' ' ' ILE . 4.9 tm-20 -57.71 -59.09 5.74 Favored 'General case' 0 N--CA 1.453 -0.298 0 CA-C-N 118.895 0.77 . . . . 2.3799999999999999 109.602 177.878 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 9.4 t -47.32 -44.84 23.9 Favored 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.005 0.821 . . . . 1.22 112.097 -174.878 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 30.1 m -73.03 -43.83 57.84 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 O-C-N 120.987 -1.071 . . . . 0.82999999999999996 110.843 178.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 37.1 t -53.69 -51.28 45.03 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.312 0 O-C-N 121.405 -0.809 . . . . 1.1699999999999999 110.617 175.131 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 13.7 t -60.05 -48.91 79.74 Favored 'General case' 0 N--CA 1.451 -0.386 0 CA-C-O 117.457 -1.258 . . . . 1.48 110.355 175.693 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 99.0 m -46.14 -57.67 4.3 Favored 'General case' 0 C--N 1.344 0.334 0 CA-C-N 120.634 1.561 . . . . 1.3100000000000001 109.671 175.287 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 10.5 m-30 -55.63 -61.28 2.46 Favored 'General case' 0 CA--C 1.535 0.395 0 N-CA-C 112.343 0.497 . . . . 6.7999999999999998 112.343 179.354 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -69.49 -33.95 73.62 Favored 'General case' 0 N--CA 1.463 0.22 0 CA-C-N 119.165 0.893 . . . . 4.4400000000000004 112.025 -169.939 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 64.6 p -61.44 -55.53 30.31 Favored 'General case' 0 C--O 1.222 -0.38 0 N-CA-C 108.449 -0.945 . . . . 3.5699999999999998 108.449 170.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -55.44 -38.11 68.59 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 119.046 0.839 . . . . 2.98 112.038 -177.836 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.32 -19.7 9.44 Favored 'General case' 0 C--O 1.234 0.25 0 C-N-CA 127.417 2.287 . . . . 1.5 112.323 176.511 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.99 -17.54 10.17 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.609 1.163 . . . . 3.4399999999999999 112.444 170.589 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.497 ' CB ' ' HG3' ' B' ' 37' ' ' GLU . 0.0 OUTLIER -47.68 -65.62 0.54 Allowed 'General case' 0 CA--C 1.538 0.505 0 N-CA-C 115.082 1.512 . . . . 1.9399999999999999 115.082 -173.925 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . 0.342 17.4 mt-10 -82.42 -17.65 44.63 Favored 'General case' 0 CA--C 1.535 0.392 0 N-CA-C 118.621 2.823 . . . . 3.2200000000000002 118.621 -161.574 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.21 -107.16 0.58 Allowed Glycine 0 C--N 1.338 0.655 1 C-N-CA 133.601 5.381 . . . . 3.4900000000000002 114.093 -4.521 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER 67.26 86.6 0.13 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 107.525 -1.287 . . . . 4.6100000000000003 107.525 -175.467 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 14.6 pttm -81.95 14.47 2.74 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 115.558 1.688 . . . . 3.77 115.558 -157.881 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 21.5 p-10 -120.11 -49.19 2.3 Favored 'General case' 0 C--N 1.332 -0.185 0 C-N-CA 124.131 0.972 . . . . 3.0899999999999999 109.158 171.898 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 85.1 p -68.63 131.38 45.11 Favored 'General case' 0 N--CA 1.448 -0.571 0 C-N-CA 123.404 0.682 . . . . 1.9399999999999999 110.458 -179.524 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.6 mp -94.04 112.34 24.16 Favored 'General case' 0 N--CA 1.447 -0.613 0 N-CA-C 106.675 -1.602 . . . . 3.0800000000000001 106.675 164.206 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 42.0 m -81.69 -174.36 4.96 Favored 'General case' 0 N--CA 1.444 -0.765 0 C-N-CA 128.183 2.593 . . . . 3.3300000000000001 107.775 178.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 75.5 t -68.15 -95.5 0.0 OUTLIER 'Isoleucine or valine' 0 C--O 1.237 0.432 0 N-CA-C 103.575 -2.75 . . . . 3.0299999999999998 103.575 -171.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -72.44 70.12 0.87 Allowed 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 120.659 1.572 . . . . 2.7799999999999998 108.724 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.497 ' HG3' ' CB ' ' B' ' 26' ' ' GLN . 25.8 tt0 -159.0 -56.0 0.06 Allowed 'General case' 0 N--CA 1.443 -0.803 0 C-N-CA 131.54 3.936 . . . . 2.5299999999999998 104.282 178.719 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . 0.405 ' CE2' ' CE2' ' B' ' 76' ' ' TYR . 0.8 OUTLIER -60.19 -51.74 68.31 Favored 'General case' 0 N--CA 1.451 -0.392 0 N-CA-C 108.478 -0.934 . . . . 2.3700000000000001 108.478 166.996 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 50.2 tttt -59.42 -32.64 70.37 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 119.285 -0.966 . . . . 2.6499999999999999 111.894 -169.9 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -55.3 -34.46 64.15 Favored 'General case' 0 CA--C 1.535 0.367 0 O-C-N 121.705 -0.622 . . . . 3.3100000000000001 112.424 174.036 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.4 tt -69.73 -45.17 68.76 Favored 'General case' 0 C--O 1.233 0.198 0 CA-C-N 119.111 0.869 . . . . 1.8899999999999999 109.262 -176.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.428 HG11 HD23 ' B' ' 56' ' ' LEU . 30.4 m -68.12 -36.9 77.1 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.402 0 N-CA-C 109.447 -0.575 . . . . 0.97999999999999998 109.447 -175.613 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 99.4 m -62.51 -60.51 3.43 Favored 'General case' 0 N--CA 1.449 -0.482 0 C-N-CA 122.639 0.376 . . . . 1.1299999999999999 111.268 169.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 19.8 tt0 -82.47 -59.11 2.64 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 123.759 0.824 . . . . 2.4100000000000001 112.938 -164.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 1.1 mp0 -81.67 -32.75 31.64 Favored 'General case' 0 CA--C 1.53 0.18 0 C-N-CA 124.022 0.929 . . . . 3.2999999999999998 112.34 -165.546 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . 0.416 HD11 HD21 ' B' ' 83' ' ' LEU . 13.6 tp -82.82 -14.61 0.21 Allowed Pre-proline 0 CA--C 1.545 0.753 0 N-CA-C 118.816 2.895 . . . . 1.51 118.816 -164.016 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -40.14 -62.95 0.32 Allowed 'Trans proline' 0 N--CA 1.459 -0.558 0 C-N-CA 125.277 3.985 . . . . 2.29 117.857 -132.846 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 12.4 t-160 -88.8 54.0 2.88 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-N 119.975 1.261 . . . . 3.6099999999999999 110.534 -156.338 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 14.2 tp -145.57 -107.24 0.1 Allowed 'General case' 0 N--CA 1.444 -0.756 0 C-N-CA 123.727 0.811 . . . . 1.8400000000000001 109.981 -166.101 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 2.4 mp -69.42 92.95 0.63 Allowed 'General case' 0 CA--C 1.531 0.242 0 O-C-N 120.913 -1.117 . . . . 2.1299999999999999 110.483 178.649 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -39.01 149.47 0.04 OUTLIER 'General case' 0 C--O 1.237 0.42 0 C-N-CA 125.443 1.497 . . . . 6.0 113.476 174.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 19.4 t0 54.8 41.65 31.75 Favored 'General case' 0 N--CA 1.462 0.156 0 CA-C-O 123.205 1.479 . . . . 5.0 107.335 176.793 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 17.0 m 35.8 45.93 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.442 -0.866 0 C-N-CA 127.739 2.416 . . . . 4.1799999999999997 113.093 -170.437 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . 68.33 8.2 54.47 Favored Glycine 0 CA--C 1.526 0.735 0 C-N-CA 125.414 1.483 . . . . 7.1100000000000003 114.865 177.742 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . 0.274 0.5 OUTLIER 49.35 66.07 1.22 Allowed 'General case' 0 CA--C 1.541 0.606 0 CA-C-O 123.493 1.616 . . . . 4.2300000000000004 110.044 -175.525 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . 0.428 HD23 HG11 ' B' ' 42' ' ' VAL . 0.2 OUTLIER -49.32 -26.49 3.14 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 126.11 1.764 . . . . 2.2599999999999998 114.123 -178.295 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.1 p-10 -50.03 -74.33 0.03 OUTLIER 'General case' 0 CA--C 1.54 0.574 0 C-N-CA 123.983 0.913 . . . . 4.1500000000000004 112.35 166.285 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 5.8 pt-20 -50.28 -45.35 54.34 Favored 'General case' 0 C--N 1.344 0.349 0 CA-C-N 119.211 0.914 . . . . 2.5800000000000001 109.585 173.89 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -60.23 -39.21 85.86 Favored 'General case' 0 N--CA 1.453 -0.317 0 CA-C-O 118.834 -0.603 . . . . 2.9300000000000002 111.644 -172.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 5.0 ttt -55.3 -45.15 76.28 Favored 'General case' 0 N--CA 1.453 -0.312 0 CA-C-N 119.4 1.0 . . . . 2.1000000000000001 108.744 176.775 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -63.48 -43.13 98.18 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.112 -0.993 . . . . 4.7300000000000004 111.121 175.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 2.6 m -58.72 -41.67 86.9 Favored 'General case' 0 CA--C 1.542 0.66 0 CA-C-N 118.859 0.754 . . . . 1.73 112.853 176.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 33.3 mt -82.68 -60.13 2.28 Favored 'General case' 0 N--CA 1.454 -0.241 0 C-N-CA 125.886 1.674 . . . . 1.3799999999999999 111.457 -172.797 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.282 4.3 t0 -64.85 -7.21 10.35 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 127.662 2.385 . . . . 2.48 116.506 -157.702 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 34.1 m -36.61 -25.36 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.538 0.485 0 C-N-CA 130.985 3.714 . . . . 2.1600000000000001 117.841 -154.116 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 35.8 p30 -65.8 -20.69 66.35 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-N 120.088 1.313 . . . . 3.5099999999999998 112.332 175.263 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 112.57 -43.72 0.0 OUTLIER 'General case' 0 C--N 1.344 0.354 0 C-N-CA 129.331 3.052 . . . . 4.9299999999999997 111.169 164.042 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 1.2 p30 -46.56 117.82 1.76 Allowed 'General case' 0 C--O 1.232 0.183 0 C-N-CA 123.763 0.825 . . . . 3.8700000000000001 109.441 173.085 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 7.8 t -70.04 63.74 0.22 Allowed 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 126.515 1.926 . . . . 2.4900000000000002 110.637 -176.245 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 16.5 mt-10 -161.26 118.9 2.32 Favored 'General case' 0 N--CA 1.446 -0.652 0 C-N-CA 127.769 2.427 . . . . 3.2599999999999998 105.251 -171.579 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 3.4 mm? -87.96 110.77 20.82 Favored 'General case' 0 N--CA 1.447 -0.611 0 N-CA-C 108.082 -1.081 . . . . 1.6599999999999999 108.082 174.755 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -82.33 158.76 23.28 Favored 'General case' 0 N--CA 1.453 -0.285 0 N-CA-C 107.377 -1.342 . . . . 6.6399999999999997 107.377 170.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -86.04 56.89 4.18 Favored 'General case' 0 CA--C 1.537 0.459 0 O-C-N 121.171 -0.956 . . . . 4.1100000000000003 111.566 169.802 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . 0.407 ' HB2' ' CD ' ' A' ' 85' ' ' LYS . 1.7 t-20 -152.82 49.3 0.73 Allowed 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 119.987 -0.685 . . . . 2.52 109.868 111.554 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 30.3 mt-10 -93.28 -61.94 1.47 Allowed 'General case' 0 N--CA 1.451 -0.422 0 C-N-CA 127.437 2.295 . . . . 2.5299999999999998 107.678 134.857 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.405 ' CE2' ' CE2' ' B' ' 38' ' ' PHE . 16.2 t80 -46.23 -40.79 11.97 Favored 'General case' 0 CA--C 1.513 -0.455 0 C-N-CA 127.584 2.354 . . . . 3.9300000000000002 111.99 -174.306 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.554 ' CZ2' ' CE2' ' A' ' 77' ' ' TRP . 41.7 t90 -50.91 -35.41 32.93 Favored 'General case' 0 N--CA 1.444 -0.74 0 N-CA-C 112.668 0.618 . . . . 4.0599999999999996 112.668 -175.348 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 52.5 mtp180 -45.18 -33.79 2.44 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 122.893 0.477 . . . . 4.4100000000000001 111.943 174.486 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 17.7 tp -60.86 -48.12 83.26 Favored 'General case' 0 N--CA 1.435 -1.189 0 C-N-CA 124.645 1.178 . . . . 1.1799999999999999 108.89 -175.156 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . 0.296 5.2 pt -71.78 -18.01 19.57 Favored 'Isoleucine or valine' 0 N--CA 1.431 -1.376 0 C-N-CA 117.6 -1.64 . . . . 2.96 108.477 -175.384 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.554 ' HA2' ' CE2' ' A' ' 77' ' ' TRP . . . -67.7 -47.49 61.27 Favored Glycine 0 N--CA 1.443 -0.857 0 C-N-CA 125.108 1.337 . . . . 1.6000000000000001 110.241 172.841 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -56.66 -63.13 1.3 Allowed 'General case' 0 N--CA 1.44 -0.956 0 CA-C-O 117.089 -1.434 . . . . 3.2200000000000002 107.756 168.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.416 HD21 HD11 ' B' ' 46' ' ' LEU . 8.6 mp -41.76 -56.24 2.74 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 121.0 1.727 . . . . 2.0600000000000001 113.286 -177.707 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.87 -28.01 63.78 Favored 'General case' 0 N--CA 1.456 -0.158 0 C-N-CA 125.159 1.383 . . . . 1.24 112.198 -176.487 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.77 -60.84 2.22 Favored 'General case' 0 CA--C 1.514 -0.43 0 CA-C-O 118.145 -0.931 . . . . 1.9199999999999999 109.941 164.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 14.1 mm-40 -59.3 -24.35 63.22 Favored 'General case' 0 N--CA 1.454 -0.233 0 C-N-CA 123.807 0.843 . . . . 2.29 112.465 -158.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 11.4 tt -45.85 -53.09 2.42 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 CA-C-N 118.569 0.622 . . . . 1.8799999999999999 111.249 164.723 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 49.5 ttt85 -85.21 -61.47 1.76 Allowed 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 126.407 1.883 . . . . 5.3300000000000001 113.957 171.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 49.8 tttp -64.18 139.11 58.73 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 124.316 1.046 . . . . 4.71 111.749 -166.803 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 6.4 tmtm? -83.79 -61.96 1.69 Allowed 'General case' 0 CA--C 1.531 0.247 0 O-C-N 122.028 -0.42 . . . . 5.1699999999999999 110.953 -168.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 41.6 tttp -175.31 27.43 0.0 OUTLIER 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 126.403 1.881 . . . . 6.9900000000000002 109.616 176.256 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 3.8 p-10 -103.47 41.33 1.28 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 128.336 2.655 . . . . 4.3200000000000003 108.478 -165.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.448 ' CG ' ' H ' ' B' ' 94' ' ' LYS . 0.3 OUTLIER -99.18 -104.19 0.22 Allowed 'General case' 0 CA--C 1.528 0.133 0 C-N-CA 125.861 1.664 . . . . 4.8600000000000003 108.189 -179.937 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . 0.448 ' H ' ' CG ' ' B' ' 93' ' ' LEU . 1.0 OUTLIER 67.12 175.34 0.25 Allowed 'General case' 0 CA--C 1.537 0.451 0 C-N-CA 126.029 1.732 . . . . 7.54 110.22 -177.201 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 7.7 tp -164.29 143.72 2.04 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.148 0 N-CA-C 107.704 -1.221 . . . . 7.9199999999999999 107.704 176.57 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -161.74 148.59 14.19 Favored 'General case' 0 N--CA 1.455 -0.201 0 N-CA-C 105.84 -1.911 . . . . 6.6500000000000004 105.84 167.482 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 6.3 tmtt? -178.31 139.04 0.19 Allowed 'General case' 0 N--CA 1.452 -0.349 0 N-CA-C 104.219 -2.512 . . . . 8.3800000000000008 104.219 -168.759 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.172 0 N-CA-C 106.118 -1.808 . . . . 8.5399999999999991 106.118 161.143 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.6 mtp . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 107.48 -1.304 . . . . 7.5800000000000001 107.48 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -66.7 174.86 2.63 Favored 'General case' 0 C--O 1.232 0.142 0 O-C-N 123.842 0.714 . . . . 4.4900000000000002 109.896 165.014 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 101.44 58.94 0.0 OUTLIER 'General case' 0 N--CA 1.456 -0.175 0 C-N-CA 129.386 3.074 . . . . 3.4100000000000001 109.004 -168.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -62.15 135.65 95.03 Favored Pre-proline 0 N--CA 1.446 -0.64 0 C-N-CA 125.741 1.617 . . . . 4.9100000000000001 110.777 -173.457 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -71.64 110.52 2.91 Favored 'Trans proline' 0 N--CA 1.453 -0.879 0 C-N-CA 122.888 2.392 . . . . 2.5899999999999999 110.452 -177.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 54.2 mt -70.58 159.72 33.82 Favored 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 124.141 0.976 . . . . 1.45 109.614 173.419 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.6 t -72.89 165.74 24.35 Favored 'General case' 0 N--CA 1.464 0.264 0 O-C-N 121.545 -0.722 . . . . 1.72 109.457 179.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.1 tt0 -57.19 -47.12 82.06 Favored 'General case' 0 C--N 1.343 0.323 0 CA-C-N 118.991 0.814 . . . . 4.0700000000000003 109.657 -177.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 3.3 mp -57.45 -58.39 8.48 Favored 'General case' 0 N--CA 1.449 -0.483 0 CA-C-O 117.755 -1.117 . . . . 1.71 111.222 178.597 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 78.2 mt-10 -49.25 -56.03 10.72 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 125.097 1.359 . . . . 2.5600000000000001 110.419 177.697 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 33.1 tp10 -52.55 -52.37 55.23 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 125.922 1.689 . . . . 3.23 110.379 -179.67 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 79.2 p -67.05 -45.2 78.14 Favored 'General case' 0 C--O 1.234 0.245 0 O-C-N 121.762 -0.587 . . . . 1.5800000000000001 111.261 -176.795 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.296 2.9 pp -62.88 -36.55 76.08 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.326 0 O-C-N 121.421 -0.8 . . . . 0.71999999999999997 109.432 177.763 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -60.11 -57.83 11.12 Favored 'General case' 0 N--CA 1.453 -0.291 0 CA-C-N 118.863 0.756 . . . . 2.8399999999999999 109.94 171.44 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -54.37 -36.33 63.77 Favored 'General case' 0 CA--C 1.538 0.514 0 CA-C-N 119.42 1.009 . . . . 1.47 111.989 -171.75 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.3 m -73.92 -47.4 43.04 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.435 0 O-C-N 121.467 -0.77 . . . . 0.93000000000000005 110.833 172.498 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 31.8 t -50.59 -50.21 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.165 0 CA-C-N 119.309 0.959 . . . . 0.53000000000000003 111.622 177.382 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.4 t -60.03 -44.28 94.73 Favored 'General case' 0 CA--C 1.534 0.364 0 CA-C-N 118.941 0.791 . . . . 1.1799999999999999 110.479 176.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 63.7 m -52.67 -51.89 58.26 Favored 'General case' 0 CA--C 1.536 0.41 0 CA-C-N 119.641 1.109 . . . . 1.1399999999999999 109.215 174.722 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 3.8 m-30 -56.6 -55.67 31.03 Favored 'General case' 0 C--O 1.225 -0.236 0 C-N-CA 122.995 0.518 . . . . 6.8899999999999997 110.732 178.559 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -68.06 -44.49 76.25 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 125.298 1.439 . . . . 2.8900000000000001 110.646 -166.096 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 66.4 p -56.17 -57.82 10.56 Favored 'General case' 0 N--CA 1.452 -0.373 0 N-CA-C 108.389 -0.967 . . . . 3.4900000000000002 108.389 170.962 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 4.1 t80 -52.7 -40.91 63.41 Favored 'General case' 0 CA--C 1.537 0.444 0 C-N-CA 122.662 0.385 . . . . 2.9100000000000001 111.959 -178.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.89 -16.83 32.37 Favored 'General case' 0 C--O 1.236 0.378 0 C-N-CA 128.323 2.649 . . . . 1.3100000000000001 112.802 -178.546 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -59.5 -28.94 67.49 Favored 'General case' 0 CA--C 1.532 0.259 0 CA-C-O 118.24 -0.886 . . . . 3.7999999999999998 111.625 169.012 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -41.92 -62.89 0.82 Allowed 'General case' 0 C--N 1.344 0.348 0 C-N-CA 124.289 1.035 . . . . 1.95 113.055 -167.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 63.5 mt-10 -124.11 177.49 5.79 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 126.193 1.797 . . . . 2.8900000000000001 107.502 -177.002 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -15.2 125.28 0.01 OUTLIER Glycine 0 CA--C 1.533 1.176 0 C-N-CA 127.852 2.644 . . . . 1.4099999999999999 115.187 -179.719 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 9.3 mpt_? 64.1 105.53 0.03 OUTLIER 'General case' 0 C--O 1.237 0.43 0 C-N-CA 124.482 1.113 . . . . 4.2000000000000002 112.214 177.97 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 59.2 pttt -67.15 60.02 0.05 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 123.856 0.862 . . . . 4.0499999999999998 111.18 166.437 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -164.37 -64.83 0.04 OUTLIER 'General case' 0 N--CA 1.458 -0.066 0 C-N-CA 125.593 1.557 . . . . 3.71 107.322 -177.861 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.8 p -85.52 159.72 19.84 Favored 'General case' 0 C--O 1.243 0.719 0 C-N-CA 125.157 1.383 . . . . 1.8200000000000001 110.836 -179.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.7 mm? -100.12 175.66 5.67 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 107.761 -1.2 . . . . 2.2799999999999998 107.761 172.99 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 17.9 t -144.33 179.78 7.03 Favored 'General case' 0 C--N 1.329 -0.32 0 C-N-CA 126.781 2.033 . . . . 2.1200000000000001 106.277 177.752 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 67.7 t -47.81 -64.02 0.29 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.446 0 C-N-CA 123.533 0.733 . . . . 2.1699999999999999 111.467 -175.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 30.3 t30 -66.57 -50.76 62.05 Favored 'General case' 0 CA--C 1.528 0.127 0 CA-C-O 119.163 -0.446 . . . . 1.99 110.267 -176.239 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.9 mt-10 -39.01 -50.67 1.8 Allowed 'General case' 0 CA--C 1.536 0.417 0 C-N-CA 124.169 0.988 . . . . 2.1899999999999999 113.139 170.293 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 5.0 t80 -65.27 -51.63 59.52 Favored 'General case' 0 N--CA 1.45 -0.449 0 C-N-CA 123.953 0.901 . . . . 2.7799999999999998 109.169 178.708 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 41.6 tttm -56.98 -42.25 79.87 Favored 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 120.64 -0.424 . . . . 3.5 110.171 -175.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -50.3 -42.2 52.13 Favored 'General case' 0 N--CA 1.447 -0.62 0 C-N-CA 123.49 0.716 . . . . 3.2400000000000002 111.604 174.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 1.9 tp -61.47 -48.15 82.43 Favored 'General case' 0 CA--C 1.527 0.076 0 O-C-N 120.663 -1.273 . . . . 2.8599999999999999 109.357 -175.995 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.5 m -72.75 -45.71 56.01 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.369 0 CA-C-O 121.681 0.753 . . . . 1.0700000000000001 109.43 -172.608 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 84.2 m -64.71 -45.37 86.85 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 124.211 1.004 . . . . 1.1699999999999999 110.035 -177.368 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -81.18 -60.33 2.32 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 124.109 0.964 . . . . 2.8300000000000001 110.734 -174.323 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 3.2 mp0 -111.97 57.11 0.64 Allowed 'General case' 0 CA--C 1.538 0.519 0 C-N-CA 123.853 0.861 . . . . 4.6399999999999997 112.478 -175.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.5 tp -159.1 81.17 2.65 Favored Pre-proline 0 CA--C 1.542 0.647 0 O-C-N 121.057 -1.027 . . . . 1.8400000000000001 109.428 167.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -75.35 -44.41 0.31 Allowed 'Trans proline' 0 N--CA 1.452 -0.943 0 C-N-CA 123.302 2.668 . . . . 2.1400000000000001 112.048 -167.385 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 35.8 t-80 -109.79 -74.88 0.64 Allowed 'General case' 0 C--N 1.343 0.319 0 CA-C-N 118.499 0.591 . . . . 3.1899999999999999 110.523 176.919 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.547 HD23 HD22 ' A' ' 83' ' ' LEU . 7.2 tp 8.45 -91.78 0.0 OUTLIER 'General case' 0 CA--C 1.545 0.751 0 C-N-CA 127.969 2.508 . . . . 1.47 116.972 -166.265 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 11.4 mt -79.67 -27.66 40.79 Favored 'General case' 0 N--CA 1.462 0.141 0 C-N-CA 124.382 1.073 . . . . 3.0600000000000001 111.707 -178.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 42.5 mmtt 53.33 -166.42 0.07 Allowed 'General case' 0 N--CA 1.446 -0.647 0 C-N-CA 125.092 1.357 . . . . 8.5399999999999991 110.073 -156.712 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.413 ' OD2' ' NZ ' ' A' ' 59' ' ' LYS . 15.4 t0 58.7 52.08 7.11 Favored 'General case' 0 N--CA 1.443 -0.788 0 CA-C-O 125.021 2.343 . . . . 3.8500000000000001 109.705 172.458 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 1.2 t -69.57 -1.17 1.65 Allowed 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 CA-C-N 111.529 -2.578 . . . . 3.2599999999999998 110.318 163.776 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -84.87 -66.37 1.45 Allowed Glycine 0 C--N 1.342 0.888 0 C-N-CA 125.527 1.536 . . . . 1.71 110.747 171.29 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.4 t -78.1 68.22 4.09 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-N 118.486 1.143 . . . . 1.99 108.964 -176.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -81.29 -36.08 30.26 Favored 'General case' 0 N--CA 1.442 -0.825 0 C-N-CA 125.118 1.367 . . . . 1.3100000000000001 110.98 -172.811 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 3.1 p-10 -53.96 -44.04 70.39 Favored 'General case' 0 CA--C 1.536 0.427 0 O-C-N 121.693 -0.629 . . . . 3.9700000000000002 112.014 -175.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 2.5 pt-20 -57.53 -42.64 83.3 Favored 'General case' 0 CA--C 1.541 0.632 0 O-C-N 121.36 -0.838 . . . . 3.8500000000000001 111.912 174.676 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.413 ' NZ ' ' OD2' ' A' ' 52' ' ' ASP . 0.2 OUTLIER -61.82 -49.41 76.4 Favored 'General case' 0 CA--C 1.533 0.322 0 O-C-N 121.217 -0.927 . . . . 3.4100000000000001 109.043 172.383 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 10.3 ttt -49.66 -45.83 49.07 Favored 'General case' 0 C--O 1.22 -0.453 0 N-CA-C 110.055 -0.35 . . . . 2.2599999999999998 110.055 178.109 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 78.5 mttt -62.68 -37.69 87.42 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 123.251 0.62 . . . . 3.3100000000000001 111.224 179.388 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.8 t -58.15 -40.69 82.01 Favored 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 118.667 0.667 . . . . 2.9100000000000001 110.358 170.737 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 60.7 mt -73.94 -78.84 0.09 Allowed 'General case' 0 CA--C 1.537 0.462 0 O-C-N 121.671 -0.643 . . . . 2.5899999999999999 111.003 178.011 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.5 t0 -77.77 67.87 3.73 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 126.803 2.041 . . . . 2.1400000000000001 110.006 -174.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 15.5 m -57.26 -19.65 11.11 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.424 0 N-CA-C 113.349 0.87 . . . . 3.1499999999999999 113.349 -179.618 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -92.54 -9.69 40.33 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 124.898 1.279 . . . . 2.8199999999999998 113.259 176.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 48.81 56.6 7.44 Favored 'General case' 0 CA--C 1.537 0.451 0 CA-C-N 119.644 1.111 . . . . 3.2799999999999998 111.624 -176.929 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 56.8 p-10 -95.36 -9.87 31.68 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 123.004 0.522 . . . . 2.25 110.265 170.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 48.2 m 63.61 20.73 12.39 Favored 'General case' 0 CA--C 1.533 0.306 0 C-N-CA 124.595 1.158 . . . . 1.99 111.912 -173.815 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -123.63 111.49 16.28 Favored 'General case' 0 N--CA 1.448 -0.554 0 N-CA-C 105.346 -2.094 . . . . 3.25 105.346 171.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -84.84 93.64 8.55 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 106.025 -1.842 . . . . 1.4299999999999999 106.025 173.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -55.22 155.6 4.79 Favored 'General case' 0 C--O 1.221 -0.417 0 C-N-CA 123.565 0.746 . . . . 4.2300000000000004 109.225 174.087 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 16.3 t80 -46.27 -55.54 7.05 Favored 'General case' 0 CA--C 1.54 0.583 0 CA-C-N 119.099 0.863 . . . . 4.9800000000000004 112.916 -172.364 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 11.5 t30 -60.09 -42.34 94.44 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-O 122.126 0.965 . . . . 1.77 111.472 176.757 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 3.7 tt0 -59.89 -42.52 93.98 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 126.025 1.73 . . . . 2.04 110.066 -176.801 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -66.73 -52.59 42.64 Favored 'General case' 0 N--CA 1.447 -0.624 0 C-N-CA 124.956 1.302 . . . . 2.6699999999999999 109.63 172.084 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.506 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 1.7 t-105 -42.99 -42.95 3.97 Favored 'General case' 0 C--N 1.344 0.365 0 O-C-N 123.735 0.647 . . . . 4.7599999999999998 109.819 179.976 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 44.0 mtt180 -37.0 -50.3 0.88 Allowed 'General case' 0 C--N 1.343 0.289 0 C-N-CA 124.302 1.041 . . . . 4.4800000000000004 111.447 -174.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.2 tp -45.36 -48.92 13.32 Favored 'General case' 0 C--O 1.221 -0.401 0 C-N-CA 123.611 0.764 . . . . 0.73999999999999999 110.941 -179.49 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 4.0 mp -69.02 -34.2 62.75 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.238 0 C-N-CA 124.91 1.284 . . . . 1.8700000000000001 109.055 -173.935 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.425 ' HA2' ' CD1' ' B' ' 77' ' ' TRP . . . -63.55 -43.97 97.27 Favored Glycine 0 N--CA 1.442 -0.902 0 N-CA-C 110.733 -0.947 . . . . 1.3100000000000001 110.733 172.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 1.2 mt-10 -59.89 -49.32 78.16 Favored 'General case' 0 N--CA 1.445 -0.72 0 CA-C-O 118.796 -0.621 . . . . 3.02 109.692 173.658 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.547 HD22 HD23 ' A' ' 49' ' ' LEU . 29.3 mt -49.25 -48.42 45.75 Favored 'General case' 0 CA--C 1.533 0.311 0 CA-C-N 119.789 1.177 . . . . 2.4700000000000002 112.448 -179.472 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.18 -25.92 35.69 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.416 0.686 . . . . 1.22 112.217 177.486 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 1.3 ttmt -81.25 -58.26 3.13 Favored 'General case' 0 CA--C 1.542 0.667 0 C-N-CA 126.292 1.837 . . . . 2.3500000000000001 109.848 168.383 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 34.6 mm-40 -49.71 -38.89 35.09 Favored 'General case' 0 N--CA 1.468 0.454 0 C-N-CA 125.662 1.585 . . . . 2.54 113.048 -172.64 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.6 tt -49.42 -37.03 10.51 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.548 0 N-CA-C 112.223 0.453 . . . . 1.21 112.223 176.225 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 18.6 ttm180 -98.43 -44.85 6.35 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 124.961 1.304 . . . . 5.9500000000000002 110.451 179.43 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 35.8 tttp -71.57 65.05 0.46 Allowed 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 126.114 1.766 . . . . 2.8599999999999999 109.792 178.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -78.82 -43.67 24.75 Favored 'General case' 0 N--CA 1.453 -0.276 0 O-C-N 121.29 -0.881 . . . . 7.2000000000000002 111.098 -176.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 16.1 tptt -162.36 67.08 0.23 Allowed 'General case' 0 CA--C 1.538 0.49 0 CA-C-O 122.502 1.144 . . . . 8.1699999999999999 108.74 177.773 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 18.7 p-10 -75.64 63.91 1.63 Allowed 'General case' 0 N--CA 1.455 -0.193 0 C-N-CA 126.667 1.987 . . . . 7.5099999999999998 111.268 -175.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -140.08 -47.7 0.44 Allowed 'General case' 0 C--N 1.331 -0.217 0 C-N-CA 123.915 0.886 . . . . 8.2100000000000009 109.56 164.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 30.0 mtpp -87.65 -47.28 8.8 Favored 'General case' 0 N--CA 1.455 -0.224 0 CA-C-O 119.095 -0.478 . . . . 10.74 110.08 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 77.4 mt 68.79 -64.25 0.22 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 125.962 1.705 . . . . 12.449999999999999 111.529 174.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 3.5 tmm_? 78.84 -45.02 0.37 Allowed 'General case' 0 CA--C 1.529 0.137 0 C-N-CA 128.14 2.576 . . . . 12.32 114.755 155.346 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . 2.278 39.4 mttp -178.26 130.36 0.13 Allowed 'General case' 0 CA--C 1.532 0.281 0 C-N-CA 125.905 1.682 . . . . 15.66 108.507 -157.025 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.406 ' C ' ' NZ ' ' A' ' 98' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.256 1.401 0 N-CA-C 104.531 -2.396 . . . . 13.44 104.531 163.94 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.41 1.2 ppp? . . . . . 0 N--CA 1.478 0.937 0 CA-C-O 116.199 -1.857 . . . . 6.0199999999999996 106.627 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 114.23 73.99 0.0 OUTLIER 'General case' 0 N--CA 1.473 0.7 0 C-N-CA 127.463 2.305 . . . . 5.7199999999999998 115.633 160.672 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 27.53 100.92 0.0 OUTLIER 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 117.754 2.501 . . . . 3.8599999999999999 117.754 137.397 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 98.6 mt-10 -91.5 151.86 43.0 Favored Pre-proline 0 CA--C 1.541 0.629 0 C-N-CA 123.921 0.888 . . . . 9.0700000000000003 110.717 168.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 93.7 Cg_endo -74.57 162.92 37.08 Favored 'Trans proline' 0 CA--C 1.536 0.602 0 C-N-CA 123.868 3.046 . . . . 3.6299999999999999 110.51 171.963 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 38.9 mt -139.72 150.28 44.65 Favored 'General case' 0 CA--C 1.544 0.717 0 C-N-CA 123.686 0.794 . . . . 2.5299999999999998 111.717 -159.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.5 HG23 ' N ' ' B' ' 8' ' ' GLU . 6.5 t -90.9 -66.6 0.91 Allowed 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 127.39 2.276 . . . . 2.6000000000000001 115.07 -173.534 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.5 ' N ' HG23 ' B' ' 7' ' ' THR . 37.5 tt0 -169.9 -75.66 0.02 OUTLIER 'General case' 0 CA--C 1.532 0.287 0 C-N-CA 123.92 0.888 . . . . 2.1800000000000002 108.69 -162.348 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.4 mt -56.83 -45.44 82.35 Favored 'General case' 0 CA--C 1.533 0.303 0 O-C-N 120.828 -1.17 . . . . 1.1299999999999999 109.774 165.792 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.484 ' HB2' ' H ' ' B' ' 7' ' ' THR . 72.1 mt-10 -50.77 -48.78 59.25 Favored 'General case' 0 CA--C 1.553 1.068 0 C-N-CA 123.932 0.893 . . . . 3.1299999999999999 110.768 170.751 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 5.2 mm-40 -58.18 -45.74 87.0 Favored 'General case' 0 N--CA 1.466 0.35 0 O-C-N 121.085 -1.009 . . . . 3.6400000000000001 110.791 176.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 19.4 m -60.24 -47.68 84.96 Favored 'General case' 0 N--CA 1.452 -0.328 0 C-N-CA 124.255 1.022 . . . . 1.7 110.752 -177.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.285 2.9 pp -61.68 -33.21 56.43 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.363 0 C-N-CA 120.322 -0.551 . . . . 0.94999999999999996 110.319 174.58 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -61.7 -58.97 5.96 Favored 'General case' 0 C--O 1.224 -0.282 0 CA-C-N 118.687 0.676 . . . . 2.6400000000000001 111.404 172.351 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 1.3 t -51.02 -40.1 57.39 Favored 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 119.386 0.994 . . . . 1.1799999999999999 111.559 -168.483 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 33.2 m -71.16 -43.58 74.96 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 O-C-N 121.366 -0.834 . . . . 0.93999999999999995 111.802 174.729 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 37.9 t -54.31 -58.37 3.91 Favored 'Isoleucine or valine' 0 C--N 1.341 0.21 0 CA-C-N 118.572 0.624 . . . . 1.1000000000000001 110.334 174.17 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 13.8 t -56.23 -47.22 78.88 Favored 'General case' 0 CA--C 1.532 0.252 0 CA-C-O 118.667 -0.682 . . . . 1.1699999999999999 110.562 178.517 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 98.3 m -58.49 -44.34 89.36 Favored 'General case' 0 C--N 1.342 0.253 0 CA-C-N 119.651 1.114 . . . . 1.3 111.82 -179.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -66.06 -43.82 86.32 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 117.952 -1.499 . . . . 4.1699999999999999 110.131 175.029 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 12.9 t80 -57.81 -46.49 84.59 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 124.119 0.968 . . . . 2.8999999999999999 111.824 -174.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 31.4 p -62.28 -25.43 67.85 Favored 'General case' 0 CA--C 1.534 0.347 0 O-C-N 121.392 -0.817 . . . . 2.2400000000000002 111.654 178.915 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 16.2 m-85 -80.52 -46.17 16.26 Favored 'General case' 0 C--O 1.224 -0.254 0 O-C-N 121.978 -0.451 . . . . 3.4100000000000001 110.491 170.123 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -57.03 -25.41 58.57 Favored 'General case' 0 C--O 1.239 0.516 0 C-N-CA 127.787 2.435 . . . . 0.93999999999999995 111.938 -178.064 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 18.1 ptt180 -45.09 -37.37 4.22 Favored 'General case' 0 CA--C 1.532 0.254 0 C-N-CA 124.783 1.233 . . . . 4.4199999999999999 111.021 171.267 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.463 ' HB2' ' HG2' ' B' ' 37' ' ' GLU . 0.5 OUTLIER -60.93 -70.02 0.2 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 116.708 2.114 . . . . 2.6800000000000002 116.708 -142.032 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 83.1 mt-10 -92.53 -74.3 0.52 Allowed 'General case' 0 C--N 1.34 0.185 0 C-N-CA 119.089 -1.044 . . . . 3.5899999999999999 113.463 -166.825 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.38 152.86 22.95 Favored Glycine 0 N--CA 1.447 -0.58 0 C-N-CA 126.384 1.945 . . . . 1.77 109.17 164.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 29.9 ttt180 43.37 100.64 0.0 OUTLIER 'General case' 0 C--O 1.241 0.63 0 C-N-CA 125.158 1.383 . . . . 4.0499999999999998 113.992 146.807 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 59.9 pttt -61.06 -22.32 64.49 Favored 'General case' 0 N--CA 1.45 -0.444 0 N-CA-C 114.538 1.31 . . . . 3.4100000000000001 114.538 -168.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -77.59 -25.52 50.0 Favored 'General case' 0 CA--C 1.532 0.258 0 N-CA-C 112.488 0.551 . . . . 4.0899999999999999 112.488 177.131 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 96.4 p -83.84 141.78 31.09 Favored 'General case' 0 CA--C 1.519 -0.225 0 CA-C-O 117.88 -1.057 . . . . 2.7000000000000002 110.836 -172.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 2.0 mm? -93.31 115.34 27.92 Favored 'General case' 0 CA--C 1.529 0.165 0 N-CA-C 106.124 -1.806 . . . . 2.0899999999999999 106.124 149.366 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 9.1 t -99.92 177.67 5.04 Favored 'General case' 0 CA--C 1.533 0.291 0 C-N-CA 123.047 0.539 . . . . 2.1600000000000001 109.671 161.464 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 11.5 p -85.76 50.81 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.532 0.268 0 O-C-N 120.724 -1.235 . . . . 2.5499999999999998 111.423 -173.554 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 60.2 t30 -159.75 53.28 0.36 Allowed 'General case' 0 CA--C 1.531 0.234 0 N-CA-C 107.38 -1.341 . . . . 2.54 107.38 147.909 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.463 ' HG2' ' HB2' ' B' ' 26' ' ' GLN . 73.8 mt-10 -160.48 -55.39 0.05 Allowed 'General case' 0 C--N 1.33 -0.25 0 C-N-CA 130.08 3.352 . . . . 1.6299999999999999 103.444 -174.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -59.3 -50.58 73.43 Favored 'General case' 0 N--CA 1.444 -0.747 0 CA-C-N 114.401 -1.272 . . . . 2.21 109.643 169.006 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 17.2 ttmt -62.65 -47.59 83.04 Favored 'General case' 0 C--N 1.342 0.263 0 C-N-CA 120.215 -0.594 . . . . 2.8100000000000001 109.546 -171.235 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 1.3 mm-40 -39.91 -48.35 2.32 Favored 'General case' 0 N--CA 1.451 -0.407 0 C-N-CA 123.233 0.613 . . . . 4.2599999999999998 112.078 167.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 2.8 tp -58.63 -49.27 78.13 Favored 'General case' 0 N--CA 1.451 -0.38 0 N-CA-C 108.906 -0.775 . . . . 1.95 108.906 -172.837 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . 0.472 ' HA ' HD23 ' B' ' 46' ' ' LEU . 4.6 m -74.25 -54.56 14.53 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.503 0 CA-C-N 115.703 -0.68 . . . . 0.64000000000000001 109.933 -173.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 63.5 m -53.03 -46.12 68.3 Favored 'General case' 0 N--CA 1.449 -0.495 0 C-N-CA 124.599 1.16 . . . . 0.96999999999999997 110.878 -179.985 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 14.9 tt0 -80.84 -62.39 1.68 Allowed 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 122.989 0.516 . . . . 1.9099999999999999 111.156 -173.924 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.9 mt-30 -84.28 -42.28 16.0 Favored 'General case' 0 CA--C 1.53 0.199 0 N-CA-C 115.633 1.716 . . . . 3.4700000000000002 115.633 -163.208 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . 0.472 HD23 ' HA ' ' B' ' 42' ' ' VAL . 0.6 OUTLIER -44.31 -46.2 23.15 Favored Pre-proline 0 N--CA 1.474 0.736 0 N-CA-C 115.576 1.695 . . . . 1.97 115.576 -155.282 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -77.74 -29.45 4.48 Favored 'Trans proline' 0 N--CA 1.449 -1.13 0 CA-C-N 120.827 1.331 . . . . 2.3100000000000001 109.477 -42.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 19.6 t60 -89.02 -49.69 6.62 Favored 'General case' 0 C--N 1.341 0.226 0 C-N-CA 125.224 1.41 . . . . 2.4900000000000002 110.844 -168.724 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.473 ' CD2' ' HG ' ' B' ' 83' ' ' LEU . 6.3 tp -34.24 -60.27 0.41 Allowed 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 126.853 2.061 . . . . 1.2 113.852 -171.042 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 54.9 mt -96.16 111.82 23.74 Favored 'General case' 0 CA--C 1.521 -0.169 0 N-CA-C 108.239 -1.023 . . . . 1.46 108.239 172.244 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 14.4 ptpt -64.49 154.46 35.82 Favored 'General case' 0 N--CA 1.453 -0.324 0 C-N-CA 120.237 -0.585 . . . . 5.5199999999999996 109.582 165.599 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 17.0 t0 61.17 82.94 0.16 Allowed 'General case' 0 N--CA 1.453 -0.319 0 C-N-CA 125.425 1.49 . . . . 4.5999999999999996 109.684 -168.534 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 29.5 m -96.78 21.94 1.11 Allowed 'Isoleucine or valine' 0 N--CA 1.443 -0.786 0 CA-C-N 113.542 -1.663 . . . . 2.8999999999999999 109.601 166.224 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -110.79 -65.93 0.53 Allowed Glycine 0 C--N 1.343 0.954 0 N-CA-C 109.605 -1.398 . . . . 3.6699999999999999 109.605 -174.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -81.67 46.3 0.96 Allowed 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.131 0.972 . . . . 4.4900000000000002 109.803 -179.01 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -55.09 -42.28 72.67 Favored 'General case' 0 N--CA 1.446 -0.65 0 C-N-CA 124.189 0.996 . . . . 2.0499999999999998 109.519 -179.701 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -25.78 -51.26 0.04 OUTLIER 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 126.348 1.859 . . . . 4.3700000000000001 113.69 164.963 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 37.3 tt0 -52.88 -56.51 15.32 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 118.986 0.812 . . . . 3.2799999999999998 111.448 174.898 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -61.59 -53.79 51.65 Favored 'General case' 0 C--O 1.224 -0.262 0 N-CA-C 108.236 -1.024 . . . . 4.6100000000000003 108.236 -178.295 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -50.67 -53.21 32.98 Favored 'General case' 0 C--N 1.332 -0.16 0 C-N-CA 125.386 1.474 . . . . 3.0600000000000001 111.015 -178.166 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 38.6 ttmt -61.07 -30.8 70.55 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 123.366 0.666 . . . . 3.9399999999999999 111.235 -178.543 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 8.2 t -71.82 -55.22 7.98 Favored 'General case' 0 CA--C 1.537 0.463 0 N-CA-C 109.831 -0.433 . . . . 2.6299999999999999 109.831 173.48 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 33.6 mt -51.9 -44.13 63.64 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.599 1.56 . . . . 1.51 111.446 -179.404 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.271 22.9 t0 -50.23 -8.7 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.593 0 N-CA-C 118.105 2.631 . . . . 1.8799999999999999 118.105 -173.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 23.3 m -32.92 -20.36 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.474 0.755 1 C-N-CA 132.074 4.15 . . . . 2.2400000000000002 119.14 -133.74 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -50.02 -39.81 42.66 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 119.792 1.178 . . . . 2.46 109.544 156.964 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 60.8 mt-30 62.3 63.43 1.05 Allowed 'General case' 0 CA--C 1.53 0.199 0 C-N-CA 125.633 1.573 . . . . 3.02 109.021 -171.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 32.7 p30 -116.93 -8.57 11.27 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 127.333 2.253 . . . . 2.7000000000000002 112.754 -175.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 2.1 t 92.19 -7.42 0.2 Allowed 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 127.068 2.147 . . . . 3.5299999999999998 113.239 178.342 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 23.1 mt-10 -129.65 119.56 23.75 Favored 'General case' 0 C--O 1.234 0.256 0 CA-C-N 119.207 0.912 . . . . 4.4199999999999999 110.736 -175.739 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -83.59 105.72 14.74 Favored 'General case' 0 CA--C 1.532 0.261 0 N-CA-C 107.634 -1.247 . . . . 1.3999999999999999 107.634 176.729 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 36.7 ttpt -84.0 175.06 9.81 Favored 'General case' 0 CA--C 1.539 0.536 0 C-N-CA 125.852 1.661 . . . . 3.5499999999999998 110.971 -175.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 22.0 m-85 -81.61 56.7 3.08 Favored 'General case' 0 CA--C 1.542 0.636 0 C-N-CA 123.668 0.787 . . . . 4.4699999999999998 110.643 178.907 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -168.83 45.89 0.04 OUTLIER 'General case' 0 CA--C 1.541 0.623 0 CA-C-O 121.855 0.836 . . . . 2.6699999999999999 110.178 110.635 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 25.4 mt-10 -90.73 -61.36 1.69 Allowed 'General case' 0 N--CA 1.446 -0.625 0 C-N-CA 127.006 2.122 . . . . 2.21 107.779 153.484 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 80.0 t80 -50.87 -38.17 47.79 Favored 'General case' 0 CA--C 1.518 -0.279 0 CA-C-N 114.648 -1.16 . . . . 3.9199999999999999 111.224 -170.101 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.464 ' C ' ' CD1' ' B' ' 77' ' ' TRP . 5.1 t90 -38.86 -48.17 1.51 Allowed 'General case' 0 CA--C 1.541 0.604 0 O-C-N 124.562 1.164 . . . . 4.6200000000000001 109.906 177.365 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 14.1 mmt-85 -42.02 -39.12 1.82 Allowed 'General case' 0 C--O 1.223 -0.311 0 CA-C-O 118.317 -0.849 . . . . 6.3899999999999997 112.959 -176.133 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.45 ' O ' HD13 ' B' ' 83' ' ' LEU . 6.5 tp -55.5 -47.68 75.81 Favored 'General case' 0 CA--C 1.54 0.587 0 CA-C-N 120.091 1.314 . . . . 0.84999999999999998 111.732 177.431 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 1.4 mt -69.93 -34.88 62.0 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.381 0 O-C-N 120.92 -1.113 . . . . 1.75 108.701 178.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -41.32 -52.31 4.32 Favored Glycine 0 C--N 1.345 1.029 0 C-N-CA 126.075 1.798 . . . . 1.76 110.216 168.596 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 3.3 mm-40 -76.67 -60.31 2.4 Favored 'General case' 0 N--CA 1.431 -1.418 0 CA-C-N 112.031 -2.085 . . . . 2.71 108.842 -175.931 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.473 ' HG ' ' CD2' ' B' ' 49' ' ' LEU . 6.5 mp -37.44 -58.46 0.85 Allowed 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 120.767 1.621 . . . . 2.1299999999999999 112.688 -172.884 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.91 -28.62 69.65 Favored 'General case' 0 CA--C 1.529 0.166 0 C-N-CA 124.347 1.059 . . . . 1.6100000000000001 112.67 -176.553 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 21.7 ttpp -80.32 -51.79 8.47 Favored 'General case' 0 N--CA 1.446 -0.642 0 C-N-CA 123.668 0.787 . . . . 1.8 110.092 172.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 4.5 mm-40 -51.48 -44.47 62.48 Favored 'General case' 0 N--CA 1.456 -0.137 0 C-N-CA 124.292 1.037 . . . . 3.52 112.028 -176.932 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 8.9 tt -52.92 -38.59 29.09 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.679 0 CA-C-N 118.926 0.785 . . . . 1.2 111.722 175.291 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.75 -30.75 26.42 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 125.827 1.651 . . . . 3.54 113.892 -179.673 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 53.2 tttp -97.94 147.28 24.63 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.785 1.634 . . . . 4.79 111.936 -163.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -84.69 -60.87 1.93 Allowed 'General case' 0 C--N 1.342 0.26 0 O-C-N 121.538 -0.727 . . . . 4.9000000000000004 112.388 -176.778 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 53.4 pttt -168.51 4.14 0.02 OUTLIER 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.349 1.46 . . . . 8.5099999999999998 111.781 -174.487 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -93.65 53.32 1.83 Allowed 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 125.152 1.381 . . . . 4.4199999999999999 108.248 -146.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 42.1 tp -106.22 -71.62 0.74 Allowed 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 125.303 1.441 . . . . 4.8499999999999996 109.462 -168.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -170.3 162.92 8.72 Favored 'General case' 0 N--CA 1.464 0.264 0 CA-C-N 118.597 0.635 . . . . 7.5199999999999996 110.382 179.024 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 7.3 tp -145.73 48.74 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.496 0 CA-C-O 122.945 1.355 . . . . 9.1600000000000001 107.921 166.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 14.6 tpp85 -166.75 152.12 7.91 Favored 'General case' 0 N--CA 1.452 -0.369 0 CA-C-N 115.22 -0.9 . . . . 8.8499999999999996 109.484 177.22 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -177.69 137.28 0.2 Allowed 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 129.093 2.957 . . . . 9.0099999999999998 104.929 172.742 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.256 1.438 0 N-CA-C 103.947 -2.612 . . . . 10.07 103.947 168.717 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.0 mtt . . . . . 0 N--CA 1.472 0.629 0 N-CA-C 106.012 -1.848 . . . . 6.2599999999999998 106.012 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -99.28 179.09 4.7 Favored 'General case' 0 CA--C 1.527 0.095 0 CA-C-N 119.362 0.983 . . . . 3.0299999999999998 110.38 177.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 80.59 77.75 0.04 OUTLIER 'General case' 0 CA--C 1.53 0.185 0 C-N-CA 127.397 2.279 . . . . 3.5099999999999998 110.559 -176.304 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 5.4 tp10 -77.33 122.94 86.87 Favored Pre-proline 0 N--CA 1.442 -0.869 0 C-N-CA 124.427 1.091 . . . . 5.3899999999999997 109.117 -175.515 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 81.4 Cg_endo -70.04 140.77 42.43 Favored 'Trans proline' 0 N--CA 1.451 -1.025 0 C-N-CA 121.96 1.773 . . . . 2.2599999999999998 108.769 175.014 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.0 mt -99.3 176.03 5.67 Favored 'General case' 0 N--CA 1.453 -0.286 0 N-CA-C 108.394 -0.965 . . . . 1.3899999999999999 108.394 -179.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.412 HG22 ' CG ' ' A' ' 10' ' ' GLU . 2.5 t -70.47 162.74 28.19 Favored 'General case' 0 CA--C 1.53 0.175 0 O-C-N 120.952 -1.092 . . . . 1.78 109.749 178.631 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 49.0 tt0 -56.44 -50.19 72.4 Favored 'General case' 0 CA--C 1.534 0.333 0 CA-C-O 121.649 0.738 . . . . 2.02 110.474 -170.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 7.6 mt -60.74 -46.55 90.0 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-O 117.251 -1.357 . . . . 1.49 111.945 176.38 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.412 ' CG ' HG22 ' A' ' 7' ' ' THR . 71.0 mt-10 -49.65 -55.13 14.83 Favored 'General case' 0 N--CA 1.468 0.451 0 CA-C-N 120.656 1.571 . . . . 2.2400000000000002 112.171 172.335 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 75.4 mm-40 -50.55 -52.53 38.0 Favored 'General case' 0 CA--C 1.536 0.411 0 CA-C-O 121.663 0.744 . . . . 4.04 109.299 176.787 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 9.4 t -57.6 -50.86 71.75 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 115.285 -0.87 . . . . 1.6399999999999999 111.441 -176.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.451 HG21 HD12 ' B' ' 83' ' ' LEU . 2.2 pp -66.37 -39.05 83.14 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.334 0 CA-C-O 118.169 -0.92 . . . . 0.69999999999999996 111.07 -179.617 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.0 tm-20 -58.89 -55.61 32.85 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 119.619 1.1 . . . . 2.98 109.93 178.959 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 15.0 t -54.13 -38.84 65.9 Favored 'General case' 0 CA--C 1.543 0.693 0 CA-C-N 118.625 0.648 . . . . 1.29 112.456 -174.129 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 m -75.03 -40.54 45.09 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 O-C-N 120.714 -1.241 . . . . 0.64000000000000001 111.148 175.225 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 25.2 t -57.83 -49.54 80.65 Favored 'Isoleucine or valine' 0 CA--C 1.529 0.15 0 CA-C-N 119.196 0.907 . . . . 0.56999999999999995 110.461 178.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.2 t -60.12 -44.94 94.5 Favored 'General case' 0 CA--C 1.537 0.453 0 CA-C-N 118.828 0.74 . . . . 0.76000000000000001 110.538 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 62.0 m -58.02 -56.47 21.56 Favored 'General case' 0 CA--C 1.538 0.486 0 O-C-N 121.759 -0.588 . . . . 0.78000000000000003 110.192 177.096 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -43.63 -56.3 3.81 Favored 'General case' 0 N--CA 1.458 -0.065 0 C-N-CA 125.009 1.324 . . . . 3.1800000000000002 110.299 172.626 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 51.8 t80 -58.1 -52.86 63.77 Favored 'General case' 0 N--CA 1.45 -0.456 0 C-N-CA 124.076 0.95 . . . . 2.8100000000000001 110.261 -174.681 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.5 t -65.15 -33.22 75.51 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 120.195 -0.602 . . . . 2.1699999999999999 111.538 -177.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.5 m-85 -61.47 -50.94 70.72 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-N 118.842 0.746 . . . . 2.6899999999999999 110.473 168.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -62.01 -19.68 63.11 Favored 'General case' 0 C--O 1.235 0.308 0 C-N-CA 125.712 1.605 . . . . 0.87 112.26 -175.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -76.68 -18.96 58.24 Favored 'General case' 0 N--CA 1.453 -0.312 0 C-N-CA 125.557 1.543 . . . . 3.8199999999999998 112.054 176.67 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -45.71 -69.39 0.13 Allowed 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 118.953 0.797 . . . . 2.6800000000000002 112.171 -179.698 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -111.26 171.25 7.59 Favored 'General case' 0 N--CA 1.444 -0.73 0 C-N-CA 125.73 1.612 . . . . 2.6099999999999999 107.082 -172.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -20.75 131.57 0.01 OUTLIER Glycine 0 CA--C 1.53 1.019 0 C-N-CA 127.338 2.399 . . . . 1.5800000000000001 114.333 179.893 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 26.3 mmm-85 64.92 103.25 0.04 OUTLIER 'General case' 0 C--O 1.237 0.438 0 C-N-CA 124.699 1.2 . . . . 6.6600000000000001 111.502 178.508 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 19.9 pttm -73.21 56.2 0.46 Allowed 'General case' 0 CA--C 1.534 0.337 0 C-N-CA 123.85 0.86 . . . . 3.5899999999999999 111.439 173.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 1.8 p30 -163.38 -54.62 0.04 OUTLIER 'General case' 0 N--CA 1.451 -0.383 0 C-N-CA 125.309 1.443 . . . . 3.6400000000000001 108.229 -176.556 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 97.8 p -83.91 150.29 25.79 Favored 'General case' 0 C--O 1.243 0.748 0 CA-C-O 121.213 0.53 . . . . 1.8 111.295 175.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 3.1 mm? -96.51 126.27 41.58 Favored 'General case' 0 C--O 1.232 0.171 0 N-CA-C 107.611 -1.255 . . . . 1.8200000000000001 107.611 168.594 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.6 t -83.37 177.42 8.5 Favored 'General case' 0 CA--C 1.533 0.327 0 N-CA-C 109.554 -0.536 . . . . 2.3199999999999998 109.554 164.087 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.7 p -61.42 -49.62 83.74 Favored 'Isoleucine or valine' 0 C--O 1.232 0.155 0 O-C-N 121.963 -0.46 . . . . 2.0800000000000001 111.517 -171.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 14.4 t-20 -63.49 -54.2 40.05 Favored 'General case' 0 C--O 1.223 -0.306 0 N-CA-C 108.333 -0.988 . . . . 2.3199999999999998 108.333 179.363 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.1 tt0 -36.97 -51.83 0.93 Allowed 'General case' 0 CA--C 1.529 0.163 0 C-N-CA 125.238 1.415 . . . . 1.9299999999999999 111.53 172.512 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 6.1 t80 -61.87 -53.97 48.54 Favored 'General case' 0 N--CA 1.442 -0.831 0 CA-C-N 115.511 -0.768 . . . . 2.3399999999999999 110.791 177.53 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 15.6 ttmm -56.32 -41.8 76.61 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 121.944 -0.472 . . . . 2.5099999999999998 110.219 -176.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -55.41 -36.31 66.31 Favored 'General case' 0 N--CA 1.449 -0.48 0 C-N-CA 122.768 0.427 . . . . 3.2999999999999998 111.145 178.274 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 8.1 tt -68.17 -48.26 65.8 Favored 'General case' 0 C--O 1.231 0.126 0 CA-C-N 119.403 1.001 . . . . 2.5 109.737 -178.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.1 m -67.15 -39.94 84.18 Favored 'Isoleucine or valine' 0 CA--C 1.527 0.093 0 N-CA-C 109.507 -0.553 . . . . 0.92000000000000004 109.507 -176.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 95.0 m -63.37 -52.94 59.62 Favored 'General case' 0 N--CA 1.45 -0.46 0 C-N-CA 124.011 0.924 . . . . 1.1599999999999999 110.69 176.554 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 10.5 tt0 -78.34 -54.78 5.82 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 123.505 0.722 . . . . 2.04 111.257 -167.684 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 6.6 mm100 -120.32 43.11 2.8 Favored 'General case' 0 CA--C 1.531 0.25 0 C-N-CA 123.498 0.719 . . . . 3.5699999999999998 111.045 -163.74 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 tp -153.18 61.07 3.48 Favored Pre-proline 0 CA--C 1.542 0.671 0 O-C-N 121.885 -0.509 . . . . 1.5700000000000001 111.013 177.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 50.4 Cg_endo -66.72 -43.82 6.77 Favored 'Trans proline' 0 N--CA 1.453 -0.858 0 C-N-CA 124.169 3.246 . . . . 2.02 115.385 -165.858 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 32.0 t60 -132.27 26.98 4.49 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 120.008 1.276 . . . . 3.46 112.281 -166.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.419 HD23 HD22 ' A' ' 83' ' ' LEU . 11.5 tp -99.93 -75.99 0.56 Allowed 'General case' 0 N--CA 1.45 -0.43 0 C-N-CA 122.566 0.347 . . . . 1.5800000000000001 110.796 -168.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 2.0 mp -91.74 -175.94 4.31 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 124.639 1.175 . . . . 3.0 108.604 166.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 16.6 pttp -134.74 -160.76 1.08 Allowed 'General case' 0 CA--C 1.539 0.528 0 N-CA-C 106.93 -1.507 . . . . 5.7300000000000004 106.93 159.904 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 15.8 m-20 69.15 26.94 5.38 Favored 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 125.639 1.575 . . . . 3.7799999999999998 111.291 171.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.9 m -68.38 -8.97 10.49 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.388 0 C-N-CA 124.939 1.295 . . . . 2.02 112.962 -174.64 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -60.65 -64.28 4.24 Favored Glycine 0 CA--C 1.527 0.811 0 N-CA-C 108.792 -1.723 . . . . 1.78 108.792 166.924 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -69.89 53.65 0.12 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 129.191 2.996 . . . . 2.52 111.646 178.384 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -74.31 -26.36 60.12 Favored 'General case' 0 N--CA 1.444 -0.768 0 C-N-CA 124.985 1.314 . . . . 1.3600000000000001 109.33 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -54.14 -46.36 72.22 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 124.663 1.185 . . . . 4.2300000000000004 111.224 176.504 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 21.5 tt0 -50.12 -54.85 17.78 Favored 'General case' 0 C--O 1.234 0.255 0 CA-C-O 121.788 0.804 . . . . 2.8700000000000001 109.7 174.208 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.02 -47.93 83.44 Favored 'General case' 0 N--CA 1.445 -0.708 0 CA-C-N 115.412 -0.813 . . . . 4.9100000000000001 109.966 -177.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 7.4 tmm? -51.12 -58.42 6.16 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 124.965 1.306 . . . . 2.04 109.455 176.586 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 76.9 mttt -52.83 -44.18 66.51 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.422 1.089 . . . . 3.3399999999999999 110.983 178.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 21.1 m -65.68 -38.99 90.8 Favored 'General case' 0 CA--C 1.533 0.323 0 C-N-CA 123.173 0.589 . . . . 2.21 111.839 -179.877 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 34.8 mt -77.9 -47.09 19.53 Favored 'General case' 0 C--O 1.235 0.294 0 C-N-CA 124.501 1.12 . . . . 1.72 111.708 -175.49 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 5.6 t70 -72.47 91.46 1.38 Allowed 'General case' 0 N--CA 1.448 -0.549 0 C-N-CA 123.455 0.702 . . . . 2.3399999999999999 110.194 -170.35 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 26.2 m -55.38 -37.55 45.04 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.181 0 C-N-CA 122.796 0.438 . . . . 2.3900000000000001 112.143 -167.349 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 29.0 p-10 -97.26 -0.88 45.9 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 112.762 0.653 . . . . 2.1899999999999999 112.762 179.676 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 72.5 mt-30 46.21 48.74 13.02 Favored 'General case' 0 CA--C 1.531 0.231 0 C-N-CA 125.489 1.515 . . . . 4.5300000000000002 111.806 -178.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 55.4 p30 -90.84 -12.62 35.76 Favored 'General case' 0 CA--C 1.535 0.39 0 C-N-CA 124.207 1.003 . . . . 1.78 110.685 168.895 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 35.4 p 70.47 7.05 6.07 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 127.52 2.328 . . . . 1.97 114.074 -176.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 2.5 mt-10 -95.06 112.82 24.48 Favored 'General case' 0 N--CA 1.453 -0.319 0 N-CA-C 104.741 -2.318 . . . . 2.9300000000000002 104.741 160.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.9 mm? -80.74 96.67 7.01 Favored 'General case' 0 N--CA 1.449 -0.506 0 N-CA-C 103.766 -2.679 . . . . 1.01 103.766 171.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -54.15 158.32 2.27 Favored 'General case' 0 CA--C 1.532 0.252 0 N-CA-C 108.481 -0.933 . . . . 3.8999999999999999 108.481 171.837 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 10.1 p90 -38.94 -52.41 1.78 Allowed 'General case' 0 CA--C 1.538 0.509 0 C-N-CA 124.879 1.271 . . . . 6.0099999999999998 111.915 -179.132 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 5.4 t30 -70.36 -35.17 73.39 Favored 'General case' 0 CA--C 1.538 0.513 0 C-N-CA 123.181 0.592 . . . . 1.6299999999999999 112.494 -179.108 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.9 mt-10 -65.13 -51.73 59.52 Favored 'General case' 0 C--O 1.227 -0.129 0 O-C-N 121.643 -0.661 . . . . 2.1499999999999999 109.257 176.46 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 16.3 t80 -56.1 -49.86 72.68 Favored 'General case' 0 N--CA 1.454 -0.254 0 C-N-CA 122.788 0.435 . . . . 2.9900000000000002 110.058 178.018 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' B' ' 77' ' ' TRP . 0.7 OUTLIER -40.02 -44.0 1.66 Allowed 'General case' 0 CA--C 1.535 0.402 0 O-C-N 124.164 0.915 . . . . 4.2400000000000002 110.691 179.169 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 17.6 mtm180 -42.58 -40.49 2.7 Favored 'General case' 0 CA--C 1.532 0.272 0 N-CA-C 114.176 1.176 . . . . 3.7400000000000002 114.176 178.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 60.4 tp -46.19 -51.23 14.59 Favored 'General case' 0 N--CA 1.454 -0.265 0 CA-C-N 119.252 0.933 . . . . 0.91000000000000003 111.107 175.401 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 78.1 mt -57.38 -28.94 31.95 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.568 0 C-N-CA 124.656 1.182 . . . . 1.4299999999999999 107.824 -175.315 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.524 ' HA3' ' CE2' ' B' ' 77' ' ' TRP . . . -76.99 -48.89 8.03 Favored Glycine 0 N--CA 1.44 -1.071 0 N-CA-C 109.607 -1.397 . . . . 1.1499999999999999 109.607 -178.833 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 29.3 mt-10 -48.61 -52.61 22.16 Favored 'General case' 0 C--O 1.213 -0.827 0 CA-C-O 117.752 -1.118 . . . . 4.1399999999999997 108.291 169.865 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.419 HD22 HD23 ' A' ' 49' ' ' LEU . 11.6 mt -49.48 -52.78 26.98 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 120.077 1.308 . . . . 2.4700000000000002 111.712 178.599 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.4 -21.32 24.3 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 123.9 0.88 . . . . 1.22 112.386 176.073 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.62 -61.5 1.95 Allowed 'General case' 0 C--O 1.221 -0.437 0 CA-C-O 117.434 -1.27 . . . . 2.27 112.956 162.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.8 mm-40 -54.91 -33.83 62.5 Favored 'General case' 0 N--CA 1.462 0.158 0 C-N-CA 125.834 1.654 . . . . 2.9300000000000002 112.119 -166.103 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 1.7 tp -38.39 -44.3 0.37 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.832 0 C-N-CA 124.808 1.243 . . . . 1.3400000000000001 111.465 167.247 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 51.4 mtt85 -104.67 -58.47 1.88 Allowed 'General case' 0 N--CA 1.452 -0.354 0 C-N-CA 127.044 2.138 . . . . 7.6200000000000001 110.665 178.265 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 3.3 ttpm? -72.28 54.79 0.31 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 125.717 1.607 . . . . 3.4900000000000002 112.784 -175.075 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 19.6 ttmt -81.02 -19.64 43.47 Favored 'General case' 0 CA--C 1.544 0.718 0 O-C-N 120.741 -1.224 . . . . 7.5499999999999998 114.053 -172.52 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 57.0 tptt 177.71 -31.07 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 126.281 1.832 . . . . 10.01 110.884 170.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 75.83 35.41 0.51 Allowed 'General case' 0 CA--C 1.527 0.081 0 C-N-CA 123.308 0.643 . . . . 5.5 112.184 151.677 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 21.2 tp -149.57 -54.84 0.17 Allowed 'General case' 0 N--CA 1.443 -0.811 0 N-CA-C 107.135 -1.432 . . . . 9.1300000000000008 107.135 174.764 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 25.3 mtpp -111.61 -65.44 1.17 Allowed 'General case' 0 N--CA 1.464 0.231 0 C-N-CA 123.405 0.682 . . . . 10.9 110.873 174.529 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . 0.259 1.4 pp 50.6 -173.77 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.519 0 C-N-CA 125.919 1.688 . . . . 8.6699999999999999 112.849 -165.986 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.03 126.85 11.81 Favored 'General case' 0 N--CA 1.451 -0.408 0 N-CA-C 106.09 -1.818 . . . . 13.5 106.09 163.562 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -178.18 -63.4 0.01 OUTLIER 'General case' 0 CA--C 1.528 0.097 0 C-N-CA 124.723 1.209 . . . . 10.81 107.961 -173.262 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . 2.396 6.7 mtpm? . . . . . 0 C--O 1.25 1.106 0 CA-C-O 117.054 -1.451 . . . . 10.199999999999999 111.01 -176.623 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.418 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.613 0 N-CA-C 105.487 -2.042 . . . . 6.79 105.487 . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 66.12 -170.97 0.19 Allowed 'General case' 0 N--CA 1.464 0.242 0 CA-C-N 119.8 1.182 . . . . 5.0099999999999998 113.16 169.287 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 57.76 51.48 9.23 Favored 'General case' 0 N--CA 1.447 -0.596 0 C-N-CA 125.43 1.492 . . . . 4.5599999999999996 111.59 -178.666 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -117.59 153.53 50.5 Favored Pre-proline 0 CA--C 1.536 0.408 0 C-N-CA 126.05 1.74 . . . . 7.9900000000000002 106.693 170.235 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -71.98 150.12 54.22 Favored 'Trans proline' 0 N--CA 1.457 -0.659 0 C-N-CA 122.758 2.305 . . . . 2.8900000000000001 108.981 172.307 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 30.0 mt -140.17 137.57 34.48 Favored 'General case' 0 CA--C 1.53 0.205 0 N-CA-C 108.68 -0.859 . . . . 2.6499999999999999 108.68 -166.345 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.456 HG23 ' N ' ' B' ' 8' ' ' GLU . 6.4 t -69.15 -65.59 0.69 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 113.062 0.764 . . . . 2.5299999999999998 113.062 -174.869 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.456 ' N ' HG23 ' B' ' 7' ' ' THR . 43.9 tt0 -168.82 -75.97 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.221 0 N-CA-C 108.78 -0.822 . . . . 1.96 108.78 -162.318 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 mt -57.3 -45.29 84.32 Favored 'General case' 0 CA--C 1.53 0.177 0 O-C-N 120.98 -1.075 . . . . 1.01 109.366 167.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 83.5 mt-10 -56.06 -39.11 71.54 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.867 1.267 . . . . 3.46 110.52 174.218 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -71.28 -50.89 28.05 Favored 'General case' 0 CA--C 1.532 0.257 0 N-CA-C 108.852 -0.795 . . . . 4.46 108.852 -176.47 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 5.4 p -61.3 -35.48 77.45 Favored 'General case' 0 N--CA 1.454 -0.275 0 CA-C-N 115.445 -0.798 . . . . 1.51 110.747 -172.319 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . 0.493 ' O ' HG23 ' B' ' 17' ' ' VAL 0.332 2.9 pp -62.38 -42.41 95.44 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.422 0 CA-C-O 118.395 -0.812 . . . . 1.0700000000000001 111.311 173.901 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 8.9 tt0 -67.2 -42.94 83.29 Favored 'General case' 0 C--N 1.343 0.319 0 CA-C-N 120.763 1.62 . . . . 3.75 110.419 175.182 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 16.9 m -43.77 -47.68 8.01 Favored 'General case' 0 CA--C 1.541 0.612 0 CA-C-N 119.261 0.937 . . . . 2.4100000000000001 112.304 175.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 35.2 m -74.02 -37.16 46.62 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.369 0 O-C-N 120.777 -1.202 . . . . 1.0 111.431 177.604 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . 0.493 HG23 ' O ' ' B' ' 13' ' ' ILE . 95.6 t -54.85 -49.68 67.76 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.411 0 CA-C-N 119.308 0.958 . . . . 1.22 110.242 173.973 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 12.8 t -64.24 -39.26 93.59 Favored 'General case' 0 CA--C 1.534 0.334 0 O-C-N 121.494 -0.754 . . . . 1.24 110.656 179.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 34.6 m -58.9 -38.72 79.54 Favored 'General case' 0 CA--C 1.533 0.318 0 CA-C-N 118.78 0.718 . . . . 1.5700000000000001 111.076 174.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . 0.45 ' CE1' ' HB2' ' B' ' 24' ' ' ALA . 0.0 OUTLIER -60.28 -52.57 64.7 Favored 'General case' 0 CA--C 1.537 0.452 0 O-C-N 121.183 -0.948 . . . . 4.3899999999999997 109.165 169.325 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 17.6 t80 -55.01 -41.04 70.79 Favored 'General case' 0 N--CA 1.453 -0.308 0 C-N-CA 123.499 0.72 . . . . 3.0299999999999998 112.672 -172.383 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 16.6 p -57.93 -30.26 65.8 Favored 'General case' 0 CA--C 1.535 0.381 0 CA-C-O 118.722 -0.656 . . . . 2.9500000000000002 112.197 177.522 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 68.2 m-85 -82.07 -34.62 29.3 Favored 'General case' 0 N--CA 1.465 0.325 0 CA-C-N 119.376 0.989 . . . . 2.8300000000000001 112.514 167.007 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . 0.45 ' HB2' ' CE1' ' B' ' 20' ' ' PHE . . . -51.05 -44.6 61.13 Favored 'General case' 0 CA--C 1.514 -0.434 0 C-N-CA 124.167 0.987 . . . . 1.1499999999999999 109.949 -174.905 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 1.2 ptm180 -51.49 -38.55 54.5 Favored 'General case' 0 N--CA 1.455 -0.208 0 O-C-N 124.545 1.153 . . . . 3.3399999999999999 112.96 178.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -55.47 -69.17 0.14 Allowed 'General case' 0 CA--C 1.54 0.573 0 N-CA-C 116.89 2.181 . . . . 1.79 116.89 -136.574 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 78.6 mt-10 -93.15 -76.91 0.46 Allowed 'General case' 0 C--N 1.341 0.204 0 CA-C-O 122.216 1.008 . . . . 3.73 113.652 -173.718 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -91.06 153.53 22.37 Favored Glycine 0 N--CA 1.445 -0.702 0 C-N-CA 127.593 2.521 . . . . 2.21 109.767 167.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 13.6 ttt85 45.06 101.63 0.0 OUTLIER 'General case' 0 C--O 1.245 0.824 0 C-N-CA 125.706 1.602 . . . . 4.0899999999999999 114.028 153.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 58.7 pttt -73.09 59.6 0.53 Allowed 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 124.712 1.205 . . . . 3.9700000000000002 112.113 -179.717 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 9.2 t0 -160.98 -61.19 0.06 Allowed 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.173 1.389 . . . . 3.71 108.501 -168.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 55.2 p -97.44 158.71 15.33 Favored 'General case' 0 C--O 1.245 0.842 0 C-N-CA 123.418 0.687 . . . . 1.96 109.648 -173.588 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 62.6 mt -107.91 157.06 18.51 Favored 'General case' 0 N--CA 1.455 -0.202 0 O-C-N 124.491 1.12 . . . . 2.5800000000000001 109.187 164.285 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 7.9 t -152.26 178.62 9.31 Favored 'General case' 0 C--N 1.327 -0.398 0 N-CA-C 106.684 -1.599 . . . . 3.6800000000000002 106.684 167.354 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 3.2 t -83.85 56.84 0.14 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 118.743 0.701 . . . . 2.7999999999999998 112.008 -161.986 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 57.5 t30 -156.5 56.4 0.56 Allowed 'General case' 0 C--O 1.225 -0.211 0 N-CA-C 106.782 -1.562 . . . . 2.25 106.782 141.317 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 1.3 tt0 -173.87 -52.09 0.01 OUTLIER 'General case' 0 C--O 1.225 -0.188 0 C-N-CA 125.842 1.657 . . . . 1.74 106.703 -166.191 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 9.2 t80 -61.6 -53.06 61.34 Favored 'General case' 0 N--CA 1.447 -0.576 0 CA-C-N 115.461 -0.79 . . . . 2.1699999999999999 108.968 168.298 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 38.4 tttt -57.93 -37.06 73.42 Favored 'General case' 0 CA--C 1.533 0.313 0 CA-C-N 116.57 -0.286 . . . . 2.7999999999999998 111.08 -174.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 74.2 mt-10 -47.35 -36.86 10.09 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 112.806 0.669 . . . . 3.4900000000000002 112.806 173.092 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 6.6 tt -66.45 -51.28 58.56 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 107.799 -1.185 . . . . 2.48 107.799 -175.579 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 14.3 m -67.4 -46.14 84.19 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.264 0 N-CA-C 109.802 -0.444 . . . . 0.71999999999999997 109.802 -176.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 99.0 m -55.73 -50.73 69.57 Favored 'General case' 0 N--CA 1.448 -0.572 0 C-N-CA 123.93 0.892 . . . . 0.85999999999999999 111.517 176.525 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 13.3 tt0 -76.1 -61.62 1.88 Allowed 'General case' 0 N--CA 1.455 -0.216 0 CA-C-N 118.302 0.501 . . . . 3.2799999999999998 111.111 -174.558 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 40.4 mm-40 -81.36 -46.44 14.66 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 112.833 0.679 . . . . 3.4199999999999999 112.833 -157.507 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 1.2 mm? -57.77 -36.71 48.17 Favored Pre-proline 0 CA--C 1.534 0.341 0 C-N-CA 122.874 0.469 . . . . 2.0899999999999999 111.893 -162.294 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -45.1 -57.25 2.19 Favored 'Trans proline' 0 N--CA 1.454 -0.824 0 C-N-CA 119.767 -3.014 . . . . 1.7 108.871 -83.271 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 2.0 t-80 -55.13 -42.74 73.42 Favored 'General case' 0 N--CA 1.452 -0.345 0 C-N-CA 125.251 1.42 . . . . 2.2599999999999998 112.55 -175.907 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 35.7 tp -52.09 -47.4 65.24 Favored 'General case' 0 CA--C 1.535 0.382 0 CA-C-O 120.951 0.405 . . . . 0.95999999999999996 110.69 -169.593 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 92.6 mt -114.96 69.58 0.72 Allowed 'General case' 0 C--O 1.228 -0.067 0 C-N-CA 125.341 1.456 . . . . 1.6399999999999999 109.067 163.917 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.94 8.59 0.03 OUTLIER 'General case' 0 CA--C 1.544 0.719 0 N-CA-C 115.752 1.76 . . . . 4.9699999999999998 115.752 178.157 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 30.8 t0 -105.05 89.82 3.25 Favored 'General case' 0 N--CA 1.451 -0.414 0 N-CA-C 104.733 -2.321 . . . . 3.3300000000000001 104.733 163.669 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 19.7 m -93.52 14.81 2.04 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 CA-C-N 114.991 -1.004 . . . . 1.6599999999999999 108.944 166.814 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -83.36 -73.49 1.24 Allowed Glycine 0 N--CA 1.443 -0.892 0 N-CA-C 107.345 -2.302 . . . . 2.3199999999999998 107.345 176.791 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 55.6 m -80.06 54.33 1.9 Allowed 'General case' 0 CA--C 1.531 0.24 0 C-N-CA 124.516 1.127 . . . . 2.6400000000000001 112.076 -169.089 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.09 -40.89 87.01 Favored 'General case' 0 N--CA 1.442 -0.841 0 C-N-CA 124.811 1.245 . . . . 1.1599999999999999 109.143 179.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -29.43 -66.52 0.09 Allowed 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 127.164 2.186 . . . . 4.25 114.208 165.534 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 34.0 tt0 -47.66 -53.11 15.87 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-O 121.854 0.835 . . . . 2.8599999999999999 110.007 177.024 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -58.79 -38.28 78.19 Favored 'General case' 0 N--CA 1.44 -0.973 0 CA-C-O 118.427 -0.796 . . . . 4.3499999999999996 111.12 178.714 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.7 ttp -60.59 -45.64 93.22 Favored 'General case' 0 N--CA 1.455 -0.189 0 CA-C-N 119.881 1.218 . . . . 2.9900000000000002 109.843 178.113 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 17.6 ttmm -61.71 -42.81 99.44 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 120.56 -0.456 . . . . 4.2599999999999998 110.278 174.292 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 11.4 m -62.67 -30.47 71.41 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 122.86 0.464 . . . . 1.7 112.029 176.617 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.566 HD23 ' HB2' ' B' ' 78' ' ' ARG . 8.4 mt -76.45 -59.52 2.73 Favored 'General case' 0 N--CA 1.45 -0.469 0 C-N-CA 125.928 1.691 . . . . 1.22 109.627 -178.436 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . 0.419 ' HA ' ' HG2' ' B' ' 75' ' ' GLU 0.344 2.7 t70 -57.18 -14.42 4.11 Favored 'General case' 0 C--O 1.222 -0.391 0 N-CA-C 116.571 2.063 . . . . 2.9199999999999999 116.571 -159.233 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 28.8 m -34.61 -19.92 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.539 0.554 0 C-N-CA 130.635 3.574 . . . . 2.6899999999999999 118.951 -132.066 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -48.98 -42.78 38.87 Favored 'General case' 0 CA--C 1.538 0.519 0 CA-C-N 120.531 1.514 . . . . 3.9100000000000001 110.092 151.848 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 8.8 tt0 70.98 55.01 0.23 Allowed 'General case' 0 C--N 1.34 0.189 0 CA-C-O 122.14 0.971 . . . . 4.1799999999999997 109.23 168.727 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 16.7 p30 -87.15 -133.21 0.07 Allowed 'General case' 0 CA--C 1.547 0.836 0 N-CA-C 104.636 -2.357 . . . . 4.1699999999999999 104.636 158.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 61.8 m -146.14 29.11 1.09 Allowed 'General case' 0 CA--C 1.538 0.505 0 O-C-N 120.123 -1.611 . . . . 3.0 110.945 165.178 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 2.4 mp0 -129.94 110.78 11.95 Favored 'General case' 0 N--CA 1.448 -0.564 0 C-N-CA 127.49 2.316 . . . . 6.2800000000000002 105.646 179.184 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -74.24 108.39 7.0 Favored 'General case' 0 N--CA 1.441 -0.921 0 N-CA-C 104.421 -2.437 . . . . 1.27 104.421 177.919 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -93.12 175.11 6.9 Favored 'General case' 0 CA--C 1.535 0.369 0 C-N-CA 125.257 1.423 . . . . 3.6600000000000001 108.947 -178.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 18.9 p90 -86.9 53.05 2.69 Favored 'General case' 0 C--O 1.224 -0.281 0 O-C-N 120.434 -1.417 . . . . 5.3499999999999996 113.793 -169.169 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -157.57 51.64 0.45 Allowed 'General case' 0 CA--C 1.536 0.42 0 N-CA-C 105.325 -2.102 . . . . 2.4100000000000001 105.325 127.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . 0.419 ' HG2' ' HA ' ' B' ' 64' ' ' ASP . 0.7 OUTLIER -89.2 -63.94 1.22 Allowed 'General case' 0 N--CA 1.443 -0.776 0 N-CA-C 108.776 -0.824 . . . . 2.8199999999999998 108.776 152.624 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.406 ' CE2' ' CE1' ' B' ' 20' ' ' PHE . 0.0 OUTLIER -53.55 -35.79 61.13 Favored 'General case' 0 N--CA 1.472 0.67 0 C-N-CA 122.684 0.394 . . . . 7.8700000000000001 110.865 -170.32 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.636 ' CZ2' ' CZ2' ' A' ' 77' ' ' TRP . 67.3 t-105 -38.62 -51.72 1.64 Allowed 'General case' 0 N--CA 1.439 -1.018 0 O-C-N 124.646 1.216 . . . . 4.5800000000000001 110.744 173.612 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . 0.566 ' HB2' HD23 ' B' ' 63' ' ' LEU . 11.0 mmm180 -45.99 -48.09 16.64 Favored 'General case' 0 CA--C 1.537 0.457 0 O-C-N 121.623 -0.673 . . . . 4.2000000000000002 111.429 177.751 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.419 ' HB2' HD21 ' B' ' 63' ' ' LEU . 6.7 tp -58.03 -41.28 82.86 Favored 'General case' 0 N--CA 1.453 -0.278 0 C-N-CA 123.197 0.599 . . . . 0.87 111.104 -179.652 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 55.9 mt -64.8 -35.46 75.13 Favored 'Isoleucine or valine' 0 N--CA 1.439 -1.006 0 N-CA-C 105.945 -1.872 . . . . 1.3899999999999999 105.945 -176.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.575 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -66.09 -48.2 67.11 Favored Glycine 0 CA--C 1.494 -1.224 0 N-CA-C 110.209 -1.156 . . . . 1.47 110.209 -179.598 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 2.3 mm-40 -62.44 -61.48 2.42 Favored 'General case' 0 N--CA 1.432 -1.342 0 CA-C-O 117.89 -1.053 . . . . 2.3100000000000001 108.213 179.766 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.451 HD12 HG21 ' A' ' 13' ' ' ILE 0.262 3.8 pp -53.98 -36.22 62.68 Favored 'General case' 0 CA--C 1.538 0.485 0 CA-C-N 119.949 1.25 . . . . 1.8200000000000001 112.573 -178.408 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.41 -61.68 2.37 Favored 'General case' 0 CA--C 1.532 0.255 0 CA-C-N 119.183 0.901 . . . . 1.71 110.804 170.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 18.3 ttpp -52.92 -41.16 64.16 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 126.356 1.863 . . . . 1.5600000000000001 111.594 -175.894 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -51.08 -33.73 27.22 Favored 'General case' 0 N--CA 1.45 -0.466 0 C-N-CA 127.47 2.308 . . . . 3.75 111.463 178.578 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 7.1 tt -52.7 -40.43 34.5 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.392 0 CA-C-N 118.607 0.639 . . . . 1.05 110.226 -176.735 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 19.1 mtp85 -84.85 -61.09 1.86 Allowed 'General case' 0 CA--C 1.534 0.329 0 CA-C-O 121.431 0.634 . . . . 6.0999999999999996 110.84 164.721 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 33.5 mttp -82.66 61.2 5.64 Favored 'General case' 0 CA--C 1.53 0.186 0 C-N-CA 124.047 0.939 . . . . 5.7699999999999996 111.486 -168.643 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.9 -19.39 65.86 Favored 'General case' 0 CA--C 1.539 0.547 0 N-CA-C 112.131 0.419 . . . . 9.6500000000000004 112.131 -175.252 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -128.4 -35.63 1.96 Allowed 'General case' 0 C--O 1.238 0.467 0 C-N-CA 124.661 1.185 . . . . 8.1799999999999997 110.553 176.116 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -77.9 39.73 0.3 Allowed 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 127.659 2.384 . . . . 4.9800000000000004 111.746 -172.309 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -93.84 -111.18 0.11 Allowed 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.418 1.087 . . . . 6.4000000000000004 108.644 179.238 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 11.8 mptt 63.71 153.18 0.04 OUTLIER 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 126.984 2.114 . . . . 8.6500000000000004 111.99 -175.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -161.19 124.42 0.39 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.217 0 N-CA-C 106.345 -1.724 . . . . 8.7100000000000009 106.345 178.689 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 33.1 ptt-85 -160.79 138.2 9.25 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 108.813 -0.81 . . . . 8.2599999999999998 108.813 173.029 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 51.3 tttp -179.58 138.71 0.13 Allowed 'General case' 0 CA--C 1.531 0.218 0 C-N-CA 126.361 1.865 . . . . 6.5800000000000001 107.641 172.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 9.3 tptp . . . . . 0 C--O 1.252 1.214 0 N-CA-C 105.113 -2.18 . . . . 7.2800000000000002 105.113 155.657 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 75.3 mtm . . . . . 0 N--CA 1.473 0.682 0 N-CA-C 106.255 -1.757 . . . . 7.4500000000000002 106.255 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -174.08 174.37 2.96 Favored 'General case' 0 N--CA 1.456 -0.15 0 C-N-CA 125.321 1.448 . . . . 3.4500000000000002 107.537 -171.335 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.15 96.04 0.01 OUTLIER 'General case' 0 N--CA 1.455 -0.199 0 C-N-CA 128.532 2.733 . . . . 3.0699999999999998 110.869 175.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 4.1 pt-20 -88.35 128.92 51.41 Favored Pre-proline 0 CA--C 1.538 0.481 0 C-N-CA 124.194 0.998 . . . . 5.5700000000000003 108.885 176.735 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -76.49 158.19 36.38 Favored 'Trans proline' 0 N--CA 1.454 -0.798 0 C-N-CA 122.746 2.297 . . . . 2.5600000000000001 110.323 -178.424 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 72.3 mt -128.57 166.72 18.3 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 125.179 1.391 . . . . 1.72 107.925 179.329 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.506 HG23 ' H ' ' A' ' 10' ' ' GLU . 7.3 t -72.95 174.48 7.75 Favored 'General case' 0 CA--C 1.53 0.175 0 CA-C-N 118.588 0.631 . . . . 2.1299999999999999 110.163 -179.747 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 13.5 mt-10 -68.18 -43.76 77.42 Favored 'General case' 0 CA--C 1.515 -0.393 0 CA-C-O 122.535 1.159 . . . . 2.7400000000000002 109.211 -177.25 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 6.8 mp -61.1 -41.57 96.91 Favored 'General case' 0 N--CA 1.437 -1.093 0 CA-C-N 115.361 -0.836 . . . . 2.1600000000000001 109.962 178.571 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.506 ' H ' HG23 ' A' ' 7' ' ' THR . 78.1 mt-10 -62.53 -49.12 76.58 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 124.475 1.11 . . . . 2.52 111.299 175.241 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -57.72 -52.83 63.82 Favored 'General case' 0 C--N 1.34 0.18 0 N-CA-C 108.359 -0.978 . . . . 5.3099999999999996 108.359 -179.816 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 46.4 p -61.68 -40.62 95.6 Favored 'General case' 0 N--CA 1.454 -0.267 0 CA-C-N 116.575 -0.284 . . . . 1.4099999999999999 110.913 -170.317 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.28 2.8 pp -67.1 -39.66 83.69 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.256 0 O-C-N 121.78 -0.575 . . . . 0.60999999999999999 110.209 177.974 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 25.7 tt0 -60.89 -51.65 68.4 Favored 'General case' 0 CA--C 1.536 0.427 0 CA-C-N 118.867 0.758 . . . . 3.6899999999999999 110.018 174.513 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 17.5 m -44.09 -47.4 8.89 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 126.697 1.999 . . . . 2.1200000000000001 112.354 175.625 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 30.4 m -76.33 -35.03 26.43 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.42 0 O-C-N 120.348 -1.47 . . . . 0.65000000000000002 111.568 177.695 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 44.6 t -59.97 -42.79 90.73 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.44 0 CA-C-N 119.484 1.038 . . . . 0.72999999999999998 111.148 174.562 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.2 t -61.64 -49.07 78.02 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 120.812 -1.18 . . . . 0.70999999999999996 109.532 175.201 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.1 m -52.51 -43.4 65.07 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-N 118.473 0.578 . . . . 0.68999999999999995 110.613 176.269 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.482 ' HA ' ' CZ ' ' A' ' 23' ' ' PHE . 41.5 t80 -48.43 -57.08 6.61 Favored 'General case' 0 CA--C 1.518 -0.273 0 C-N-CA 123.683 0.793 . . . . 3.3700000000000001 110.548 174.767 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -59.56 -41.78 90.93 Favored 'General case' 0 N--CA 1.451 -0.382 0 C-N-CA 119.724 -0.79 . . . . 3.3900000000000001 111.388 177.468 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 2.9 m -53.33 -43.86 67.97 Favored 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 112.576 0.584 . . . . 2.6099999999999999 112.576 177.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . 0.482 ' CZ ' ' HA ' ' A' ' 20' ' ' PHE . 22.8 p90 -81.58 -43.49 18.59 Favored 'General case' 0 C--O 1.222 -0.384 0 CA-C-N 119.324 0.965 . . . . 6.6200000000000001 113.201 176.158 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -63.16 -20.73 65.66 Favored 'General case' 0 C--O 1.237 0.416 0 C-N-CA 125.806 1.642 . . . . 1.27 112.16 -169.617 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -68.18 -17.86 64.45 Favored 'General case' 0 N--CA 1.454 -0.26 0 CA-C-O 117.571 -1.205 . . . . 4.9199999999999999 113.622 172.571 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -50.99 -58.18 6.71 Favored 'General case' 0 C--N 1.344 0.331 0 CA-C-N 119.925 1.239 . . . . 2.7599999999999998 112.512 -172.308 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 42.0 mt-10 -121.6 171.12 9.06 Favored 'General case' 0 N--CA 1.449 -0.498 0 C-N-CA 126.286 1.834 . . . . 2.54 107.285 -179.371 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -1.59 106.57 0.01 OUTLIER Glycine 0 CA--C 1.53 0.995 0 C-N-CA 127.443 2.449 . . . . 1.6499999999999999 114.268 170.973 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . 0.278 30.5 mtt85 66.11 109.45 0.04 OUTLIER 'General case' 0 C--O 1.239 0.544 0 N-CA-C 114.732 1.382 . . . . 5.1100000000000003 114.732 167.244 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 1.9 ptpt -62.22 59.95 0.01 OUTLIER 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 123.936 0.894 . . . . 5.4699999999999998 112.051 163.28 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 11.1 t0 -165.38 -57.82 0.03 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 127.048 2.139 . . . . 3.2599999999999998 106.725 -171.587 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 3.8 p -84.92 122.75 29.64 Favored 'General case' 0 N--CA 1.447 -0.616 0 C-N-CA 125.079 1.352 . . . . 2.3700000000000001 109.382 177.137 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.0 mm? -90.83 156.59 17.92 Favored 'General case' 0 CA--C 1.532 0.266 0 N-CA-C 107.715 -1.217 . . . . 2.1400000000000001 107.715 160.312 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 8.7 t -152.42 177.91 10.1 Favored 'General case' 0 CA--C 1.53 0.175 0 C-N-CA 123.912 0.885 . . . . 3.6699999999999999 108.784 172.021 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -39.93 -64.74 0.11 Allowed 'Isoleucine or valine' 0 N--CA 1.465 0.313 0 C-N-CA 125.487 1.515 . . . . 2.98 112.955 -168.474 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 6.6 t30 -60.49 -60.19 4.2 Favored 'General case' 0 CA--C 1.53 0.196 0 CA-C-N 118.195 0.452 . . . . 2.1000000000000001 110.416 -175.767 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.2 tt0 -38.77 -52.28 1.71 Allowed 'General case' 0 CA--C 1.53 0.178 0 C-N-CA 125.601 1.56 . . . . 1.8400000000000001 112.296 175.472 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -63.99 -51.74 62.86 Favored 'General case' 0 N--CA 1.445 -0.686 0 CA-C-N 114.803 -1.09 . . . . 2.5899999999999999 108.726 -179.416 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.426 ' HE2' ' HB3' ' A' ' 56' ' ' LEU . 32.2 ttmt -52.56 -44.95 66.2 Favored 'General case' 0 N--CA 1.455 -0.182 0 C-N-CA 122.898 0.479 . . . . 3.5800000000000001 111.185 178.017 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 55.9 mt-10 -54.26 -41.44 68.79 Favored 'General case' 0 CA--C 1.531 0.213 0 CA-C-N 118.626 0.648 . . . . 2.23 111.448 175.416 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . 0.441 HD13 ' CD2' ' A' ' 23' ' ' PHE . 45.4 tp -64.67 -49.73 69.8 Favored 'General case' 0 CA--C 1.52 -0.204 0 N-CA-C 108.632 -0.877 . . . . 2.6099999999999999 108.632 -176.445 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 4.8 m -65.8 -52.88 44.61 Favored 'Isoleucine or valine' 0 N--CA 1.451 -0.398 0 N-CA-C 108.528 -0.915 . . . . 1.0 108.528 -174.661 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 96.5 m -52.18 -53.18 46.34 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 124.936 1.294 . . . . 1.6799999999999999 111.511 178.669 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 5.6 tt0 -75.62 -53.37 8.69 Favored 'General case' 0 N--CA 1.451 -0.378 0 C-N-CA 122.42 0.288 . . . . 2.7000000000000002 110.285 -171.545 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 2.8 mp0 -85.4 -33.66 21.91 Favored 'General case' 0 CA--C 1.531 0.228 0 CA-C-O 117.717 -1.135 . . . . 4.6399999999999997 112.446 -169.789 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 37.0 mt -103.17 98.3 11.63 Favored Pre-proline 0 CA--C 1.538 0.494 0 CA-C-N 120.368 1.44 . . . . 2.8700000000000001 111.633 -171.914 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 65.7 Cg_endo -71.38 -39.15 3.97 Favored 'Trans proline' 0 N--CA 1.456 -0.72 0 C-N-CA 121.911 1.741 . . . . 1.8100000000000001 111.918 -178.025 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 0.2 OUTLIER -141.81 -12.29 0.87 Allowed 'General case' 0 CA--C 1.536 0.418 0 N-CA-C 114.477 1.288 . . . . 4.8899999999999997 114.477 -170.8 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.48 HD21 ' HG ' ' A' ' 83' ' ' LEU . 28.0 tp -66.32 -68.79 0.34 Allowed 'General case' 0 CA--C 1.532 0.266 0 CA-C-N 119.032 0.833 . . . . 1.3300000000000001 110.728 -171.353 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 36.9 mt -93.01 100.39 12.83 Favored 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 106.252 -1.759 . . . . 2.3100000000000001 106.252 163.63 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 62.4 mttt -69.12 174.99 4.08 Favored 'General case' 0 N--CA 1.451 -0.392 0 C-N-CA 120.213 -0.595 . . . . 5.4900000000000002 109.962 165.405 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 25.4 t0 59.49 50.48 7.46 Favored 'General case' 0 N--CA 1.446 -0.649 0 CA-C-O 124.593 2.14 . . . . 4.1299999999999999 108.963 177.913 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 7.7 m -58.47 -35.69 55.57 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.66 0 CA-C-N 112.338 -2.21 . . . . 1.99 108.414 161.551 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -40.75 -61.69 1.84 Allowed Glycine 0 C--N 1.342 0.91 0 C-N-CA 125.937 1.732 . . . . 1.54 111.783 174.519 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 52.5 m -103.76 43.49 1.08 Allowed 'General case' 0 C--O 1.235 0.314 0 C-N-CA 123.755 0.822 . . . . 2.4399999999999999 111.602 177.397 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.426 ' HB3' ' HE2' ' A' ' 39' ' ' LYS . 0.9 OUTLIER -41.05 -43.74 2.25 Favored 'General case' 0 C--O 1.223 -0.313 0 C-N-CA 124.252 1.021 . . . . 1.8200000000000001 109.608 162.611 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -39.41 -41.49 0.96 Allowed 'General case' 0 CA--C 1.537 0.455 0 C-N-CA 127.88 2.472 . . . . 3.7200000000000002 112.231 179.083 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 19.6 tp10 -62.09 -54.36 42.43 Favored 'General case' 0 N--CA 1.453 -0.321 0 O-C-N 121.686 -0.633 . . . . 5.0599999999999996 110.561 175.955 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -53.95 -50.33 66.72 Favored 'General case' 0 C--O 1.222 -0.365 0 N-CA-C 108.304 -0.999 . . . . 2.8700000000000001 108.304 176.54 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -47.29 -58.16 4.43 Favored 'General case' 0 N--CA 1.454 -0.232 0 C-N-CA 126.064 1.745 . . . . 2.29 110.188 -176.766 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -57.53 -35.16 69.93 Favored 'General case' 0 CA--C 1.535 0.378 0 CA-C-N 116.514 -0.312 . . . . 4.7999999999999998 111.58 -179.49 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 9.4 t -73.17 -46.81 48.64 Favored 'General case' 0 CA--C 1.537 0.477 0 C-N-CA 123.864 0.866 . . . . 2.3799999999999999 111.468 -178.528 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 4.5 mp -59.26 -48.37 81.87 Favored 'General case' 0 C--O 1.232 0.173 0 O-C-N 121.843 -0.536 . . . . 2.0699999999999998 109.629 176.584 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 50.6 t0 -71.21 83.41 0.74 Allowed 'General case' 0 N--CA 1.449 -0.488 0 CA-C-O 120.802 0.334 . . . . 1.8600000000000001 110.786 -171.549 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 34.3 m -45.97 -41.32 3.88 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.404 0 C-N-CA 125.761 1.624 . . . . 2.6000000000000001 113.941 -173.547 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 10.0 p30 -96.19 -9.06 31.41 Favored 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 124.26 1.024 . . . . 2.6400000000000001 111.845 -179.869 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 4.6 tt0 53.02 35.34 19.2 Favored 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 125.356 1.462 . . . . 3.9199999999999999 111.67 177.206 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 57.6 p30 -65.96 -16.64 64.05 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 124.277 1.031 . . . . 1.96 110.765 170.903 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.8 m 83.73 11.3 0.43 Allowed 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 127.616 2.366 . . . . 2.5499999999999998 112.472 -179.064 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 62.9 mt-10 -111.06 132.34 54.32 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 106.884 -1.524 . . . . 3.0499999999999998 106.884 164.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -95.68 102.46 14.26 Favored 'General case' 0 C--N 1.326 -0.447 0 N-CA-C 104.563 -2.384 . . . . 1.3799999999999999 104.563 163.042 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -100.12 171.36 7.86 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 118.96 0.8 . . . . 3.4399999999999999 109.88 170.929 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 64.6 m-85 -38.68 -60.33 0.84 Allowed 'General case' 0 N--CA 1.467 0.408 0 N-CA-C 115.267 1.581 . . . . 4.8600000000000003 115.267 -155.033 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.2 t30 -70.01 -26.95 64.31 Favored 'General case' 0 CA--C 1.535 0.397 0 CA-C-N 118.567 0.621 . . . . 1.8300000000000001 112.09 -174.876 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 34.0 mt-10 -73.14 -57.53 3.96 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 107.746 -1.205 . . . . 2.2599999999999998 107.746 176.24 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 71.1 t80 -50.88 -42.52 59.15 Favored 'General case' 0 CA--C 1.518 -0.252 0 C-N-CA 124.18 0.992 . . . . 3.2999999999999998 110.827 177.423 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.433 ' C ' ' CD1' ' A' ' 77' ' ' TRP . 3.1 t90 -40.03 -44.79 1.81 Allowed 'General case' 0 CA--C 1.538 0.509 0 O-C-N 124.131 0.894 . . . . 5.25 109.815 -179.889 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 83.4 mtt-85 -43.58 -33.96 1.29 Allowed 'General case' 0 C--O 1.226 -0.169 0 N-CA-C 113.227 0.825 . . . . 4.5700000000000003 113.227 -178.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 18.3 tp -51.92 -49.62 62.71 Favored 'General case' 0 C--O 1.218 -0.596 0 CA-C-O 117.616 -1.183 . . . . 0.98999999999999999 111.388 174.767 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.4 mt -71.31 -36.5 61.83 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.332 0 C-N-CA 124.96 1.304 . . . . 2.23 108.826 179.059 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.431 ' HA2' ' CE2' ' B' ' 77' ' ' TRP . . . -39.22 -56.78 2.24 Favored Glycine 0 C--N 1.344 1.02 0 C-N-CA 126.01 1.767 . . . . 1.74 111.214 170.057 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 5.7 mm-40 -74.17 -52.86 11.19 Favored 'General case' 0 N--CA 1.433 -1.311 0 CA-C-N 110.723 -2.738 . . . . 2.7200000000000002 109.344 179.386 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.48 ' HG ' HD21 ' A' ' 49' ' ' LEU . 2.6 tp -39.25 -56.12 1.57 Allowed 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 126.024 1.729 . . . . 2.9500000000000002 112.517 -172.934 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -59.65 -33.24 71.28 Favored 'General case' 0 N--CA 1.464 0.26 0 C-N-CA 123.129 0.571 . . . . 1.3400000000000001 112.504 179.003 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.505 ' CE ' ' HB2' ' B' ' 74' ' ' ASN . 0.7 OUTLIER -73.36 -44.86 57.87 Favored 'General case' 0 CA--C 1.538 0.503 0 C-N-CA 124.868 1.267 . . . . 2.0800000000000001 110.451 173.782 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -67.42 -16.16 64.08 Favored 'General case' 0 C--O 1.232 0.146 0 C-N-CA 125.173 1.389 . . . . 3.2799999999999998 113.089 -174.021 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 5.3 tt -58.94 -36.73 63.23 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 O-C-N 121.435 -0.79 . . . . 1.4399999999999999 111.076 165.73 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -99.97 -52.68 3.36 Favored 'General case' 0 CA--C 1.529 0.151 0 C-N-CA 126.72 2.008 . . . . 4.5 109.678 -170.404 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.9 tttm -69.58 62.49 0.17 Allowed 'General case' 0 CA--C 1.53 0.211 0 C-N-CA 125.908 1.683 . . . . 3.7599999999999998 106.962 163.541 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.23 -40.57 90.37 Favored 'General case' 0 N--CA 1.453 -0.322 0 O-C-N 121.493 -0.755 . . . . 7.1500000000000004 110.748 -167.701 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 9.9 tptp -170.57 -38.01 0.02 OUTLIER 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 127.686 2.394 . . . . 8.6099999999999994 107.622 166.07 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 5.0 t70 37.75 83.9 0.02 OUTLIER 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 127.624 2.37 . . . . 6.6399999999999997 113.548 -176.568 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.1 tp -172.18 -57.55 0.02 OUTLIER 'General case' 0 N--CA 1.447 -0.591 0 N-CA-C 103.792 -2.67 . . . . 9.1199999999999992 103.792 173.579 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -86.08 -169.33 2.59 Favored 'General case' 0 CA--C 1.537 0.466 0 N-CA-C 108.06 -1.089 . . . . 11.1 108.06 160.502 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 1.7 pp -71.93 -170.69 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 C-N-CA 125.327 1.451 . . . . 9.8599999999999994 112.478 -175.61 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 4.8 mmm180 67.44 104.75 0.05 OUTLIER 'General case' 0 C--N 1.342 0.282 0 C-N-CA 126.494 1.918 . . . . 13.98 107.913 -154.542 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 40.1 mttm -176.83 90.46 0.03 OUTLIER 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 130.045 3.338 . . . . 11.94 104.686 -161.898 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.674 ' H ' ' HA ' ' B' ' 1' ' ' MET . 0.1 OUTLIER . . . . . 0 C--O 1.255 1.354 0 N-CA-C 100.996 -3.705 . . . . 9.8300000000000001 100.996 -115.565 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . 0.674 ' HA ' ' H ' ' A' ' 98' ' ' LYS . 1.4 mpt? . . . . . 0 N--CA 1.471 0.615 0 CA-C-O 114.888 -2.482 . . . . 5.8600000000000003 106.28 . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . 136.02 163.13 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.43 0 C-N-CA 127.67 2.388 . . . . 5.1299999999999999 110.918 -177.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 90.06 90.83 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.237 0 C-N-CA 126.264 1.826 . . . . 4.4800000000000004 114.404 153.417 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 62.8 mt-10 -128.45 146.77 61.2 Favored Pre-proline 0 CA--C 1.537 0.456 0 N-CA-C 104.116 -2.55 . . . . 6.1299999999999999 104.116 149.636 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 67.5 Cg_endo -82.21 142.57 12.17 Favored 'Trans proline' 0 CA--C 1.535 0.543 0 C-N-CA 123.821 3.014 . . . . 3.5 108.414 167.084 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . 0.573 HD12 ' HG3' ' B' ' 10' ' ' GLU . 25.6 mt -144.5 -123.63 0.08 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.597 0.759 . . . . 3.7999999999999998 111.234 -158.884 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 9.3 t -95.78 163.75 13.04 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 125.173 1.389 . . . . 2.23 110.457 -176.016 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -48.07 -55.73 9.49 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.568 1.147 . . . . 2.1600000000000001 112.471 -171.701 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 11.4 mt -58.53 -38.23 77.32 Favored 'General case' 0 CA--C 1.533 0.321 0 CA-C-N 116.419 -0.355 . . . . 1.03 111.358 -179.907 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.573 ' HG3' HD12 ' B' ' 6' ' ' LEU . 1.4 tm-20 -59.92 -60.18 4.24 Favored 'General case' 0 N--CA 1.439 -0.98 0 CA-C-O 119.056 -0.497 . . . . 5.71 110.474 169.169 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -45.23 -42.16 9.11 Favored 'General case' 0 CA--C 1.546 0.801 0 CA-C-N 119.752 1.16 . . . . 4.2599999999999998 110.645 -176.75 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 22.3 p -64.01 -31.64 72.89 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 115.12 1.526 . . . . 1.3999999999999999 115.12 177.082 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 12.6 pt -76.04 -41.28 38.2 Favored 'Isoleucine or valine' 0 C--N 1.344 0.366 0 CA-C-N 121.95 2.159 . . . . 1.4399999999999999 109.955 164.107 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -47.11 -56.11 7.16 Favored 'General case' 0 CA--C 1.535 0.368 0 CA-C-N 121.045 1.748 . . . . 2.8799999999999999 109.981 -174.004 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 15.3 t -48.22 -43.37 32.06 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-O 122.485 1.136 . . . . 1.29 111.733 178.234 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . 0.464 HG13 ' CE2' ' B' ' 20' ' ' PHE . 0.5 OUTLIER -72.99 -38.31 55.65 Favored 'Isoleucine or valine' 0 N--CA 1.446 -0.633 0 C-N-CA 124.271 1.028 . . . . 1.53 110.126 -177.923 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 69.2 t -61.92 -50.61 79.42 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.312 0 C-N-CA 123.831 0.852 . . . . 1.29 109.303 175.455 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 11.1 t -61.59 -43.67 98.43 Favored 'General case' 0 CA--C 1.537 0.465 0 CA-C-N 118.839 0.745 . . . . 1.46 110.665 178.486 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 98.7 m -47.95 -58.16 4.77 Favored 'General case' 0 C--N 1.346 0.449 0 CA-C-N 118.595 0.634 . . . . 1.4399999999999999 109.482 170.354 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . 0.464 ' CE2' HG13 ' B' ' 16' ' ' VAL . 16.8 m-30 -55.02 -44.64 74.79 Favored 'General case' 0 C--O 1.223 -0.34 0 N-CA-C 112.786 0.662 . . . . 6.3099999999999996 112.786 178.514 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 3.3 m-85 -60.26 -53.54 56.4 Favored 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 119.716 1.144 . . . . 4.4199999999999999 110.12 -176.815 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 6.7 t -65.87 -40.74 91.92 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 119.52 -0.872 . . . . 3.5 110.08 -179.439 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 3.7 t80 -62.8 -61.73 2.21 Favored 'General case' 0 N--CA 1.455 -0.213 0 O-C-N 121.517 -0.74 . . . . 5.25 111.55 -179.754 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -64.14 -19.72 65.48 Favored 'General case' 0 N--CA 1.447 -0.604 0 C-N-CA 125.808 1.643 . . . . 1.0 111.951 -172.409 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.07 -26.86 11.99 Favored 'General case' 0 N--CA 1.455 -0.207 0 CA-C-O 118.431 -0.795 . . . . 4.1699999999999999 111.167 169.192 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -39.28 -69.05 0.14 Allowed 'General case' 0 N--CA 1.451 -0.385 0 N-CA-C 115.994 1.85 . . . . 1.8600000000000001 115.994 -156.742 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 59.5 mt-10 -92.14 -77.7 0.43 Allowed 'General case' 0 C--N 1.341 0.206 0 C-N-CA 118.889 -1.125 . . . . 2.8500000000000001 112.688 -171.289 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.04 161.16 25.39 Favored Glycine 0 N--CA 1.446 -0.673 0 C-N-CA 127.929 2.68 . . . . 1.72 110.614 152.959 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 6.0 ttm180 55.96 102.34 0.01 OUTLIER 'General case' 0 C--O 1.24 0.601 0 N-CA-C 115.116 1.525 . . . . 4.1699999999999999 115.116 135.719 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.47 6.6 5.49 Favored 'General case' 0 N--CA 1.451 -0.383 0 N-CA-C 115.135 1.531 . . . . 6.5800000000000001 115.135 -174.256 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 59.7 m-20 -123.77 11.44 9.07 Favored 'General case' 0 N--CA 1.464 0.269 0 CA-C-N 119.231 0.923 . . . . 4.0800000000000001 110.961 178.957 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 29.0 p -142.57 142.4 32.17 Favored 'General case' 0 C--O 1.242 0.674 0 N-CA-C 109.321 -0.622 . . . . 1.5700000000000001 109.321 172.87 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.7 mm? -101.29 154.18 19.0 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 108.303 -0.999 . . . . 2.2400000000000002 108.303 167.361 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 68.6 m -136.46 168.72 18.93 Favored 'General case' 0 C--N 1.328 -0.34 0 N-CA-C 107.003 -1.48 . . . . 2.4100000000000001 107.003 173.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 10.8 p -84.04 53.9 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.531 0.228 0 CA-C-O 121.725 0.774 . . . . 2.7999999999999998 111.202 -172.454 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 38.2 t30 -157.21 51.08 0.47 Allowed 'General case' 0 N--CA 1.453 -0.315 0 N-CA-C 105.881 -1.896 . . . . 3.0699999999999998 105.881 150.038 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 2.6 tt0 -168.41 -62.41 0.02 OUTLIER 'General case' 0 N--CA 1.45 -0.442 0 N-CA-C 104.583 -2.377 . . . . 2.0800000000000001 104.583 -166.897 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -48.61 -49.19 38.0 Favored 'General case' 0 CA--C 1.534 0.328 0 C-N-CA 123.689 0.796 . . . . 2.71 111.036 178.32 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 31.3 tttt -57.44 -29.27 64.05 Favored 'General case' 0 CA--C 1.533 0.32 0 C-N-CA 123.081 0.552 . . . . 2.6499999999999999 111.586 -177.992 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 21.7 mm-40 -70.17 -25.6 63.52 Favored 'General case' 0 N--CA 1.442 -0.836 0 O-C-N 121.535 -0.728 . . . . 4.5899999999999999 110.587 -174.696 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 14.8 tp -70.16 -43.2 71.34 Favored 'General case' 0 C--N 1.34 0.191 0 CA-C-N 119.015 0.825 . . . . 1.95 109.716 178.016 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 6.0 m -69.89 -41.27 79.57 Favored 'Isoleucine or valine' 0 C--N 1.339 0.147 0 N-CA-C 109.099 -0.704 . . . . 0.64000000000000001 109.099 -178.501 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 87.6 m -67.42 -60.78 2.3 Favored 'General case' 0 N--CA 1.447 -0.596 0 CA-C-N 116.029 -0.532 . . . . 0.81000000000000005 111.071 -178.782 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -82.82 -62.81 1.5 Allowed 'General case' 0 CA--C 1.532 0.252 0 C-N-CA 122.839 0.456 . . . . 2.1099999999999999 111.897 -170.821 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 10.7 mp0 -70.61 -48.2 56.32 Favored 'General case' 0 CA--C 1.528 0.096 0 O-C-N 122.16 -0.338 . . . . 3.8900000000000001 111.782 -169.651 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 3.7 tp -71.58 -19.89 0.44 Allowed Pre-proline 0 CA--C 1.536 0.429 0 N-CA-C 114.666 1.358 . . . . 1.8600000000000001 114.666 -161.627 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -34.42 -65.92 0.11 Allowed 'Trans proline' 0 CA--C 1.538 0.69 0 C-N-CA 121.895 1.73 . . . . 2.0099999999999998 114.806 -110.593 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 58.0 t-80 -73.65 -59.6 2.64 Favored 'General case' 0 CA--C 1.53 0.21 0 N-CA-C 113.358 0.873 . . . . 2.3799999999999999 113.358 -158.544 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.673 ' HG ' HD23 ' B' ' 50' ' ' LEU . 29.5 tp 0.53 -85.04 0.0 OUTLIER 'General case' 0 CA--C 1.537 0.464 0 C-N-CA 127.949 2.499 . . . . 1.4299999999999999 115.613 176.238 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.673 HD23 ' HG ' ' B' ' 49' ' ' LEU . 0.4 OUTLIER -125.88 64.52 1.21 Allowed 'General case' 0 CA--C 1.522 -0.122 0 N-CA-C 108.05 -1.092 . . . . 2.6499999999999999 108.05 166.82 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -49.28 123.31 7.22 Favored 'General case' 0 N--CA 1.449 -0.499 0 N-CA-C 108.573 -0.899 . . . . 6.3300000000000001 108.573 166.995 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.405 ' OD2' ' NZ ' ' B' ' 91' ' ' LYS . 60.6 t0 -165.96 51.43 0.09 Allowed 'General case' 0 C--N 1.324 -0.501 0 N-CA-C 105.999 -1.852 . . . . 5.1299999999999999 105.999 -169.02 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 34.4 m -88.5 -12.25 10.28 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.243 0 CA-C-N 113.698 -1.592 . . . . 2.3700000000000001 111.102 -173.679 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -71.42 -77.19 0.53 Allowed Glycine 0 C--N 1.338 0.669 0 N-CA-C 107.416 -2.274 . . . . 2.6800000000000002 107.416 165.654 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.1 43.72 0.37 Allowed 'General case' 0 CA--C 1.536 0.404 0 C-N-CA 125.863 1.665 . . . . 3.2200000000000002 112.65 -177.765 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.4 tm? -67.82 -28.48 67.61 Favored 'General case' 0 N--CA 1.435 -1.212 0 N-CA-C 108.549 -0.908 . . . . 1.1699999999999999 108.549 169.18 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -58.9 -53.17 61.42 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.097 0.862 . . . . 4.4800000000000004 110.044 173.521 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 46.6 tt0 -47.22 -56.06 7.41 Favored 'General case' 0 C--N 1.342 0.259 0 C-N-CA 124.003 0.921 . . . . 2.48 109.508 173.002 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.3 mmpt? -56.61 -61.46 2.4 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 120.812 -0.355 . . . . 4.6500000000000004 110.193 -176.999 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -45.03 -55.25 5.74 Favored 'General case' 0 C--O 1.222 -0.352 0 C-N-CA 125.242 1.417 . . . . 1.6100000000000001 110.271 179.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 12.8 ttpt -60.98 -41.1 95.79 Favored 'General case' 0 C--N 1.327 -0.378 0 C-N-CA 125.168 1.387 . . . . 3.5 110.528 -177.178 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 50.5 m -64.96 -31.7 73.07 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 123.017 0.527 . . . . 1.8500000000000001 111.82 175.43 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 5.8 mp -74.42 -52.83 10.94 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 118.809 0.731 . . . . 1.54 111.133 173.357 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.256 19.8 t0 -57.88 -8.62 1.02 Allowed 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 128.969 2.907 . . . . 1.6599999999999999 117.635 -164.451 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 8.8 m -33.6 -18.62 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.468 0.472 1 C-N-CA 132.776 4.431 . . . . 1.3999999999999999 119.344 -139.8 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -52.6 -37.75 58.74 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 120.145 1.339 . . . . 2.7200000000000002 109.616 158.114 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 12.9 tt0 67.44 68.12 0.38 Allowed 'General case' 0 CA--C 1.533 0.289 0 C-N-CA 126.744 2.018 . . . . 3.2999999999999998 108.95 -171.87 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 28.4 p30 -128.03 -10.47 5.38 Favored 'General case' 0 CA--C 1.541 0.619 0 C-N-CA 126.373 1.869 . . . . 1.8899999999999999 113.494 -172.652 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 17.9 m 72.14 4.04 4.88 Favored 'General case' 0 CA--C 1.538 0.518 0 C-N-CA 125.311 1.444 . . . . 1.8600000000000001 114.589 -178.578 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . 0.407 ' OE1' ' NZ ' ' B' ' 72' ' ' LYS . 1.8 mt-10 -99.12 103.35 15.25 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 106.321 -1.733 . . . . 3.79 106.321 156.245 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.26 94.43 1.19 Allowed 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 104.331 -2.47 . . . . 1.1699999999999999 104.331 158.975 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . 0.407 ' NZ ' ' OE1' ' B' ' 70' ' ' GLU . 20.6 ttmm -81.78 172.48 13.31 Favored 'General case' 0 CA--C 1.535 0.366 0 C-N-CA 123.973 0.909 . . . . 3.27 110.429 -170.272 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 0.4 OUTLIER -87.83 56.06 3.73 Favored 'General case' 0 CA--C 1.542 0.667 0 O-C-N 121.0 -1.063 . . . . 4.6100000000000003 111.257 177.178 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . 0.505 ' HB2' ' CE ' ' A' ' 85' ' ' LYS . 0.5 OUTLIER -161.35 55.72 0.28 Allowed 'General case' 0 CA--C 1.534 0.365 0 N-CA-C 107.32 -1.363 . . . . 2.5699999999999998 107.32 100.263 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 32.3 mt-10 -90.9 -60.97 1.77 Allowed 'General case' 0 N--CA 1.444 -0.769 0 C-N-CA 124.741 1.216 . . . . 2.0899999999999999 108.808 139.562 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 1.4 p90 -56.77 -37.05 70.55 Favored 'General case' 0 C--N 1.342 0.24 0 C-N-CA 124.09 0.956 . . . . 5.7699999999999996 112.177 -161.95 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.566 ' CD1' ' C ' ' B' ' 77' ' ' TRP . 1.6 t-105 -45.46 -39.74 7.52 Favored 'General case' 0 C--O 1.219 -0.512 0 O-C-N 123.565 0.541 . . . . 5.5 109.987 175.727 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 21.3 mtt180 -39.62 -48.46 2.1 Favored 'General case' 0 N--CA 1.468 0.467 0 O-C-N 120.965 -1.084 . . . . 4.2800000000000002 112.038 -169.105 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 13.1 tp -49.53 -46.71 48.88 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 123.421 0.688 . . . . 1.02 111.244 177.445 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 8.5 mm -58.37 -42.25 83.5 Favored 'Isoleucine or valine' 0 CA--C 1.522 -0.103 0 C-N-CA 127.284 2.233 . . . . 2.7999999999999998 108.169 -178.824 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -64.5 -51.18 54.5 Favored Glycine 0 N--CA 1.441 -1.019 0 N-CA-C 109.971 -1.252 . . . . 1.5800000000000001 109.971 178.166 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.6 mt-10 -50.89 -47.47 60.59 Favored 'General case' 0 N--CA 1.446 -0.626 0 CA-C-O 118.235 -0.888 . . . . 2.1699999999999999 110.712 178.166 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.434 HD23 HD21 ' B' ' 50' ' ' LEU . 22.1 mt -39.14 -54.5 1.75 Allowed 'General case' 0 CA--C 1.54 0.57 0 CA-C-N 119.598 1.09 . . . . 1.9399999999999999 113.214 -178.25 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -62.78 -26.25 68.62 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 124.917 1.287 . . . . 1.3200000000000001 112.143 -176.55 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 23.5 ttpp -80.72 -53.42 6.53 Favored 'General case' 0 N--CA 1.449 -0.489 0 C-N-CA 124.131 0.973 . . . . 1.96 109.526 171.648 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . 0.451 ' CG ' HD22 ' B' ' 50' ' ' LEU . 4.2 mm-40 -57.6 -40.42 79.03 Favored 'General case' 0 N--CA 1.453 -0.322 0 C-N-CA 123.993 0.917 . . . . 2.5499999999999998 111.718 -171.113 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 10.8 tt -50.01 -36.68 12.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 CA-C-N 118.568 0.622 . . . . 1.03 111.885 174.758 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -81.15 -49.11 11.23 Favored 'General case' 0 CA--C 1.535 0.397 0 C-N-CA 123.518 0.727 . . . . 5.3600000000000003 109.726 174.774 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 32.2 mttm -106.38 116.35 31.77 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.886 1.674 . . . . 5.1399999999999997 112.144 -166.16 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 22.6 pttp -38.39 -13.37 0.01 OUTLIER 'General case' 0 CA--C 1.55 0.971 0 C-N-CA 130.291 3.436 . . . . 6.3600000000000003 119.157 174.14 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . 0.405 ' NZ ' ' OD2' ' B' ' 52' ' ' ASP . 7.4 tppt? 114.16 26.99 0.0 OUTLIER 'General case' 0 N--CA 1.472 0.67 1 C-N-CA 132.064 4.145 . . . . 9.2799999999999994 107.514 -158.226 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 29.3 t70 -82.05 64.15 6.6 Favored 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 125.644 1.578 . . . . 3.9500000000000002 109.598 -176.672 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -137.48 -116.75 0.16 Allowed 'General case' 0 CA--C 1.534 0.339 0 C-N-CA 123.956 0.902 . . . . 4.8499999999999996 110.939 -179.969 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 73.6 mmtt 59.48 -164.95 0.2 Allowed 'General case' 0 CA--C 1.544 0.735 0 C-N-CA 124.952 1.301 . . . . 7.7199999999999998 110.261 -168.494 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . 0.254 0.2 OUTLIER 36.93 90.59 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.543 0.693 0 C-N-CA 127.734 2.414 . . . . 8.0 115.04 -179.929 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.8 107.96 3.75 Favored 'General case' 0 CA--C 1.53 0.204 0 O-C-N 120.946 -1.097 . . . . 11.43 109.471 166.381 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 56.7 tttp -175.71 137.26 0.34 Allowed 'General case' 0 N--CA 1.456 -0.131 0 N-CA-C 104.794 -2.298 . . . . 6.4000000000000004 104.794 -169.375 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--O 1.252 1.232 0 N-CA-C 105.97 -1.863 . . . . 10.23 105.97 -155.18 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.2 mtt . . . . . 0 N--CA 1.472 0.64 0 N-CA-C 105.854 -1.906 . . . . 6.6399999999999997 105.854 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -65.06 176.49 1.25 Allowed 'General case' 0 C--O 1.232 0.183 0 CA-C-N 118.9 0.773 . . . . 3.0499999999999998 110.174 162.957 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.84 98.73 0.01 OUTLIER 'General case' 0 N--CA 1.454 -0.25 0 C-N-CA 128.963 2.905 . . . . 3.2400000000000002 109.171 -171.849 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 2.7 pt-20 -96.04 115.57 65.65 Favored Pre-proline 0 N--CA 1.451 -0.391 0 C-N-CA 124.996 1.318 . . . . 4.8200000000000003 109.093 -174.234 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 98.6 Cg_endo -70.54 146.94 56.72 Favored 'Trans proline' 0 N--CA 1.451 -0.98 0 C-N-CA 121.859 1.706 . . . . 2.73 108.385 175.373 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 51.9 mt -101.15 173.14 6.6 Favored 'General case' 0 CA--C 1.536 0.419 0 N-CA-C 108.256 -1.016 . . . . 1.4399999999999999 108.256 -176.178 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . 0.605 HG22 ' OE1' ' A' ' 10' ' ' GLU . 8.9 t -71.14 161.47 31.05 Favored 'General case' 0 CA--C 1.535 0.39 0 O-C-N 120.573 -1.329 . . . . 2.5099999999999998 110.001 178.548 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 14.7 mt-10 -48.34 -43.77 33.72 Favored 'General case' 0 CA--C 1.521 -0.144 0 C-N-CA 124.072 0.949 . . . . 2.6099999999999999 111.382 -179.998 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.424 ' H ' HD12 ' A' ' 9' ' ' LEU . 5.6 mp -63.29 -54.46 36.84 Favored 'General case' 0 N--CA 1.443 -0.81 0 N-CA-C 109.308 -0.627 . . . . 1.96 109.308 -177.265 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . 0.605 ' OE1' HG22 ' A' ' 7' ' ' THR . 81.6 mt-10 -49.64 -57.71 6.67 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 125.586 1.554 . . . . 2.7000000000000002 110.898 174.975 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 71.8 mm-40 -49.93 -51.13 43.36 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 123.889 0.876 . . . . 3.5899999999999999 109.94 177.966 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 88.8 p -64.3 -47.86 77.86 Favored 'General case' 0 CA--C 1.537 0.443 0 O-C-N 121.543 -0.723 . . . . 1.6100000000000001 112.21 -178.124 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.276 2.6 pp -63.13 -31.57 53.15 Favored 'Isoleucine or valine' 0 C--N 1.341 0.198 0 O-C-N 121.131 -0.981 . . . . 1.1000000000000001 110.283 -179.577 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.1 tm-20 -65.73 -57.07 8.89 Favored 'General case' 0 N--CA 1.452 -0.373 0 C-N-CA 120.026 -0.669 . . . . 3.1400000000000001 109.404 169.281 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -48.38 -43.52 33.92 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.983 0.81 . . . . 1.3999999999999999 111.616 -171.764 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.4 m -69.75 -39.39 77.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.455 0 O-C-N 121.402 -0.811 . . . . 1.03 111.568 177.413 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 38.8 t -63.73 -48.17 87.77 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.392 0 C-N-CA 123.729 0.812 . . . . 0.98999999999999999 110.572 177.614 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 9.7 t -60.89 -44.04 97.66 Favored 'General case' 0 CA--C 1.536 0.421 0 O-C-N 120.981 -1.075 . . . . 0.84999999999999998 110.741 174.398 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 61.1 m -57.34 -45.08 84.68 Favored 'General case' 0 CA--C 1.539 0.548 0 CA-C-N 119.327 0.967 . . . . 0.77000000000000002 110.264 176.433 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 34.1 t80 -53.33 -60.07 3.76 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 123.178 0.591 . . . . 3.3700000000000001 110.235 172.4 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -58.76 -48.0 82.74 Favored 'General case' 0 C--O 1.232 0.169 0 O-C-N 121.693 -0.63 . . . . 4.25 112.185 -174.125 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -63.47 -23.11 67.26 Favored 'General case' 0 CA--C 1.532 0.27 0 CA-C-O 118.639 -0.696 . . . . 1.9199999999999999 111.243 -178.186 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -80.05 -42.03 24.54 Favored 'General case' 0 C--O 1.22 -0.484 0 CA-C-N 118.462 0.574 . . . . 2.9500000000000002 111.185 167.78 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.93 -32.19 65.72 Favored 'General case' 0 C--O 1.238 0.474 0 O-C-N 120.68 -1.263 . . . . 1.28 112.579 -175.539 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . 0.255 0.0 OUTLIER -77.14 -15.17 59.64 Favored 'General case' 0 N--CA 1.453 -0.295 0 C-N-CA 125.804 1.641 . . . . 3.8199999999999998 113.971 179.546 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -39.04 -65.08 0.4 Allowed 'General case' 0 N--CA 1.47 0.529 0 CA-C-N 119.457 1.026 . . . . 1.8999999999999999 112.03 177.248 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 43.0 mt-10 -141.21 -175.31 4.29 Favored 'General case' 0 C--O 1.238 0.477 0 C-N-CA 125.72 1.608 . . . . 5.46 109.226 -170.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 25.12 92.76 0.01 OUTLIER Glycine 0 C--N 1.341 0.858 0 C-N-CA 127.197 2.332 . . . . 2.3900000000000001 113.179 157.841 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 97.5 mtt180 62.44 102.01 0.03 OUTLIER 'General case' 0 CA--C 1.539 0.532 0 C-N-CA 124.55 1.14 . . . . 5.4500000000000002 110.35 178.854 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 25.9 pttt -79.03 50.99 1.09 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.115 1.366 . . . . 6.4900000000000002 112.074 -166.404 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -172.01 -55.15 0.02 OUTLIER 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 107.815 -1.18 . . . . 5.5999999999999996 107.815 -156.839 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 93.7 p -84.74 153.81 22.81 Favored 'General case' 0 C--O 1.244 0.799 0 C-N-CA 124.058 0.943 . . . . 2.4199999999999999 110.886 170.486 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -94.67 119.08 32.74 Favored 'General case' 0 N--CA 1.453 -0.282 0 N-CA-C 108.094 -1.076 . . . . 2.0600000000000001 108.094 172.843 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 4.4 m -82.41 166.28 19.54 Favored 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 108.345 -0.983 . . . . 3.0699999999999998 108.345 171.778 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 62.0 t -60.99 -57.96 9.74 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.399 0 O-C-N 121.139 -0.976 . . . . 2.29 111.275 -171.558 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 27.2 t-20 -61.33 -43.25 99.19 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-O 121.096 0.474 . . . . 3.3999999999999999 110.888 -179.665 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -50.83 -50.6 56.22 Favored 'General case' 0 N--CA 1.452 -0.344 0 C-N-CA 124.668 1.187 . . . . 2.52 110.324 176.188 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 43.3 t80 -62.94 -44.11 96.97 Favored 'General case' 0 N--CA 1.449 -0.48 0 O-C-N 121.829 -0.544 . . . . 3.6499999999999999 110.933 173.71 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 56.2 tttm -49.22 -38.81 27.58 Favored 'General case' 0 N--CA 1.453 -0.294 0 CA-C-O 118.641 -0.695 . . . . 3.7200000000000002 111.234 -178.292 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -46.06 -48.76 16.9 Favored 'General case' 0 C--O 1.224 -0.273 0 CA-C-N 118.807 0.731 . . . . 2.8700000000000001 112.085 172.754 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -59.32 -51.37 70.23 Favored 'General case' 0 N--CA 1.456 -0.137 0 N-CA-C 108.949 -0.76 . . . . 2.4700000000000002 108.949 -173.167 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -71.99 -33.66 48.18 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.261 0 CA-C-N 115.87 -0.605 . . . . 1.3400000000000001 110.012 -173.769 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 91.1 m -69.33 -32.77 72.09 Favored 'General case' 0 CA--C 1.54 0.578 0 C-N-CA 123.896 0.878 . . . . 1.23 111.124 174.012 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 14.3 tt0 -81.16 -58.84 2.88 Favored 'General case' 0 N--CA 1.455 -0.197 0 C-N-CA 125.002 1.321 . . . . 2.5699999999999998 109.878 -174.392 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -99.95 -135.26 0.29 Allowed 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 108.898 -0.779 . . . . 3.8500000000000001 108.898 176.322 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . 0.451 HD22 ' H ' ' A' ' 46' ' ' LEU . 2.8 mm? 29.98 51.75 0.46 Allowed Pre-proline 0 CA--C 1.544 0.744 0 C-N-CA 127.309 2.244 . . . . 2.0800000000000001 113.949 -170.688 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -66.95 -40.08 12.74 Favored 'Trans proline' 0 N--CA 1.448 -1.201 0 C-N-CA 121.97 1.78 . . . . 1.73 111.175 178.424 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 20.6 t-160 -116.71 -28.05 6.48 Favored 'General case' 0 C--N 1.341 0.224 0 CA-C-O 119.216 -0.421 . . . . 4.1299999999999999 111.636 -165.166 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . . . . . . . . . 1.1 tp -64.53 -74.75 0.1 Allowed 'General case' 0 C--O 1.232 0.174 0 CA-C-N 119.481 1.037 . . . . 1.3999999999999999 110.832 179.903 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 85.2 mt -119.54 83.63 2.07 Favored 'General case' 0 N--CA 1.45 -0.473 0 C-N-CA 125.338 1.455 . . . . 2.3100000000000001 107.362 -174.406 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -63.85 -178.34 0.31 Allowed 'General case' 0 CA--C 1.538 0.486 0 CA-C-N 114.976 -1.011 . . . . 5.7800000000000002 109.433 167.626 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER 80.97 44.2 0.04 OUTLIER 'General case' 0 C--N 1.333 -0.136 0 C-N-CA 125.192 1.397 . . . . 4.0 110.053 -179.8 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 0.5 OUTLIER -59.99 -21.5 22.06 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.535 0 C-N-CA 124.833 1.253 . . . . 3.4700000000000002 111.188 175.873 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -56.18 -53.97 38.92 Favored Glycine 0 CA--C 1.528 0.899 0 N-CA-C 110.736 -0.945 . . . . 1.6599999999999999 110.736 169.439 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 56.0 p -80.14 40.71 0.49 Allowed 'General case' 0 CA--C 1.531 0.24 0 CA-C-N 118.062 0.931 . . . . 2.8799999999999999 111.726 -172.132 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.1 tm? -57.21 -36.92 71.46 Favored 'General case' 0 N--CA 1.446 -0.664 0 O-C-N 120.811 -1.181 . . . . 1.6200000000000001 110.501 -172.373 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -53.09 -34.95 58.9 Favored 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 113.689 0.996 . . . . 4.5700000000000003 113.689 177.459 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.8 tt0 -57.99 -51.97 67.45 Favored 'General case' 0 N--CA 1.464 0.234 0 CA-C-O 121.571 0.701 . . . . 3.1499999999999999 109.219 174.313 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -60.75 -51.07 70.89 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 107.574 -1.269 . . . . 3.6800000000000002 107.574 -178.694 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.2 tmt? -46.35 -60.88 2.06 Favored 'General case' 0 C--O 1.222 -0.35 0 C-N-CA 123.922 0.889 . . . . 1.4399999999999999 109.988 176.93 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 2.9 mtmm -67.32 -28.34 67.91 Favored 'General case' 0 CA--C 1.532 0.286 0 CA-C-N 119.055 0.843 . . . . 4.1699999999999999 112.396 -176.645 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 49.5 m -61.74 -32.04 72.26 Favored 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 118.647 0.658 . . . . 2.2400000000000002 111.804 169.543 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . 0.485 HD23 ' HB3' ' A' ' 78' ' ' ARG . 12.1 mt -91.24 -64.38 1.13 Allowed 'General case' 0 CA--C 1.528 0.107 0 C-N-CA 124.714 1.206 . . . . 1.72 111.305 -175.52 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -74.48 71.61 1.83 Allowed 'General case' 0 N--CA 1.449 -0.503 0 C-N-CA 125.242 1.417 . . . . 2.1499999999999999 109.96 -173.803 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -49.79 -33.1 8.14 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.419 0 C-N-CA 124.934 1.294 . . . . 3.3900000000000001 112.766 -177.507 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -85.14 -10.2 57.0 Favored 'General case' 0 CA--C 1.534 0.357 0 C-N-CA 124.214 1.006 . . . . 2.1299999999999999 113.095 -179.203 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 51.86 39.85 26.67 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.862 1.265 . . . . 5.0999999999999996 110.693 179.372 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 31.0 p30 -88.62 -14.53 37.27 Favored 'General case' 0 CA--C 1.534 0.338 0 C-N-CA 124.006 0.922 . . . . 2.1600000000000001 109.92 174.993 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 15.2 m 69.34 15.75 8.43 Favored 'General case' 0 CA--C 1.533 0.313 0 C-N-CA 124.942 1.297 . . . . 1.5900000000000001 112.974 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 25.6 mt-10 -121.66 105.61 10.58 Favored 'General case' 0 N--CA 1.45 -0.425 0 C-N-CA 125.609 1.563 . . . . 3.96 107.474 167.24 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -82.14 109.32 16.34 Favored 'General case' 0 N--CA 1.445 -0.702 0 N-CA-C 105.976 -1.861 . . . . 1.26 105.976 -175.154 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 6.2 ttpm? -85.06 148.54 26.1 Favored 'General case' 0 N--CA 1.455 -0.224 0 C-N-CA 124.435 1.094 . . . . 3.46 108.149 177.048 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 9.3 p90 -39.69 -56.37 1.72 Allowed 'General case' 0 CA--C 1.539 0.533 0 C-N-CA 125.012 1.325 . . . . 5.1500000000000004 114.159 -173.44 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -68.06 -29.08 67.96 Favored 'General case' 0 CA--C 1.536 0.432 0 O-C-N 121.451 -0.781 . . . . 2.0499999999999998 112.173 -178.609 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 75.7 mt-10 -66.13 -51.36 58.69 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 107.975 -1.12 . . . . 2.1899999999999999 107.975 173.104 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER -51.98 -44.44 64.02 Favored 'General case' 0 N--CA 1.455 -0.214 0 C-N-CA 124.315 1.046 . . . . 6.4000000000000004 110.395 177.948 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.679 ' CZ2' ' CE2' ' B' ' 77' ' ' TRP . 23.5 t90 -40.63 -38.71 0.92 Allowed 'General case' 0 N--CA 1.448 -0.555 0 CA-C-O 117.705 -1.14 . . . . 5.0099999999999998 113.061 -171.615 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.485 ' HB3' HD23 ' A' ' 63' ' ' LEU . 15.3 ttt180 -39.24 -49.49 1.9 Allowed 'General case' 0 N--CA 1.473 0.678 0 CA-C-N 119.61 1.096 . . . . 6.3899999999999997 111.012 175.805 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 9.6 tp -46.97 -46.47 21.6 Favored 'General case' 0 N--CA 1.449 -0.49 0 C-N-CA 123.368 0.667 . . . . 0.87 110.27 -177.751 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 53.2 mt -66.31 -33.0 60.59 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.361 0 CA-C-O 121.829 0.823 . . . . 1.9399999999999999 109.319 -174.066 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.56 ' HA2' ' CE2' ' B' ' 77' ' ' TRP . . . -63.6 -48.87 73.65 Favored Glycine 0 CA--C 1.492 -1.373 0 C-N-CA 126.888 2.185 . . . . 1.4299999999999999 110.073 176.728 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 4.0 mm-40 -69.89 -53.07 19.67 Favored 'General case' 0 N--CA 1.433 -1.298 0 N-CA-C 106.002 -1.851 . . . . 2.4199999999999999 106.002 -173.976 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . . . . . . . . . 1.4 mt -40.13 -59.39 1.26 Allowed 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.913 1.285 . . . . 2.52 111.375 168.835 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.72 -41.35 77.3 Favored 'General case' 0 CA--C 1.529 0.168 0 C-N-CA 123.43 0.692 . . . . 1.1599999999999999 110.943 -179.485 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' A' ' 82' ' ' GLU . 0.0 OUTLIER -58.92 -52.19 66.79 Favored 'General case' 0 N--CA 1.451 -0.402 0 O-C-N 121.896 -0.503 . . . . 1.97 110.184 174.091 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -52.42 -46.31 66.3 Favored 'General case' 0 N--CA 1.452 -0.335 0 C-N-CA 126.409 1.883 . . . . 2.3100000000000001 110.288 -168.143 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 2.8 tt -53.77 -29.99 18.45 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.723 0 N-CA-C 112.52 0.563 . . . . 1.48 112.52 178.246 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 7.4 tmm_? -88.68 -45.48 9.79 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 124.109 0.964 . . . . 6.1200000000000001 111.25 174.15 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 34.3 tttt -80.98 -32.38 34.36 Favored 'General case' 0 CA--C 1.535 0.404 0 C-N-CA 128.233 2.613 . . . . 3.48 114.299 -165.124 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 27.2 mttm -31.86 -62.69 0.2 Allowed 'General case' 0 N--CA 1.471 0.588 0 CA-C-N 120.425 1.466 . . . . 7.3300000000000001 114.699 -117.086 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 32.4 ttmt -146.66 60.94 1.21 Allowed 'General case' 0 N--CA 1.449 -0.486 0 N-CA-C 107.525 -1.287 . . . . 8.9299999999999997 107.525 175.634 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 14.0 t70 -53.61 95.41 0.01 OUTLIER 'General case' 0 CA--C 1.535 0.376 0 C-N-CA 125.373 1.469 . . . . 6.6500000000000004 109.595 172.954 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 11.0 tp -173.47 -58.29 0.02 OUTLIER 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 104.919 -2.252 . . . . 8.1300000000000008 104.919 -168.346 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 73.7 mmtt -73.01 171.77 12.24 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 108.773 -0.825 . . . . 10.48 108.773 161.95 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 20.6 tt -57.26 143.93 10.54 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.347 0 C-N-CA 122.964 0.506 . . . . 11.33 110.454 179.495 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 8.3 mpt_? -78.02 151.69 33.42 Favored 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.044 0.537 . . . . 14.029999999999999 109.558 -174.084 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -177.57 -27.01 0.01 OUTLIER 'General case' 0 CA--C 1.539 0.545 0 C-N-CA 125.296 1.438 . . . . 10.4 111.08 -170.924 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . 0.446 ' NZ ' ' OE2' ' B' ' 4' ' ' GLU . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.954 0 C-N-CA 126.754 2.022 . . . . 9.7100000000000009 110.531 -176.787 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 52.7 mmm . . . . . 0 N--CA 1.477 0.908 0 CA-C-O 118.511 -0.757 . . . . 7.21 111.51 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -176.58 166.2 2.66 Favored 'General case' 0 N--CA 1.461 0.102 0 CA-C-N 119.576 1.08 . . . . 7.3300000000000001 108.831 176.579 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 65.92 89.54 0.1 Allowed 'General case' 0 CA--C 1.536 0.407 0 C-N-CA 126.043 1.737 . . . . 6.46 115.593 155.476 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . 0.446 ' OE2' ' NZ ' ' A' ' 98' ' ' LYS . 54.0 mt-10 -138.43 151.18 68.7 Favored Pre-proline 0 CA--C 1.537 0.464 0 N-CA-C 105.432 -2.062 . . . . 5.29 105.432 148.568 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -76.91 147.08 26.7 Favored 'Trans proline' 0 CA--C 1.534 0.517 0 C-N-CA 123.452 2.768 . . . . 3.5600000000000001 110.709 -179.655 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 76.3 mt -144.47 -159.12 0.95 Allowed 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 126.346 1.858 . . . . 3.0600000000000001 109.821 -166.227 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . 0.485 HG23 ' N ' ' B' ' 8' ' ' GLU . 4.0 t -69.13 -70.56 0.27 Allowed 'General case' 0 CA--C 1.543 0.695 0 N-CA-C 115.221 1.563 . . . . 2.3599999999999999 115.221 -165.766 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . 0.485 ' N ' HG23 ' B' ' 7' ' ' THR . 28.4 tt0 -171.93 -73.45 0.02 OUTLIER 'General case' 0 CA--C 1.531 0.243 0 C-N-CA 125.411 1.484 . . . . 2.3900000000000001 108.334 -168.094 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 17.4 mt -56.47 -41.24 76.23 Favored 'General case' 0 CA--C 1.532 0.271 0 O-C-N 120.574 -1.328 . . . . 1.05 110.064 167.798 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . 0.446 ' CG ' HG22 ' B' ' 7' ' ' THR . 78.4 mt-10 -54.59 -41.8 70.33 Favored 'General case' 0 CA--C 1.549 0.916 0 C-N-CA 123.52 0.728 . . . . 3.5099999999999998 111.319 171.964 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 7.5 mm-40 -63.42 -43.54 97.2 Favored 'General case' 0 CA--C 1.533 0.318 0 O-C-N 120.891 -1.131 . . . . 4.3099999999999996 110.43 173.974 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.2 t -59.58 -45.42 91.92 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 123.305 0.642 . . . . 1.8300000000000001 110.624 -178.259 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . . 2.8 pp -66.46 -38.0 80.81 Favored 'Isoleucine or valine' 0 C--O 1.235 0.308 0 CA-C-N 118.151 0.432 . . . . 1.0 110.4 172.869 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -56.09 -60.34 3.63 Favored 'General case' 0 C--O 1.22 -0.462 0 CA-C-O 117.894 -1.051 . . . . 2.73 109.764 178.929 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 14.1 t -56.93 -28.82 62.51 Favored 'General case' 0 CA--C 1.542 0.662 0 CA-C-N 120.182 1.355 . . . . 1.24 113.455 -170.516 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 27.2 m -81.05 -44.66 21.0 Favored 'Isoleucine or valine' 0 N--CA 1.464 0.258 0 O-C-N 121.426 -0.797 . . . . 0.89000000000000001 109.626 -178.669 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 85.9 t -54.38 -35.46 30.95 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.407 0 N-CA-C 108.405 -0.961 . . . . 1.1200000000000001 108.405 165.748 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . 2.238 1.5 t -54.59 -63.76 1.05 Allowed 'General case' 0 N--CA 1.446 -0.648 0 C-N-CA 126.543 1.937 . . . . 3.29 110.834 -178.72 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 49.8 m -51.32 -59.66 3.98 Favored 'General case' 0 N--CA 1.438 -1.068 0 CA-C-N 110.805 -2.907 . . . . 1.02 110.166 176.598 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 18.0 m-85 -58.91 -54.55 45.81 Favored 'General case' 0 C--O 1.223 -0.331 0 O-C-N 122.108 -0.37 . . . . 6.8899999999999997 110.815 -178.946 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 46.2 t80 -57.72 -45.76 85.32 Favored 'General case' 0 C--N 1.332 -0.191 0 C-N-CA 124.895 1.278 . . . . 3.1699999999999999 111.768 -176.52 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 2.7 t -65.72 -52.9 47.54 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 109.082 -0.71 . . . . 3.0899999999999999 109.082 177.158 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 11.0 t80 -55.5 -38.95 69.84 Favored 'General case' 0 CA--C 1.533 0.291 0 CA-C-O 121.696 0.76 . . . . 3.54 111.046 -179.031 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -55.93 -24.2 36.43 Favored 'General case' 0 N--CA 1.447 -0.595 0 C-N-CA 127.153 2.181 . . . . 1.1399999999999999 110.6 -179.42 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.43 -19.24 34.67 Favored 'General case' 0 N--CA 1.451 -0.405 0 CA-C-O 117.844 -1.074 . . . . 4.1799999999999997 111.841 175.783 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.435 ' HB3' ' HG3' ' B' ' 37' ' ' GLU . 0.5 OUTLIER -50.57 -67.52 0.25 Allowed 'General case' 0 CA--C 1.536 0.407 0 N-CA-C 113.881 1.067 . . . . 2.1099999999999999 113.881 -160.96 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 68.4 mt-10 -90.14 -44.48 9.75 Favored 'General case' 0 N--CA 1.452 -0.36 0 C-N-CA 125.931 1.692 . . . . 3.7200000000000002 111.977 -179.091 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.5 -143.48 1.12 Allowed Glycine 0 CA--C 1.536 1.36 0 CA-C-N 115.269 -0.878 . . . . 3.75 113.546 -166.052 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 16.2 mtt-85 50.35 99.45 0.01 OUTLIER 'General case' 0 C--O 1.237 0.404 1 C-N-CA 131.755 4.022 . . . . 3.5800000000000001 112.464 27.349 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 10.4 ptpp? -66.42 -177.72 0.59 Allowed 'General case' 0 N--CA 1.446 -0.637 0 C-N-CA 119.092 -1.043 . . . . 3.8500000000000001 109.195 148.946 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 9.1 t70 78.31 -59.83 0.42 Allowed 'General case' 0 C--N 1.328 -0.335 0 C-N-CA 127.593 2.357 . . . . 4.1500000000000004 109.846 179.809 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 25.8 p -88.12 134.66 33.71 Favored 'General case' 0 C--O 1.243 0.72 0 CA-C-O 121.471 0.653 . . . . 1.8500000000000001 110.201 175.857 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 4.1 mm? -82.14 141.89 32.71 Favored 'General case' 0 N--CA 1.447 -0.597 0 N-CA-C 106.84 -1.541 . . . . 2.2000000000000002 106.84 167.056 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 4.5 t -92.79 -172.32 2.99 Favored 'General case' 0 C--N 1.327 -0.37 0 C-N-CA 125.086 1.354 . . . . 2.21 109.998 165.771 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . 0.408 ' C ' ' H ' ' B' ' 37' ' ' GLU . 70.9 t -67.53 -112.16 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.45 -0.431 2 N-CA-C 99.47 -4.27 . . . . 3.52 99.47 -179.354 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -75.75 53.78 0.75 Allowed 'General case' 0 CA--C 1.556 1.202 0 CA-C-N 123.505 2.866 . . . . 2.8999999999999999 112.136 -172.171 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.435 ' HG3' ' HB3' ' B' ' 26' ' ' GLN . 3.3 tt0 -105.4 -58.0 1.96 Allowed 'General case' 0 N--CA 1.448 -0.552 1 C-N-CA 132.292 4.237 . . . . 1.6599999999999999 104.099 150.38 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 24.2 t80 -57.68 -40.16 78.8 Favored 'General case' 0 N--CA 1.447 -0.611 0 C-N-CA 123.716 0.806 . . . . 2.1699999999999999 110.161 -178.767 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 3.7 ttpm? -58.02 -37.06 73.6 Favored 'General case' 0 C--N 1.341 0.202 0 C-N-CA 119.126 -1.03 . . . . 4.6299999999999999 109.981 179.647 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 43.2 mm-40 -73.83 -25.58 60.16 Favored 'General case' 0 N--CA 1.442 -0.875 0 CA-C-N 116.413 -0.358 . . . . 4.9000000000000004 110.687 179.209 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 8.5 tt -67.57 -48.76 65.98 Favored 'General case' 0 N--CA 1.449 -0.484 0 N-CA-C 108.484 -0.932 . . . . 2.6899999999999999 108.484 172.558 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 2.1 m -65.24 -51.09 69.51 Favored 'Isoleucine or valine' 0 C--N 1.34 0.166 0 N-CA-C 109.344 -0.613 . . . . 1.1200000000000001 109.344 -177.858 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 94.6 m -51.31 -56.6 12.18 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 123.722 0.809 . . . . 0.89000000000000001 111.576 176.557 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 6.6 tt0 -80.87 -54.37 5.65 Favored 'General case' 0 CA--C 1.533 0.293 0 N-CA-C 111.757 0.28 . . . . 1.77 111.757 -169.612 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 26.5 mm100 -80.11 -40.23 27.92 Favored 'General case' 0 C--O 1.227 -0.131 0 N-CA-C 113.573 0.953 . . . . 3.5699999999999998 113.573 -164.64 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 0.9 OUTLIER -54.62 -41.89 92.01 Favored Pre-proline 0 N--CA 1.467 0.393 0 CA-C-N 118.937 0.79 . . . . 2.0800000000000001 112.47 -168.237 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -70.61 -54.4 0.18 Allowed 'Trans proline' 0 N--CA 1.452 -0.926 0 N-CA-C 107.631 -1.719 . . . . 2.6299999999999999 107.631 -41.91 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 50.7 t60 -66.44 -43.62 85.11 Favored 'General case' 0 N--CA 1.454 -0.235 0 C-N-CA 124.786 1.234 . . . . 3.48 112.046 -175.311 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 27.0 tp -33.85 -62.96 0.28 Allowed 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.123 1.769 . . . . 1.3600000000000001 113.257 -168.635 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . 0.495 ' CD1' HD11 ' B' ' 79' ' ' LEU . 35.2 mt -81.34 97.59 7.77 Favored 'General case' 0 N--CA 1.453 -0.32 0 N-CA-C 107.76 -1.2 . . . . 1.6899999999999999 107.76 167.152 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -49.44 145.07 5.02 Favored 'General case' 0 N--CA 1.454 -0.266 0 N-CA-C 109.081 -0.711 . . . . 6.0499999999999998 109.081 171.065 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 40.7 t0 63.38 60.19 1.17 Allowed 'General case' 0 C--N 1.339 0.134 0 CA-C-O 123.987 1.851 . . . . 4.3099999999999996 109.191 171.29 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 33.7 m -56.07 -21.27 11.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 112.36 -2.2 . . . . 2.0800000000000001 111.245 164.142 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -64.34 -60.52 7.0 Favored Glycine 0 C--N 1.341 0.82 0 C-N-CA 124.455 1.026 . . . . 2.9700000000000002 111.378 178.367 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 4.2 t -77.21 66.68 3.04 Favored 'General case' 0 CA--C 1.532 0.28 0 CA-C-O 122.396 1.094 . . . . 2.71 109.675 -175.846 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -71.09 -34.88 71.56 Favored 'General case' 0 N--CA 1.44 -0.926 0 C-N-CA 125.274 1.43 . . . . 1.3 109.917 -174.162 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -18.08 -70.35 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.427 0 C-N-CA 127.128 2.171 . . . . 4.1900000000000004 115.508 167.194 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -38.77 78.67 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 119.705 1.139 . . . . 3.21 111.635 -175.676 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.98 -60.08 4.35 Favored 'General case' 0 N--CA 1.451 -0.409 0 N-CA-C 108.203 -1.036 . . . . 3.5600000000000001 108.203 172.734 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.1 tmt? -46.16 -51.43 14.11 Favored 'General case' 0 C--O 1.225 -0.201 0 CA-C-N 118.962 0.801 . . . . 2.2599999999999998 110.982 -178.36 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -63.0 -42.21 99.79 Favored 'General case' 0 CA--C 1.533 0.31 0 O-C-N 121.74 -0.6 . . . . 3.5499999999999998 111.954 178.827 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 24.8 t -61.16 -39.67 90.97 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.7 0.682 . . . . 2.2999999999999998 111.828 174.763 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . 0.438 HD23 ' HB2' ' B' ' 78' ' ' ARG . 34.4 mt -80.83 -61.19 2.04 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 124.478 1.111 . . . . 1.6399999999999999 110.669 -171.822 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 7.9 t0 -71.11 -10.12 59.22 Favored 'General case' 0 C--O 1.238 0.47 0 C-N-CA 128.888 2.875 . . . . 2.9399999999999999 115.101 -162.636 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 0.3 OUTLIER -37.72 -19.56 0.01 OUTLIER 'Isoleucine or valine' 0 N--CA 1.447 -0.586 0 C-N-CA 131.143 3.777 . . . . 3.9900000000000002 117.441 -160.698 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -61.12 -19.42 61.48 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 120.192 1.36 . . . . 2.7599999999999998 111.747 171.845 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 3.1 tp-100 101.16 -25.3 0.02 OUTLIER 'General case' 0 C--N 1.343 0.309 0 C-N-CA 127.605 2.362 . . . . 3.6200000000000001 111.32 166.982 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 6.9 p30 -61.62 139.32 58.29 Favored 'General case' 0 C--N 1.34 0.181 0 C-N-CA 118.457 -1.297 . . . . 2.9900000000000002 107.546 164.848 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 1.7 p -78.33 12.9 1.71 Allowed 'General case' 0 CA--C 1.537 0.463 0 C-N-CA 127.929 2.492 . . . . 3.2799999999999998 112.987 -179.576 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 31.2 mt-10 -87.63 116.76 25.98 Favored 'General case' 0 N--CA 1.448 -0.526 0 N-CA-C 104.389 -2.449 . . . . 3.2599999999999998 104.389 162.839 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -65.05 90.59 0.09 Allowed 'General case' 0 N--CA 1.451 -0.407 0 N-CA-C 104.924 -2.25 . . . . 1.8500000000000001 104.924 157.463 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 36.6 tptt -80.02 168.45 19.17 Favored 'General case' 0 N--CA 1.45 -0.427 0 N-CA-C 108.331 -0.989 . . . . 4.9400000000000004 108.331 -165.564 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -91.61 61.02 4.17 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 109.22 -0.659 . . . . 4.6399999999999997 109.22 175.627 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -154.89 50.94 0.6 Allowed 'General case' 0 N--CA 1.442 -0.826 0 C-N-CA 119.096 -1.042 . . . . 3.8999999999999999 112.661 87.203 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 55.1 mt-10 -86.42 -55.92 3.67 Favored 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 125.691 1.597 . . . . 2.2000000000000002 108.288 153.798 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 1.2 p90 -50.62 -39.95 51.59 Favored 'General case' 0 C--N 1.344 0.354 0 C-N-CA 123.021 0.528 . . . . 5.9100000000000001 110.427 -174.377 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.679 ' CE2' ' CZ2' ' A' ' 77' ' ' TRP . 27.8 t90 -47.44 -38.49 13.62 Favored 'General case' 0 N--CA 1.448 -0.551 0 C-N-CA 123.651 0.781 . . . . 4.0 111.206 -179.808 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . 0.438 ' HB2' HD23 ' B' ' 63' ' ' LEU . 54.5 mtp85 -43.05 -38.79 2.45 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 124.681 1.193 . . . . 4.3099999999999996 111.716 177.079 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . 0.495 HD11 ' CD1' ' B' ' 50' ' ' LEU . 13.7 tp -51.62 -47.45 63.66 Favored 'General case' 0 C--O 1.222 -0.348 0 CA-C-N 117.915 0.325 . . . . 0.85999999999999999 111.05 177.686 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 65.3 mt -65.74 -26.04 37.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.395 0 N-CA-C 109.133 -0.691 . . . . 1.73 109.133 -176.252 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.574 ' N ' ' CZ2' ' A' ' 77' ' ' TRP . . . -67.15 -51.64 37.43 Favored Glycine 0 CA--C 1.501 -0.829 0 C-N-CA 126.907 2.194 . . . . 1.78 108.112 176.104 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 12.6 mt-10 -51.99 -60.95 2.59 Favored 'General case' 0 N--CA 1.444 -0.757 0 N-CA-C 108.168 -1.049 . . . . 4.3899999999999997 108.168 169.411 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 16.4 mt -48.09 -51.96 22.33 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 120.526 1.512 . . . . 2.4900000000000002 113.121 -175.701 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -55.0 -33.93 62.99 Favored 'General case' 0 N--CA 1.456 -0.166 0 C-N-CA 124.26 1.024 . . . . 1.9099999999999999 110.548 178.647 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.89 -56.39 5.8 Favored 'General case' 0 N--CA 1.446 -0.628 0 CA-C-O 117.284 -1.341 . . . . 1.98 111.423 165.538 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 45.0 mm-40 -52.73 -36.15 57.17 Favored 'General case' 0 N--CA 1.464 0.233 0 CA-C-N 120.295 1.407 . . . . 2.54 112.894 -164.092 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 3.0 tt -55.61 -38.2 49.13 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.729 0 O-C-N 121.598 -0.689 . . . . 0.98999999999999999 111.446 175.222 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -84.06 -61.66 1.76 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 125.248 1.419 . . . . 6.5800000000000001 113.463 169.949 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 10.8 pttp -83.09 147.97 27.79 Favored 'General case' 0 C--O 1.223 -0.302 0 O-C-N 120.804 -1.185 . . . . 6.5099999999999998 111.83 -169.555 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 47.9 tttt -81.12 -60.28 2.35 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 109.225 -0.657 . . . . 5.4800000000000004 109.225 164.874 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 37.6 tptt -144.24 21.07 1.73 Allowed 'General case' 0 CA--C 1.537 0.453 0 C-N-CA 124.143 0.977 . . . . 8.0600000000000005 109.718 166.627 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 18.2 t70 33.85 -122.49 0.09 Allowed 'General case' 0 C--N 1.346 0.43 0 C-N-CA 126.223 1.809 . . . . 4.8899999999999997 109.329 -167.783 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 33.2 tp -110.11 134.86 51.75 Favored 'General case' 0 N--CA 1.434 -1.237 0 N-CA-C 105.189 -2.152 . . . . 9.2400000000000002 105.189 154.314 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -31.52 131.66 0.11 Allowed 'General case' 0 CA--C 1.543 0.692 0 C-N-CA 124.733 1.213 . . . . 7.2300000000000004 112.382 163.445 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 42.5 pt -103.05 150.13 6.83 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.212 0 C-N-CA 124.227 1.011 . . . . 7.6500000000000004 109.77 -179.83 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -168.41 -179.01 3.76 Favored 'General case' 0 CA--C 1.528 0.134 0 C-N-CA 125.992 1.717 . . . . 6.2999999999999998 106.958 170.008 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 6.8 ttmt -175.9 137.25 0.33 Allowed 'General case' 0 N--CA 1.455 -0.203 0 N-CA-C 106.29 -1.745 . . . . 7.6299999999999999 106.29 178.381 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.254 1.333 0 N-CA-C 104.903 -2.258 . . . . 6.7699999999999996 104.903 165.962 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 61.2 mtt . . . . . 0 N--CA 1.475 0.819 0 N-CA-C 104.905 -2.258 . . . . 6.5300000000000002 104.905 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -63.66 178.04 0.64 Allowed 'General case' 0 C--O 1.238 0.481 0 N-CA-C 108.566 -0.902 . . . . 2.98 108.566 135.048 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 73.15 87.77 0.1 Allowed 'General case' 0 N--CA 1.45 -0.438 0 C-N-CA 125.932 1.693 . . . . 3.5600000000000001 109.429 -170.867 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -74.61 123.16 88.88 Favored Pre-proline 0 N--CA 1.444 -0.728 0 C-N-CA 125.425 1.49 . . . . 4.4400000000000004 108.82 -176.523 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 86.1 Cg_endo -67.53 141.98 57.49 Favored 'Trans proline' 0 N--CA 1.45 -1.079 0 N-CA-C 107.522 -1.761 . . . . 2.25 107.522 171.028 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 57.6 mt -96.84 173.9 7.07 Favored 'General case' 0 N--CA 1.45 -0.447 0 N-CA-C 107.4 -1.333 . . . . 1.3300000000000001 107.4 179.324 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 2.9 t -72.47 166.63 22.23 Favored 'General case' 0 CA--C 1.529 0.173 0 O-C-N 120.804 -1.185 . . . . 1.8500000000000001 110.534 -177.824 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 43.6 tt0 -52.8 -57.42 10.23 Favored 'General case' 0 N--CA 1.452 -0.336 0 CA-C-O 121.961 0.886 . . . . 2.1899999999999999 111.39 -169.019 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 8.8 mt -66.63 -31.2 71.74 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 117.436 -1.269 . . . . 1.6399999999999999 112.08 178.679 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 77.6 mt-10 -55.67 -55.97 25.95 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 120.84 1.654 . . . . 1.95 110.92 168.482 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 64.2 mm-40 -48.56 -51.44 27.7 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-O 122.028 0.918 . . . . 3.3900000000000001 109.18 174.748 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.2 t -60.01 -53.58 56.15 Favored 'General case' 0 N--CA 1.452 -0.341 0 CA-C-N 115.279 -0.873 . . . . 1.8300000000000001 112.42 -173.787 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . . . . . . . . 0.356 0.1 OUTLIER -71.29 -33.24 49.8 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.232 0 CA-C-N 119.404 1.002 . . . . 1.45 110.415 -178.584 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 1.2 tm-20 -53.44 -53.3 53.25 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 119.081 0.855 . . . . 2.6699999999999999 109.693 173.293 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 14.5 t -59.22 -25.38 63.96 Favored 'General case' 0 CA--C 1.542 0.656 0 N-CA-C 113.953 1.094 . . . . 1.49 113.953 -173.686 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 18.7 m -81.24 -42.22 19.67 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.322 0 CA-C-N 120.286 1.403 . . . . 0.65000000000000002 110.776 169.498 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 55.1 t -56.05 -46.05 80.63 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.175 0 C-N-CA 123.89 0.876 . . . . 0.73999999999999999 111.018 179.62 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 15.3 t -60.65 -47.08 87.82 Favored 'General case' 0 CA--C 1.537 0.479 0 CA-C-N 119.174 0.897 . . . . 0.76000000000000001 110.632 177.309 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 18.3 m -58.26 -47.12 84.59 Favored 'General case' 0 CA--C 1.537 0.465 0 O-C-N 121.358 -0.839 . . . . 0.82999999999999996 110.073 179.275 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.455 ' CZ ' HD23 ' A' ' 33' ' ' LEU . 7.6 t80 -52.34 -56.98 11.27 Favored 'General case' 0 CA--C 1.538 0.489 0 C-N-CA 124.566 1.146 . . . . 3.0099999999999998 110.696 171.171 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 21.2 t80 -68.62 -39.56 80.77 Favored 'General case' 0 N--CA 1.457 -0.113 0 C-N-CA 123.91 0.884 . . . . 2.6600000000000001 110.928 -166.506 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 25.3 p -57.92 -60.35 3.85 Favored 'General case' 0 N--CA 1.45 -0.475 0 N-CA-C 108.621 -0.881 . . . . 2.46 108.621 169.762 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -49.04 -41.39 34.8 Favored 'General case' 0 N--CA 1.467 0.39 0 CA-C-N 118.874 0.761 . . . . 3.0 113.044 -179.75 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.68 -25.75 19.57 Favored 'General case' 0 C--O 1.236 0.395 0 C-N-CA 127.037 2.135 . . . . 1.1000000000000001 111.711 -174.774 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.6 -34.1 70.73 Favored 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.999 1.32 . . . . 4.1500000000000004 112.367 176.575 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -52.85 -52.03 58.73 Favored 'General case' 0 C--N 1.341 0.201 0 CA-C-O 121.642 0.734 . . . . 1.98 112.53 -157.323 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 25.0 mt-10 -119.34 165.3 14.48 Favored 'General case' 0 N--CA 1.442 -0.856 0 C-N-CA 127.839 2.456 . . . . 2.7000000000000002 105.923 176.033 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 9.19 106.98 0.0 OUTLIER Glycine 0 CA--C 1.536 1.372 0 C-N-CA 126.798 2.142 . . . . 1.46 115.768 165.593 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 6.9 mpt_? 66.38 105.41 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 124.848 1.259 . . . . 5.8799999999999999 113.904 165.552 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 16.3 pttp -65.29 63.99 0.03 OUTLIER 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.499 0.72 . . . . 3.5299999999999998 111.245 164.529 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -171.67 -53.59 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.116 0 C-N-CA 126.9 2.08 . . . . 3.6800000000000002 106.965 -175.987 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.2 m -84.4 128.0 34.33 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 124.345 1.058 . . . . 2.5800000000000001 109.803 174.283 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.455 HD23 ' CZ ' ' A' ' 20' ' ' PHE . 2.2 mm? -82.56 145.88 29.49 Favored 'General case' 0 N--CA 1.444 -0.774 0 N-CA-C 107.378 -1.342 . . . . 2.5899999999999999 107.378 172.499 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 13.3 m -121.02 164.47 16.71 Favored 'General case' 0 N--CA 1.445 -0.709 0 C-N-CA 125.179 1.392 . . . . 4.2300000000000004 107.815 -169.183 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.7 p -68.94 -36.16 72.7 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.267 0 O-C-N 120.707 -1.245 . . . . 2.6299999999999999 112.193 -167.819 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 2.0 t30 -69.26 -48.84 60.65 Favored 'General case' 0 N--CA 1.452 -0.366 0 N-CA-C 107.551 -1.277 . . . . 1.99 107.551 179.648 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 86.1 mt-10 -44.74 -54.66 6.04 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.911 0.884 . . . . 1.95 111.021 171.396 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 50.0 t80 -51.22 -57.03 9.89 Favored 'General case' 0 N--CA 1.449 -0.499 0 CA-C-N 115.67 -0.695 . . . . 2.7599999999999998 110.498 177.637 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.536 ' HE3' HD12 ' A' ' 56' ' ' LEU . 17.0 ttmt -59.52 -42.02 91.28 Favored 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 118.249 0.477 . . . . 3.8199999999999998 111.874 179.785 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.3 mt-10 -56.83 -39.7 74.69 Favored 'General case' 0 N--CA 1.454 -0.26 0 O-C-N 121.277 -0.89 . . . . 2.48 110.452 176.946 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.2 tm? -63.41 -47.33 82.41 Favored 'General case' 0 C--O 1.232 0.184 0 N-CA-C 108.024 -1.102 . . . . 2.0899999999999999 108.024 -174.846 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -66.53 -54.24 27.76 Favored 'Isoleucine or valine' 0 N--CA 1.456 -0.159 0 N-CA-C 109.995 -0.372 . . . . 0.88 109.995 -179.103 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 92.3 m -50.0 -48.31 52.52 Favored 'General case' 0 N--CA 1.451 -0.411 0 C-N-CA 124.745 1.218 . . . . 1.1299999999999999 110.877 -179.717 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.0 tt0 -76.74 -45.41 29.31 Favored 'General case' 0 N--CA 1.447 -0.608 0 C-N-CA 123.35 0.66 . . . . 2.3999999999999999 110.862 -174.643 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.1 mt-30 -135.01 10.67 3.58 Favored 'General case' 0 C--N 1.343 0.311 0 N-CA-C 116.527 2.047 . . . . 3.5099999999999998 116.527 -161.214 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 2.6 mm? -120.47 69.89 16.25 Favored Pre-proline 0 N--CA 1.469 0.517 0 CA-C-N 121.133 1.788 . . . . 1.8700000000000001 109.567 164.1 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_endo -68.28 -39.86 9.39 Favored 'Trans proline' 0 N--CA 1.449 -1.106 0 C-N-CA 123.242 2.628 . . . . 1.8 111.391 -178.171 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 1.5 t-80 -97.95 -50.38 4.43 Favored 'General case' 0 C--O 1.234 0.262 0 CA-C-N 118.476 0.58 . . . . 3.8300000000000001 109.749 -177.442 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.53 ' CD2' ' HG ' ' A' ' 83' ' ' LEU . 0.9 OUTLIER -55.47 -64.56 0.81 Allowed 'General case' 0 N--CA 1.455 -0.185 0 CA-C-O 121.361 0.601 . . . . 1.79 111.673 -167.914 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.402 ' C ' ' H ' ' A' ' 52' ' ' ASP . 84.6 mt -116.99 56.52 0.81 Allowed 'General case' 0 N--CA 1.449 -0.476 0 C-N-CA 124.861 1.265 . . . . 2.9700000000000002 108.375 -171.326 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.3 31.94 0.03 OUTLIER 'General case' 0 CA--C 1.543 0.682 0 C-N-CA 125.262 1.425 . . . . 5.21 112.776 171.394 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . 0.402 ' H ' ' C ' ' A' ' 50' ' ' LEU . 33.5 t70 -110.88 29.45 7.75 Favored 'General case' 0 N--CA 1.451 -0.389 0 C-N-CA 127.899 2.48 . . . . 4.8700000000000001 108.174 -175.376 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 27.7 m -56.93 -30.02 32.49 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.333 0 C-N-CA 123.588 0.755 . . . . 2.75 111.758 -173.215 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -56.91 -38.29 83.62 Favored Glycine 0 CA--C 1.532 1.154 0 N-CA-C 111.277 -0.729 . . . . 2.3900000000000001 111.277 174.058 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 1.8 m -110.86 46.69 1.04 Allowed 'General case' 0 CA--C 1.536 0.415 0 C-N-CA 126.299 1.839 . . . . 2.0600000000000001 109.054 178.759 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . 0.536 HD12 ' HE3' ' A' ' 39' ' ' LYS . 3.0 tm? -77.39 -50.54 12.53 Favored 'General case' 0 N--CA 1.449 -0.522 0 C-N-CA 124.561 1.144 . . . . 1.21 110.127 171.809 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.0 m-20 -64.6 -37.15 86.58 Favored 'General case' 0 CA--C 1.538 0.515 0 O-C-N 121.426 -0.796 . . . . 5.0099999999999998 110.694 -162.999 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -58.59 -40.74 84.04 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.749 0.82 . . . . 4.0099999999999998 111.664 167.705 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.97 -49.66 77.02 Favored 'General case' 0 CA--C 1.529 0.169 0 N-CA-C 107.524 -1.287 . . . . 2.9500000000000002 107.524 173.789 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -49.57 -52.19 31.76 Favored 'General case' 0 C--O 1.226 -0.18 0 N-CA-C 109.183 -0.673 . . . . 2.3399999999999999 109.183 177.996 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 25.9 ttmt -55.0 -45.37 75.05 Favored 'General case' 0 CA--C 1.535 0.384 0 C-N-CA 122.395 0.278 . . . . 3.5099999999999998 110.651 177.178 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 6.8 t -60.57 -41.76 95.27 Favored 'General case' 0 CA--C 1.535 0.388 0 O-C-N 122.081 -0.387 . . . . 2.4399999999999999 111.776 179.717 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 6.5 mp -70.43 -53.15 17.59 Favored 'General case' 0 C--O 1.232 0.135 0 CA-C-N 118.515 0.598 . . . . 1.6899999999999999 110.042 177.959 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 41.5 t0 -73.44 75.5 1.42 Allowed 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 123.71 0.804 . . . . 2.0 109.342 179.079 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 25.8 m -50.34 -27.67 4.5 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.442 0 C-N-CA 124.211 1.004 . . . . 2.23 112.591 179.322 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 13.3 m120 -77.42 -30.74 53.6 Favored 'General case' 0 CA--C 1.529 0.16 0 O-C-N 121.933 -0.48 . . . . 2.3199999999999998 111.505 179.106 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 11.5 tt0 58.39 52.86 6.79 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 124.868 1.267 . . . . 4.6200000000000001 109.534 -163.382 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.6 p30 -108.98 -13.25 14.76 Favored 'General case' 0 CA--C 1.539 0.521 0 C-N-CA 126.676 1.991 . . . . 2.5699999999999998 112.617 -179.362 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 14.6 m 74.71 2.99 4.17 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 126.486 1.914 . . . . 2.27 114.161 -176.136 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 18.5 mt-10 -86.0 115.95 23.92 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 105.936 -1.876 . . . . 4.1299999999999999 105.936 152.949 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -82.27 84.28 7.15 Favored 'General case' 0 N--CA 1.447 -0.605 0 N-CA-C 102.576 -3.12 . . . . 1.4199999999999999 102.576 154.26 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -59.36 155.0 15.52 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 107.774 -1.195 . . . . 5.3799999999999999 107.774 177.727 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 1.3 t80 -39.83 -54.69 2.09 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 124.009 0.924 . . . . 5.2999999999999998 112.337 -175.685 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -65.08 -31.95 73.41 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 123.692 0.797 . . . . 3.0 113.041 -179.833 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -70.03 -60.95 1.98 Allowed 'General case' 0 C--O 1.233 0.191 0 N-CA-C 108.377 -0.972 . . . . 2.0099999999999998 108.377 174.712 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 60.2 t80 -49.64 -44.09 47.32 Favored 'General case' 0 CA--C 1.517 -0.303 0 C-N-CA 124.864 1.266 . . . . 3.0299999999999998 111.065 -178.588 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.408 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.6 OUTLIER -40.02 -40.79 1.11 Allowed 'General case' 0 N--CA 1.449 -0.491 0 CA-C-O 116.235 -1.841 . . . . 5.0800000000000001 110.125 178.977 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -41.76 -44.33 3.2 Favored 'General case' 0 C--O 1.217 -0.63 0 CA-C-N 121.758 2.072 . . . . 6.4500000000000002 111.85 -178.267 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . 0.478 ' O ' HD13 ' A' ' 83' ' ' LEU . 12.4 tp -53.3 -49.38 67.11 Favored 'General case' 0 CA--C 1.533 0.316 0 CA-C-N 119.502 1.046 . . . . 0.85999999999999999 111.371 179.663 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 60.7 mt -73.65 -37.4 49.41 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.226 0 C-N-CA 125.536 1.534 . . . . 1.71 108.1 -174.925 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -42.98 -58.32 3.76 Favored Glycine 0 N--CA 1.44 -1.036 0 N-CA-C 109.66 -1.376 . . . . 1.5600000000000001 109.66 165.165 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . 0.404 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 46.3 mm-40 -79.91 -36.05 37.0 Favored 'General case' 0 N--CA 1.443 -0.799 0 C-N-CA 127.607 2.363 . . . . 2.4199999999999999 110.153 -160.928 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.53 ' HG ' ' CD2' ' A' ' 49' ' ' LEU . 4.9 mp -39.19 -54.93 1.73 Allowed 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.938 0.895 . . . . 2.4500000000000002 110.252 170.014 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -61.13 -24.85 66.58 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 124.341 1.056 . . . . 1.04 113.449 -178.518 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.404 ' NZ ' ' OE1' ' A' ' 82' ' ' GLU . 16.7 ttpp -82.76 -50.59 8.52 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.731 1.213 . . . . 1.53 110.737 173.14 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.2 mm-40 -56.4 -40.18 74.23 Favored 'General case' 0 CA--C 1.52 -0.187 0 C-N-CA 125.666 1.586 . . . . 2.7599999999999998 111.852 -174.542 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 10.3 tt -44.68 -29.07 0.58 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.549 0 N-CA-C 113.291 0.849 . . . . 1.5 113.291 175.376 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 6.2 ptm180 -101.76 -63.01 1.19 Allowed 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 123.546 0.739 . . . . 4.4299999999999997 109.785 166.995 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -56.64 -29.84 62.67 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 113.892 1.071 . . . . 3.3799999999999999 113.892 -164.356 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.4 tppm? -52.5 -31.73 36.67 Favored 'General case' 0 CA--C 1.535 0.389 0 CA-C-N 119.013 0.824 . . . . 8.8800000000000008 112.586 -172.004 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 39.9 mmtt -137.69 -38.52 0.58 Allowed 'General case' 0 CA--C 1.531 0.218 0 N-CA-C 113.436 0.902 . . . . 8.3000000000000007 113.436 173.096 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER 17.4 68.16 0.02 OUTLIER 'General case' 0 CA--C 1.54 0.576 0 C-N-CA 126.791 2.036 . . . . 5.8799999999999999 116.359 -172.277 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 2.5 pt? -137.58 -46.76 0.55 Allowed 'General case' 0 N--CA 1.465 0.277 0 C-N-CA 123.703 0.801 . . . . 9.1899999999999995 110.613 169.391 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 17.4 mmtp -39.65 -58.76 1.25 Allowed 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.176 1.391 . . . . 14.08 111.436 178.569 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 5.0 pt -113.36 55.75 0.17 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.484 0 CA-C-O 123.592 1.663 . . . . 12.800000000000001 108.042 175.229 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . 2.287 0.0 OUTLIER -70.26 57.67 0.17 Allowed 'General case' 0 N--CA 1.451 -0.408 0 C-N-CA 129.716 3.206 . . . . 15.869999999999999 114.195 174.777 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -173.24 -50.8 0.01 OUTLIER 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 114.669 1.359 . . . . 14.630000000000001 114.669 -173.295 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 6.7 mmtp . . . . . 0 C--O 1.253 1.242 0 N-CA-C 114.149 1.166 . . . . 15.119999999999999 114.149 -166.03 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . 2.416 0.0 OUTLIER . . . . . 0 CA--C 1.544 0.733 0 N-CA-C 109.391 -0.596 . . . . 7.5700000000000003 109.391 . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.434 . . 101.4 -178.49 0.0 OUTLIER 'General case' 0 C--N 1.341 0.233 0 C-N-CA 124.724 1.209 . . . . 4.5 112.194 160.211 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 88.49 95.08 0.02 OUTLIER 'General case' 0 CA--C 1.537 0.472 0 C-N-CA 127.75 2.42 . . . . 4.6100000000000003 111.685 -177.394 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 46.1 mt-10 -132.58 148.19 68.58 Favored Pre-proline 0 CA--C 1.547 0.834 0 N-CA-C 104.871 -2.27 . . . . 6.8200000000000003 104.871 165.269 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -61.39 156.98 43.16 Favored 'Trans proline' 0 CA--C 1.537 0.641 0 C-N-CA 123.799 2.999 . . . . 2.7799999999999998 113.578 -168.165 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -168.56 172.58 8.03 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 118.72 -0.657 . . . . 2.6600000000000001 111.519 -149.029 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 5.2 t -90.54 -174.97 4.29 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 124.336 1.054 . . . . 2.1899999999999999 113.581 -173.65 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -46.77 -73.9 0.04 OUTLIER 'General case' 0 CA--C 1.534 0.34 0 C-N-CA 127.287 2.235 . . . . 3.2200000000000002 112.67 -172.872 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 25.9 mt -55.42 -37.67 67.97 Favored 'General case' 0 CA--C 1.532 0.258 0 O-C-N 121.236 -0.915 . . . . 1.22 111.297 179.359 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 78.3 mt-10 -59.76 -36.22 76.22 Favored 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 122.779 0.432 . . . . 3.6899999999999999 111.013 173.572 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 19.1 mt-10 -66.13 -46.99 75.58 Favored 'General case' 0 C--N 1.344 0.351 0 O-C-N 120.135 -1.603 . . . . 3.9900000000000002 109.155 172.077 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 8.4 t -56.27 -42.8 78.03 Favored 'General case' 0 N--CA 1.454 -0.267 0 C-N-CA 123.099 0.559 . . . . 1.3400000000000001 110.287 -175.778 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.263 2.5 pp -70.6 -42.7 78.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.244 0 O-C-N 121.622 -0.674 . . . . 0.96999999999999997 111.033 171.721 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 25.9 tt0 -54.71 -42.41 71.47 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 119.607 1.094 . . . . 4.3399999999999999 112.07 179.127 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 6.1 t -63.18 -31.6 72.79 Favored 'General case' 0 CA--C 1.54 0.577 0 O-C-N 121.109 -0.994 . . . . 1.23 112.096 -177.919 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 21.1 m -80.15 -36.76 16.91 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.164 0 O-C-N 120.899 -1.125 . . . . 0.95999999999999996 109.916 173.866 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 58.8 t -57.77 -45.0 87.1 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.204 0 C-N-CA 122.937 0.495 . . . . 1.1399999999999999 110.343 176.235 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 14.1 t -67.85 -40.42 83.67 Favored 'General case' 0 CA--C 1.535 0.393 0 CA-C-N 118.699 0.682 . . . . 1.27 110.729 177.988 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 51.5 m -55.64 -52.29 64.3 Favored 'General case' 0 C--N 1.343 0.322 0 CA-C-N 119.038 0.835 . . . . 1.1299999999999999 108.891 174.076 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.2 t80 -48.41 -55.63 10.31 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.229 1.411 . . . . 4.5199999999999996 111.318 171.887 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 1.7 t80 -56.33 -56.65 18.48 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 124.05 0.94 . . . . 3.0899999999999999 109.554 -175.262 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 36.7 p -61.61 -44.79 96.35 Favored 'General case' 0 CA--C 1.532 0.288 0 C-N-CA 123.256 0.622 . . . . 2.3199999999999998 110.705 -177.576 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 2.6 t80 -57.64 -61.38 2.55 Favored 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 124.533 1.133 . . . . 5.4299999999999997 111.008 177.376 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -59.8 -19.6 51.65 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 126.668 1.987 . . . . 1.22 111.678 176.656 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . 2.318 0.0 OUTLIER -46.68 -19.1 0.08 Allowed 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 127.956 2.502 . . . . 5.2400000000000002 113.481 162.368 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . . . . . . . . . 1.7 tp-100 -52.07 -64.06 0.94 Allowed 'General case' 0 CA--C 1.536 0.411 0 N-CA-C 114.101 1.149 . . . . 2.1899999999999999 114.101 -175.838 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 9.5 mt-10 -73.68 -31.6 63.52 Favored 'General case' 0 CA--C 1.534 0.333 0 N-CA-C 116.512 2.041 . . . . 5.3499999999999996 116.512 -154.63 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.22 -111.35 0.43 Allowed Glycine 0 CA--C 1.53 1.013 1 C-N-CA 132.384 4.802 . . . . 3.98 116.075 9.579 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 49.5 ttt85 53.75 98.49 0.01 OUTLIER 'General case' 0 C--O 1.237 0.4 0 C-N-CA 126.512 1.925 . . . . 4.29 112.25 -175.9 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -64.32 -39.24 93.51 Favored 'General case' 0 N--CA 1.453 -0.307 0 CA-C-O 121.061 0.458 . . . . 5.0899999999999999 111.109 177.329 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -75.06 2.33 10.9 Favored 'General case' 0 C--O 1.235 0.342 0 N-CA-C 113.109 0.781 . . . . 3.9300000000000002 113.109 -171.02 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 1.6 m -154.93 144.21 21.15 Favored 'General case' 0 C--O 1.24 0.587 0 CA-C-N 118.956 0.798 . . . . 2.8100000000000001 110.657 -177.309 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . 0.428 HD13 ' CG ' ' B' ' 76' ' ' TYR . 4.8 mp -131.64 141.31 49.59 Favored 'General case' 0 N--CA 1.455 -0.211 0 C-N-CA 124.164 0.985 . . . . 2.7799999999999998 108.932 178.645 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 8.2 t -108.67 177.24 4.84 Favored 'General case' 0 C--O 1.235 0.333 0 CA-C-O 121.662 0.744 . . . . 3.02 109.773 168.628 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 10.3 p -84.44 53.77 0.11 Allowed 'Isoleucine or valine' 0 CA--C 1.528 0.118 0 CA-C-O 122.283 1.039 . . . . 2.5099999999999998 109.878 177.044 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -155.99 54.33 0.58 Allowed 'General case' 0 N--CA 1.447 -0.581 0 N-CA-C 104.825 -2.287 . . . . 3.1499999999999999 104.825 149.387 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . . . . . . . . . 14.7 tt0 -163.56 -60.42 0.04 OUTLIER 'General case' 0 N--CA 1.442 -0.826 0 N-CA-C 102.403 -3.184 . . . . 2.3300000000000001 102.403 175.882 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 28.2 t80 -41.26 -58.08 1.93 Allowed 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.53 1.132 . . . . 2.9399999999999999 113.602 -179.129 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 11.9 ttmm -54.78 -30.55 57.1 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 123.456 0.702 . . . . 2.5699999999999998 112.42 -179.277 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 74.3 mt-10 -65.0 -25.5 67.89 Favored 'General case' 0 N--CA 1.449 -0.502 0 O-C-N 121.083 -1.011 . . . . 3.04 110.898 -173.707 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 3.1 tm? -67.69 -49.54 62.23 Favored 'General case' 0 C--O 1.233 0.211 0 CA-C-N 119.27 0.941 . . . . 2.6200000000000001 108.92 179.272 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 15.3 m -66.67 -38.16 81.01 Favored 'Isoleucine or valine' 0 N--CA 1.454 -0.243 0 CA-C-N 115.337 -0.847 . . . . 0.80000000000000004 109.142 -175.704 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 72.5 m -63.53 -54.37 37.31 Favored 'General case' 0 N--CA 1.449 -0.524 0 C-N-CA 123.767 0.827 . . . . 0.96999999999999997 111.323 175.503 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 22.4 tt0 -80.79 -62.33 1.7 Allowed 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 112.199 0.444 . . . . 2.25 112.199 -164.424 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -80.94 -43.72 19.32 Favored 'General case' 0 C--O 1.226 -0.148 0 O-C-N 122.144 -0.348 . . . . 2.48 110.687 -170.677 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 6.6 mp -81.71 -18.89 0.27 Allowed Pre-proline 0 CA--C 1.536 0.433 0 N-CA-C 119.171 3.026 . . . . 2.48 119.171 -161.523 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -52.05 89.56 0.03 OUTLIER 'Trans proline' 0 C--N 1.352 0.756 0 C-N-CA 123.396 2.731 . . . . 3.1200000000000001 114.104 -145.787 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 13.7 t-80 154.36 -65.06 0.0 OUTLIER 'General case' 0 N--CA 1.449 -0.516 0 C-N-CA 129.656 3.182 . . . . 3.9500000000000002 106.579 -175.098 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 52.7 tp -49.13 -73.37 0.04 OUTLIER 'General case' 0 C--O 1.235 0.304 0 C-N-CA 123.649 0.78 . . . . 1.0700000000000001 109.445 -164.801 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.3 mt -74.01 131.85 41.78 Favored 'General case' 0 N--CA 1.444 -0.756 0 N-CA-C 106.002 -1.851 . . . . 2.02 106.002 147.029 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -123.49 168.46 12.55 Favored 'General case' 0 N--CA 1.445 -0.723 0 N-CA-C 104.333 -2.469 . . . . 6.5599999999999996 104.333 167.864 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . 0.408 ' OD2' ' NZ ' ' B' ' 59' ' ' LYS . 8.8 t0 61.3 84.21 0.14 Allowed 'General case' 0 N--CA 1.451 -0.382 0 O-C-N 124.493 1.12 . . . . 3.5600000000000001 108.349 -152.599 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 27.3 m -89.13 4.15 5.41 Favored 'Isoleucine or valine' 0 N--CA 1.447 -0.596 0 CA-C-N 114.061 -1.427 . . . . 1.6299999999999999 109.712 165.649 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -88.79 -71.48 1.27 Allowed Glycine 0 C--N 1.341 0.854 0 N-CA-C 108.215 -1.954 . . . . 2.3500000000000001 108.215 -173.55 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 1.5 t -77.01 64.17 2.44 Favored 'General case' 0 CA--C 1.528 0.096 0 C-N-CA 125.518 1.527 . . . . 2.6099999999999999 107.671 177.583 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -75.25 -27.74 59.59 Favored 'General case' 0 N--CA 1.44 -0.946 0 C-N-CA 126.35 1.86 . . . . 0.98999999999999999 108.845 178.235 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 14.3 p-10 -42.24 -48.84 4.98 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 126.256 1.822 . . . . 4.3300000000000001 112.143 170.336 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -45.87 -54.4 8.2 Favored 'General case' 0 CA--C 1.534 0.327 0 C-N-CA 125.369 1.468 . . . . 3.2599999999999998 110.723 174.872 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . 0.455 ' H ' ' HE2' ' B' ' 59' ' ' LYS . 1.6 mppt? -67.93 -55.51 12.48 Favored 'General case' 0 N--CA 1.449 -0.488 0 N-CA-C 107.363 -1.347 . . . . 3.9300000000000002 107.363 -177.912 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 2.0 tmt? -40.87 -56.17 2.29 Favored 'General case' 0 C--O 1.225 -0.191 0 C-N-CA 125.207 1.403 . . . . 2.02 110.966 -179.973 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -61.27 -42.04 97.96 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 117.8 0.273 . . . . 2.77 111.404 -179.994 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 21.4 m -59.44 -32.1 69.9 Favored 'General case' 0 CA--C 1.535 0.376 0 N-CA-C 112.065 0.394 . . . . 1.51 112.065 176.871 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 6.1 mp -76.65 -57.2 3.99 Favored 'General case' 0 CA--C 1.531 0.246 0 CA-C-N 118.463 0.574 . . . . 2.1200000000000001 111.076 172.134 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 31.6 t0 -59.63 -16.19 24.32 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 126.348 1.859 . . . . 1.74 113.557 -162.397 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.7 m -32.01 -26.33 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 129.848 3.259 . . . . 1.51 119.007 -132.885 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 16.7 p30 -54.3 -31.32 53.77 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-N 120.497 1.499 . . . . 2.5099999999999998 111.314 159.025 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 8.7 tt0 70.57 68.89 0.2 Allowed 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 124.814 1.246 . . . . 2.9500000000000002 111.077 166.44 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 41.5 p30 -121.14 -7.23 9.4 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.845 1.258 . . . . 1.8899999999999999 112.497 -177.816 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 18.8 m 72.13 15.48 5.46 Favored 'General case' 0 CA--C 1.534 0.353 0 C-N-CA 125.239 1.415 . . . . 2.1400000000000001 112.789 -176.567 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 23.0 tt0 -115.76 106.19 13.57 Favored 'General case' 0 N--CA 1.449 -0.515 0 C-N-CA 127.152 2.181 . . . . 3.9399999999999999 107.386 164.778 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -83.49 90.12 7.17 Favored 'General case' 0 N--CA 1.449 -0.508 0 N-CA-C 106.505 -1.665 . . . . 0.97999999999999998 106.505 167.004 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 31.3 pttt -84.75 174.2 10.08 Favored 'General case' 0 N--CA 1.466 0.371 0 C-N-CA 124.049 0.94 . . . . 4.2300000000000004 111.37 179.078 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 23.3 p90 -84.67 49.35 1.69 Allowed 'General case' 0 CA--C 1.543 0.684 0 N-CA-C 113.75 1.019 . . . . 5.5099999999999998 113.75 -168.424 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 35.5 t30 -172.03 58.36 0.03 OUTLIER 'General case' 0 C--N 1.331 -0.232 0 C-N-CA 125.529 1.531 . . . . 2.9500000000000002 108.866 116.96 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 70.6 mt-10 -87.11 -59.13 2.34 Favored 'General case' 0 N--CA 1.439 -1.0 0 N-CA-C 106.758 -1.571 . . . . 2.0499999999999998 106.758 124.182 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . 0.428 ' CG ' HD13 ' B' ' 33' ' ' LEU . 53.7 t80 -42.27 -50.94 4.92 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 125.51 1.524 . . . . 3.2200000000000002 115.044 -168.333 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.444 ' C ' ' CD1' ' B' ' 77' ' ' TRP . 0.0 OUTLIER -45.88 -35.39 4.5 Favored 'General case' 0 C--N 1.345 0.402 0 CA-C-O 117.918 -1.039 . . . . 4.6399999999999997 109.621 -177.835 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 8.0 mmt180 -35.77 -55.26 0.72 Allowed 'General case' 0 C--O 1.219 -0.541 0 CA-C-O 117.66 -1.162 . . . . 3.8900000000000001 111.087 -178.159 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 12.4 tp -48.31 -46.98 36.94 Favored 'General case' 0 CA--C 1.535 0.383 0 CA-C-N 120.276 1.398 . . . . 0.83999999999999997 112.203 -177.369 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 64.3 mt -72.87 -39.75 59.29 Favored 'Isoleucine or valine' 0 C--N 1.331 -0.203 0 C-N-CA 125.154 1.382 . . . . 1.8700000000000001 107.965 -176.965 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -45.93 -53.19 9.08 Favored Glycine 0 N--CA 1.446 -0.638 0 CA-C-O 122.908 1.282 . . . . 2.3300000000000001 110.864 170.254 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 9.5 mm-40 -75.3 -47.77 26.28 Favored 'General case' 0 N--CA 1.438 -1.029 0 C-N-CA 126.734 2.014 . . . . 3.4700000000000002 107.199 -166.847 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . . . . . . . . . 1.2 mp -38.85 -47.15 1.38 Allowed 'General case' 0 C--N 1.34 0.171 0 C-N-CA 125.305 1.442 . . . . 2.0899999999999999 111.138 172.929 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -45.61 -46.16 14.22 Favored 'General case' 0 N--CA 1.452 -0.331 0 CA-C-O 118.448 -0.787 . . . . 1.76 111.379 178.548 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.453 0.0 OUTLIER -83.74 -34.72 24.8 Favored 'General case' 0 CA--C 1.539 0.527 0 N-CA-C 116.285 1.957 . . . . 2.0099999999999998 116.285 166.033 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 18.0 mm-40 -59.45 -18.92 43.59 Favored 'General case' 0 N--CA 1.469 0.48 0 CA-C-N 121.215 1.825 . . . . 3.8500000000000001 113.052 -176.593 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 6.9 tp -41.51 -51.54 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.855 0 O-C-N 121.894 -0.504 . . . . 1.76 110.732 163.468 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 13.2 ptm180 -86.22 -48.69 8.33 Favored 'General case' 0 CA--C 1.539 0.555 0 C-N-CA 125.681 1.593 . . . . 4.4000000000000004 113.441 171.137 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 46.2 tttp -79.94 138.41 37.09 Favored 'General case' 0 CA--C 1.537 0.475 0 C-N-CA 124.476 1.11 . . . . 4.3200000000000003 111.991 -163.853 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -85.03 -60.65 1.98 Allowed 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 123.298 0.639 . . . . 6.46 111.669 176.512 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 31.6 ttmt -172.94 32.68 0.01 OUTLIER 'General case' 0 N--CA 1.47 0.563 0 C-N-CA 126.169 1.788 . . . . 8.6500000000000004 109.242 -177.345 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER -92.8 47.0 1.26 Allowed 'General case' 0 N--CA 1.453 -0.325 0 O-C-N 121.024 -1.047 . . . . 5.0999999999999996 108.801 -160.111 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . 0.464 ' CG ' ' H ' ' B' ' 94' ' ' LYS . 0.3 OUTLIER -106.22 -96.24 0.35 Allowed 'General case' 0 CA--C 1.528 0.115 0 C-N-CA 125.65 1.58 . . . . 5.1900000000000004 109.19 -173.873 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . 0.464 ' H ' ' CG ' ' B' ' 93' ' ' LEU . 1.9 mptp? 61.35 -147.35 0.42 Allowed 'General case' 0 CA--C 1.539 0.524 0 C-N-CA 125.143 1.377 . . . . 7.1399999999999997 108.617 -176.76 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 14.1 mt 49.2 68.21 0.13 Allowed 'Isoleucine or valine' 0 CA--C 1.538 0.493 0 C-N-CA 124.773 1.229 . . . . 7.8600000000000003 111.207 174.591 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 6.0 ppt_? -125.55 132.56 52.55 Favored 'General case' 0 N--CA 1.457 -0.111 0 C-N-CA 123.806 0.843 . . . . 8.7599999999999998 108.96 177.725 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 48.0 tttp -178.88 138.92 0.16 Allowed 'General case' 0 CA--C 1.532 0.26 0 C-N-CA 126.033 1.733 . . . . 7.8200000000000003 107.133 -178.058 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.252 1.22 0 N-CA-C 103.649 -2.723 . . . . 6.7999999999999998 103.649 147.362 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.6 ptt? . . . . . 0 N--CA 1.475 0.797 0 N-CA-C 110.364 -0.236 . . . . 8.5 110.364 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -178.15 170.64 1.78 Allowed 'General case' 0 N--CA 1.453 -0.303 0 C-N-CA 127.695 2.398 . . . . 4.4000000000000004 105.204 179.665 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 100.47 69.32 0.0 OUTLIER 'General case' 0 N--CA 1.451 -0.413 0 C-N-CA 128.844 2.858 . . . . 6.6100000000000003 110.192 179.633 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 1.6 pm0 -114.32 71.64 2.27 Favored Pre-proline 0 CA--C 1.539 0.547 0 C-N-CA 126.733 2.013 . . . . 5.7300000000000004 108.116 178.08 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 91.3 Cg_endo -72.71 88.34 0.91 Allowed 'Trans proline' 0 N--CA 1.453 -0.87 0 C-N-CA 122.814 2.343 . . . . 3.3900000000000001 110.066 -175.908 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 87.6 mt -64.3 137.02 57.7 Favored 'General case' 0 N--CA 1.45 -0.472 0 N-CA-C 107.36 -1.348 . . . . 1.4199999999999999 107.36 170.912 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 7.9 t -65.47 169.07 6.42 Favored 'General case' 0 N--CA 1.456 -0.133 0 N-CA-C 109.403 -0.591 . . . . 1.9399999999999999 109.403 176.72 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 46.1 tt0 -59.23 -48.28 82.22 Favored 'General case' 0 N--CA 1.453 -0.275 0 CA-C-O 121.586 0.708 . . . . 3.7000000000000002 109.561 -175.896 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 4.4 mp -57.98 -45.7 86.32 Favored 'General case' 0 N--CA 1.446 -0.634 0 CA-C-O 118.245 -0.883 . . . . 1.6399999999999999 110.267 -179.307 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 76.4 mt-10 -57.81 -53.33 59.48 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.09 0.956 . . . . 2.1200000000000001 111.34 174.824 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -56.84 -49.35 75.69 Favored 'General case' 0 CA--C 1.53 0.2 0 N-CA-C 108.827 -0.805 . . . . 5.1900000000000004 108.827 -176.1 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 70.7 p -68.81 -44.42 73.59 Favored 'General case' 0 N--CA 1.448 -0.541 0 CA-C-N 116.097 -0.501 . . . . 1.3300000000000001 110.994 -175.141 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.483 HG21 HD12 ' B' ' 83' ' ' LEU 0.257 2.5 pp -63.59 -36.94 78.25 Favored 'Isoleucine or valine' 0 N--CA 1.448 -0.574 0 C-N-CA 118.441 -1.304 . . . . 0.81000000000000005 109.809 176.797 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 13.4 tt0 -59.04 -50.37 74.35 Favored 'General case' 0 CA--C 1.535 0.379 0 CA-C-N 119.462 1.028 . . . . 3.2200000000000002 110.187 173.031 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.73 -38.34 78.16 Favored 'General case' 0 CA--C 1.542 0.641 0 CA-C-O 121.366 0.603 . . . . 1.29 111.921 -175.143 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 10.8 m -78.27 -36.98 21.56 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 O-C-N 120.54 -1.35 . . . . 0.77000000000000002 111.012 174.302 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 24.6 t -59.01 -41.89 84.63 Favored 'Isoleucine or valine' 0 N--CA 1.462 0.166 0 CA-C-N 119.427 1.012 . . . . 0.78000000000000003 110.481 177.359 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 12.6 t -65.22 -41.88 93.97 Favored 'General case' 0 CA--C 1.536 0.415 0 CA-C-N 119.015 0.825 . . . . 0.92000000000000004 110.466 176.604 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 22.4 m -61.98 -47.83 83.05 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 118.659 0.663 . . . . 0.92000000000000004 109.907 177.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 9.4 t80 -48.45 -56.77 7.36 Favored 'General case' 0 C--O 1.222 -0.359 0 C-N-CA 124.449 1.1 . . . . 3.1899999999999999 109.883 169.075 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 55.0 t80 -62.72 -45.44 92.75 Favored 'General case' 0 C--O 1.235 0.303 0 C-N-CA 123.338 0.655 . . . . 3.9500000000000002 111.737 -171.467 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 1.0 OUTLIER -62.24 -25.88 68.06 Favored 'General case' 0 CA--C 1.535 0.391 0 O-C-N 122.269 -0.269 . . . . 2.23 110.775 179.823 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -80.2 -39.64 28.79 Favored 'General case' 0 C--O 1.218 -0.59 0 CA-C-N 118.354 0.524 . . . . 2.5699999999999998 112.262 164.798 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -53.94 -37.67 64.1 Favored 'General case' 0 C--O 1.24 0.553 0 O-C-N 120.122 -1.611 . . . . 1.02 110.497 -174.747 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -66.58 -21.07 66.14 Favored 'General case' 0 N--CA 1.454 -0.26 0 C-N-CA 125.25 1.42 . . . . 4.8700000000000001 113.302 -179.841 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.0 -66.07 0.45 Allowed 'General case' 0 C--O 1.234 0.26 0 CA-C-N 119.849 1.204 . . . . 2.52 111.561 -168.713 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 26.1 mt-10 -123.39 151.82 42.19 Favored 'General case' 0 N--CA 1.448 -0.553 0 C-N-CA 127.148 2.179 . . . . 3.25 109.858 -168.333 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 41.63 62.54 1.89 Allowed Glycine 0 CA--C 1.523 0.589 0 C-N-CA 124.207 0.908 . . . . 2.0299999999999998 112.941 153.772 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . 0.457 10.7 mpt_? 85.54 112.1 0.05 OUTLIER 'General case' 0 CA--C 1.545 0.787 0 N-CA-C 114.558 1.318 . . . . 6.2000000000000002 114.558 175.757 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 63.3 pttt -67.14 49.87 0.04 OUTLIER 'General case' 0 CA--C 1.535 0.398 0 C-N-CA 128.605 2.762 . . . . 3.8399999999999999 114.522 -177.796 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -169.86 -54.46 0.02 OUTLIER 'General case' 0 C--N 1.333 -0.131 0 N-CA-C 108.626 -0.879 . . . . 4.3600000000000003 108.626 -165.294 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 1.4 p -82.71 131.19 35.21 Favored 'General case' 0 C--O 1.242 0.665 0 C-N-CA 127.403 2.281 . . . . 2.1499999999999999 107.72 175.907 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.9 mm? -97.97 129.64 44.86 Favored 'General case' 0 N--CA 1.453 -0.307 0 C-N-CA 123.297 0.639 . . . . 2.6000000000000001 109.606 -175.807 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 9.9 t -82.58 161.86 22.13 Favored 'General case' 0 N--CA 1.454 -0.243 0 C-N-CA 125.663 1.585 . . . . 2.8399999999999999 109.603 177.64 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 14.4 p -57.46 -39.71 70.35 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.291 0 CA-C-N 116.212 -0.449 . . . . 2.54 109.927 167.919 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 15.0 t30 -69.91 -57.14 5.39 Favored 'General case' 0 C--O 1.222 -0.368 0 CA-C-O 117.823 -1.084 . . . . 1.8400000000000001 108.977 -178.186 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 63.9 mt-10 -39.0 -49.61 1.72 Allowed 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 119.07 0.85 . . . . 1.77 112.12 169.91 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 5.6 t80 -57.71 -52.15 66.63 Favored 'General case' 0 N--CA 1.45 -0.471 0 O-C-N 122.011 -0.43 . . . . 2.6899999999999999 110.723 175.006 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 48.1 tttt -57.23 -38.13 73.3 Favored 'General case' 0 CA--C 1.535 0.373 0 O-C-N 121.715 -0.616 . . . . 2.5 111.261 -179.959 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 42.8 mm-40 -55.43 -34.91 64.86 Favored 'General case' 0 CA--C 1.533 0.32 0 CA-C-N 118.278 0.49 . . . . 2.96 111.376 177.193 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 2.9 tm? -65.07 -53.78 40.24 Favored 'General case' 0 C--O 1.235 0.3 0 N-CA-C 108.294 -1.002 . . . . 2.5800000000000001 108.294 -178.096 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 11.2 m -66.86 -40.91 86.9 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.286 0 CA-C-N 115.318 -0.856 . . . . 0.97999999999999998 109.71 -173.458 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 97.3 m -60.9 -53.74 53.59 Favored 'General case' 0 N--CA 1.449 -0.502 0 C-N-CA 124.288 1.035 . . . . 1.3200000000000001 110.533 176.001 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 23.3 tt0 -71.11 -48.0 54.79 Favored 'General case' 0 N--CA 1.452 -0.37 0 CA-C-O 119.188 -0.434 . . . . 2.3700000000000001 111.282 -170.128 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 23.1 mt-30 -154.21 85.85 1.15 Allowed 'General case' 0 C--N 1.34 0.166 0 CA-C-N 118.644 0.656 . . . . 4.9699999999999998 111.492 177.776 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 3.0 tp -157.62 59.02 1.59 Allowed Pre-proline 0 CA--C 1.543 0.696 0 CA-C-N 117.988 0.358 . . . . 1.8500000000000001 111.602 161.454 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_endo -65.85 -54.61 0.52 Allowed 'Trans proline' 0 N--CA 1.452 -0.965 0 C-N-CA 124.103 3.202 . . . . 2.3300000000000001 113.865 -166.394 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 5.4 t60 -107.66 41.31 1.54 Allowed 'General case' 0 N--CA 1.463 0.205 0 CA-C-N 119.295 0.952 . . . . 3.9500000000000002 110.066 -169.671 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.475 HD23 HD22 ' A' ' 83' ' ' LEU . 1.1 mp -126.31 -98.78 0.4 Allowed 'General case' 0 N--CA 1.449 -0.512 0 N-CA-C 106.727 -1.583 . . . . 1.6100000000000001 106.727 -178.416 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 87.6 mt -90.06 55.99 3.29 Favored 'General case' 0 N--CA 1.451 -0.38 0 O-C-N 121.119 -0.988 . . . . 2.6000000000000001 109.365 -168.183 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -60.72 157.57 14.49 Favored 'General case' 0 CA--C 1.535 0.372 0 CA-C-N 115.658 -0.701 . . . . 4.9199999999999999 110.925 -179.528 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 84.25 41.57 0.02 OUTLIER 'General case' 0 N--CA 1.467 0.398 0 C-N-CA 128.045 2.538 . . . . 4.5599999999999996 110.193 -170.01 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 33.3 m -72.4 26.29 0.02 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.605 0 C-N-CA 124.389 1.076 . . . . 2.23 113.556 -177.425 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -74.02 -76.85 0.67 Allowed Glycine 0 CA--C 1.522 0.478 0 N-CA-C 105.86 -2.896 . . . . 1.5 105.86 166.475 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 10.7 m -71.19 54.57 0.19 Allowed 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 127.276 2.23 . . . . 2.8399999999999999 112.114 176.955 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 2.7 tm? -57.04 -28.54 62.63 Favored 'General case' 0 N--CA 1.448 -0.54 0 C-N-CA 125.302 1.441 . . . . 1.1499999999999999 109.866 175.554 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -46.6 -33.43 4.16 Favored 'General case' 0 C--O 1.237 0.43 0 C-N-CA 125.121 1.368 . . . . 4.21 112.565 170.032 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 26.4 tt0 -50.19 -60.88 2.53 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 108.035 -1.098 . . . . 4.04 108.035 172.884 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -70.7 -38.81 73.69 Favored 'General case' 0 N--CA 1.442 -0.858 0 CA-C-N 115.059 -0.973 . . . . 3.7000000000000002 109.47 -172.969 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -49.64 -56.79 8.77 Favored 'General case' 0 CA--C 1.528 0.126 0 N-CA-C 109.389 -0.597 . . . . 1.3899999999999999 109.389 175.04 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 7.9 mtmp? -63.42 -36.53 84.05 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 111.549 0.203 . . . . 3.46 111.549 178.945 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 16.1 m -59.36 -32.53 70.2 Favored 'General case' 0 CA--C 1.537 0.473 0 O-C-N 121.821 -0.549 . . . . 1.95 112.45 174.063 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 17.7 mt -87.47 -51.67 5.79 Favored 'General case' 0 CA--C 1.53 0.203 0 C-N-CA 125.307 1.443 . . . . 1.53 111.679 -175.709 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 43.1 t0 -75.22 69.42 2.07 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.616 1.167 . . . . 1.52 109.83 -173.695 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 16.4 m -51.36 -42.71 28.26 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 124.47 1.108 . . . . 1.9199999999999999 113.711 -168.992 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 28.9 p-10 -84.22 -6.62 59.42 Favored 'General case' 0 CA--C 1.535 0.366 0 CA-C-N 118.273 0.488 . . . . 2.0299999999999998 112.245 -179.612 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . 0.306 0.0 OUTLIER 51.25 59.95 4.23 Favored 'General case' 0 N--CA 1.448 -0.557 0 C-N-CA 126.646 1.979 . . . . 4.4699999999999998 113.448 179.365 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 44.0 p30 -101.6 -9.39 21.0 Favored 'General case' 0 CA--C 1.538 0.5 0 C-N-CA 125.259 1.423 . . . . 1.8300000000000001 111.44 175.91 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . 0.295 15.7 p 80.9 -0.54 1.8 Allowed 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 127.751 2.42 . . . . 2.6299999999999999 114.234 -174.831 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 38.9 mt-10 -110.33 124.68 52.11 Favored 'General case' 0 N--CA 1.455 -0.189 0 C-N-CA 124.204 1.002 . . . . 3.0499999999999998 108.345 173.064 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.8 mm? -84.7 97.77 9.84 Favored 'General case' 0 N--CA 1.448 -0.547 0 N-CA-C 106.071 -1.825 . . . . 0.94999999999999996 106.071 168.084 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.3 pttt -69.65 162.8 26.95 Favored 'General case' 0 CA--C 1.535 0.377 0 CA-C-N 119.542 1.065 . . . . 6.1299999999999999 109.32 173.095 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 70.9 m-85 -38.46 -52.61 1.57 Allowed 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 124.695 1.198 . . . . 5.29 113.429 -173.051 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -65.08 -45.49 85.04 Favored 'General case' 0 CA--C 1.536 0.432 0 C-N-CA 122.858 0.463 . . . . 1.5 111.174 -179.212 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 54.4 mt-10 -60.0 -45.43 92.77 Favored 'General case' 0 N--CA 1.456 -0.173 0 N-CA-C 109.673 -0.492 . . . . 1.8899999999999999 109.673 178.915 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 39.5 t80 -66.01 -45.15 82.57 Favored 'General case' 0 N--CA 1.449 -0.481 0 CA-C-O 118.558 -0.734 . . . . 2.8500000000000001 110.458 177.581 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.53 ' CD1' ' C ' ' A' ' 77' ' ' TRP . 0.0 OUTLIER -42.8 -47.13 5.44 Favored 'General case' 0 C--N 1.347 0.457 0 CA-C-O 117.133 -1.413 . . . . 5.2699999999999996 107.239 173.499 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . 0.581 ' HB3' HH11 ' A' ' 78' ' ' ARG . 13.4 mtp-105 -39.16 -45.76 1.36 Allowed 'General case' 0 C--O 1.213 -0.829 0 CA-C-O 117.368 -1.301 . . . . 3.5800000000000001 111.364 -177.422 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 14.5 tp -45.12 -56.94 4.25 Favored 'General case' 0 C--O 1.222 -0.388 0 CA-C-N 120.226 1.375 . . . . 1.1000000000000001 112.319 174.526 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 1.7 mp -61.81 -40.69 87.88 Favored 'Isoleucine or valine' 0 C--N 1.332 -0.165 0 C-N-CA 126.949 2.1 . . . . 1.6200000000000001 107.761 179.636 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . . . . . . . . . . . -44.98 -54.89 6.66 Favored Glycine 0 CA--C 1.528 0.858 0 N-CA-C 109.761 -1.336 . . . . 2.1200000000000001 109.761 170.707 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 3.2 mm-40 -74.27 -38.9 63.3 Favored 'General case' 0 N--CA 1.441 -0.904 0 C-N-CA 127.266 2.226 . . . . 2.7000000000000002 107.727 -169.193 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.475 HD22 HD23 ' A' ' 49' ' ' LEU . 11.3 mt -52.85 -43.17 65.86 Favored 'General case' 0 CA--C 1.53 0.178 0 CA-C-N 119.365 0.984 . . . . 2.21 110.912 178.869 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.49 -25.0 59.09 Favored 'General case' 0 CA--C 1.539 0.542 0 N-CA-C 112.833 0.679 . . . . 1.6499999999999999 112.833 176.829 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 20.2 ttmt -83.78 -57.15 3.33 Favored 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 125.908 1.683 . . . . 1.5600000000000001 111.498 168.716 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 17.2 mm-40 -57.33 -26.34 60.79 Favored 'General case' 0 N--CA 1.465 0.306 0 O-C-N 120.826 -1.171 . . . . 3.8599999999999999 112.841 -175.604 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 9.0 tp -42.5 -33.24 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.292 0 C-N-CA 124.626 1.17 . . . . 1.9399999999999999 112.284 168.913 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -128.1 -5.7 5.53 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 124.122 0.969 . . . . 6.1500000000000004 112.785 174.39 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 26.8 tttp -101.74 7.7 41.78 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 119.666 1.121 . . . . 3.4100000000000001 113.424 176.233 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 2.0 tmmm? -35.01 -44.3 0.22 Allowed 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 127.167 2.187 . . . . 7.2400000000000002 116.029 -157.604 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 13.7 mttt -158.61 57.13 0.44 Allowed 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 119.148 0.886 . . . . 11.029999999999999 109.02 155.726 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -24.66 -68.79 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.609 0 C-N-CA 128.089 2.556 . . . . 5.8300000000000001 111.971 -178.601 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . 0.49 ' H ' HD23 ' A' ' 93' ' ' LEU . 2.4 pt? -53.48 -25.01 14.61 Favored 'General case' 0 N--CA 1.453 -0.291 0 C-N-CA 125.382 1.473 . . . . 10.27 114.192 -170.019 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -108.23 -59.71 1.82 Allowed 'General case' 0 C--O 1.234 0.278 0 CA-C-N 118.739 0.7 . . . . 12.34 109.776 172.87 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 36.0 mt -116.62 89.35 1.33 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 C-N-CA 124.173 0.989 . . . . 10.24 109.604 -166.728 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -72.33 88.01 1.16 Allowed 'General case' 0 CA--C 1.535 0.382 0 N-CA-C 108.86 -0.793 . . . . 12.390000000000001 108.86 166.959 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 19.8 ttmm -176.42 136.83 0.27 Allowed 'General case' 0 C--O 1.234 0.281 0 C-N-CA 127.67 2.388 . . . . 9.4199999999999999 104.629 176.58 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 13.3 ttmm . . . . . 0 C--O 1.253 1.28 0 CA-C-O 117.762 -1.114 . . . . 12.43 108.287 -131.02 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 92.5 mmm . . . . . 0 N--CA 1.475 0.815 0 N-CA-C 112.899 0.703 . . . . 5.9000000000000004 112.899 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . . . . -161.63 -145.15 0.1 Allowed 'General case' 0 C--O 1.224 -0.266 0 C-N-CA 124.802 1.241 . . . . 4.7999999999999998 107.811 -168.582 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 83.48 108.49 0.06 Allowed 'General case' 0 N--CA 1.444 -0.745 0 N-CA-C 116.522 2.045 . . . . 4.71 116.522 127.302 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 5.4 mt-10 111.58 132.81 0.0 OUTLIER Pre-proline 0 N--CA 1.471 0.596 0 C-N-CA 125.042 1.337 . . . . 6.5599999999999996 111.482 147.6 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 73.6 Cg_endo -66.69 170.31 12.82 Favored 'Trans proline' 0 C--N 1.351 0.667 0 C-N-CA 124.104 3.202 . . . . 2.5299999999999998 111.27 -178.752 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -170.34 169.09 7.76 Favored 'General case' 0 CA--C 1.546 0.806 0 CA-C-O 118.886 -0.578 . . . . 2.8999999999999999 110.338 -152.619 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 3.2 t -86.77 -171.88 3.73 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 124.334 1.054 . . . . 1.9199999999999999 113.149 -170.397 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 55.1 tt0 -55.16 -67.04 0.31 Allowed 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.786 1.634 . . . . 2.3300000000000001 112.837 -170.97 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 20.5 mt -53.13 -42.21 65.82 Favored 'General case' 0 CA--C 1.529 0.142 0 O-C-N 121.265 -0.897 . . . . 1.4199999999999999 111.32 176.234 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 86.5 mt-10 -57.45 -42.4 82.42 Favored 'General case' 0 CA--C 1.548 0.877 0 CA-C-O 119.454 -0.308 . . . . 3.1699999999999999 110.443 177.415 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 2.2 mm-40 -61.7 -49.58 75.9 Favored 'General case' 0 C--N 1.34 0.168 0 C-N-CA 124.536 1.134 . . . . 4.0300000000000002 110.148 175.066 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 76.0 p -67.33 -25.88 66.22 Favored 'General case' 0 CA--C 1.533 0.315 0 CA-C-O 118.895 -0.574 . . . . 1.55 112.151 -174.58 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.287 2.7 pp -80.32 -32.56 13.56 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 CA-C-N 119.219 0.918 . . . . 1.26 111.268 165.844 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 2.3 tm-20 -58.46 -53.42 58.47 Favored 'General case' 0 CA--C 1.533 0.299 0 CA-C-N 119.553 1.069 . . . . 2.9700000000000002 110.808 175.406 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 8.2 t -48.47 -45.13 36.31 Favored 'General case' 0 CA--C 1.543 0.682 0 CA-C-N 119.59 1.086 . . . . 1.1799999999999999 111.557 -174.013 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 33.3 m -69.96 -34.25 59.1 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.263 0 O-C-N 121.113 -0.992 . . . . 0.90000000000000002 111.577 177.917 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 59.1 t -63.14 -52.32 60.39 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.194 0 CA-C-N 118.883 0.765 . . . . 0.93999999999999995 110.224 173.353 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . . 8.9 t -60.72 -43.01 98.37 Favored 'General case' 0 CA--C 1.538 0.507 0 CA-C-N 119.547 1.067 . . . . 1.04 110.557 179.009 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 54.9 m -57.72 -49.23 77.22 Favored 'General case' 0 CA--C 1.539 0.535 0 O-C-N 121.388 -0.82 . . . . 1.0900000000000001 110.768 174.251 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 0.7 OUTLIER -48.68 -53.51 18.47 Favored 'General case' 0 CA--C 1.531 0.222 0 O-C-N 121.512 -0.742 . . . . 3.9100000000000001 110.191 170.209 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 49.9 t80 -59.32 -47.83 83.92 Favored 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 124.442 1.097 . . . . 2.54 110.969 -173.331 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 4.8 t -61.55 -47.43 85.58 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 119.876 -0.73 . . . . 2.6299999999999999 109.909 178.38 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 20.5 m-85 -59.2 -35.16 73.12 Favored 'General case' 0 N--CA 1.466 0.358 0 O-C-N 120.849 -1.157 . . . . 2.8700000000000001 111.828 173.584 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -65.11 -34.77 79.2 Favored 'General case' 0 N--CA 1.446 -0.651 0 O-C-N 120.926 -1.109 . . . . 1.02 109.601 -179.875 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.4 -18.53 64.79 Favored 'General case' 0 CA--C 1.519 -0.218 0 CA-C-O 117.566 -1.207 . . . . 4.0499999999999998 113.159 -177.86 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.4 ' HB3' ' HG3' ' B' ' 37' ' ' GLU . 0.7 OUTLIER -49.17 -66.73 0.35 Allowed 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 114.113 1.153 . . . . 2.1499999999999999 114.113 -155.921 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 58.5 mt-10 -92.54 -79.69 0.39 Allowed 'General case' 0 CA--C 1.535 0.372 0 N-CA-C 113.361 0.875 . . . . 3.2999999999999998 113.361 -172.762 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.79 170.61 30.89 Favored Glycine 0 C--N 1.34 0.764 0 C-N-CA 128.792 3.091 . . . . 1.8799999999999999 111.611 160.527 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 14.9 mmt85 46.69 96.85 0.01 OUTLIER 'General case' 0 C--O 1.241 0.621 0 C-N-CA 124.843 1.257 . . . . 3.5600000000000001 113.724 146.781 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -76.69 52.88 0.85 Allowed 'General case' 0 CA--C 1.542 0.638 0 C-N-CA 123.937 0.895 . . . . 3.5600000000000001 111.198 173.239 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 0.0 OUTLIER -147.59 -64.78 0.27 Allowed 'General case' 0 CA--C 1.52 -0.202 0 N-CA-C 105.256 -2.128 . . . . 4.0899999999999999 105.256 179.182 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 26.0 p -78.34 139.38 38.82 Favored 'General case' 0 N--CA 1.436 -1.161 0 CA-C-N 114.942 -1.026 . . . . 2.04 109.855 -178.533 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 3.8 mm? -89.82 128.42 36.16 Favored 'General case' 0 N--CA 1.447 -0.596 0 N-CA-C 106.883 -1.525 . . . . 2.6099999999999999 106.883 159.156 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 6.5 t -82.46 -170.13 2.79 Favored 'General case' 0 N--CA 1.448 -0.558 0 C-N-CA 125.37 1.468 . . . . 2.8599999999999999 108.496 163.707 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 85.1 t -67.03 -98.36 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.325 -0.5 0 C-N-CA 130.183 3.393 . . . . 2.6299999999999999 101.969 -174.113 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 3.9 t30 -71.7 77.92 0.84 Allowed 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 121.364 1.893 . . . . 2.6800000000000002 108.313 178.546 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.4 ' HG3' ' HB3' ' B' ' 26' ' ' GLN . 1.8 tt0 -163.3 -56.84 0.04 OUTLIER 'General case' 0 N--CA 1.444 -0.755 1 C-N-CA 132.155 4.182 . . . . 1.8 102.752 177.849 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 8.0 t80 -63.36 -52.78 60.29 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-N 115.061 -0.972 . . . . 2.0899999999999999 109.01 170.359 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 9.8 ttmm -55.95 -37.1 68.56 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 119.677 -0.809 . . . . 2.7799999999999998 110.333 -176.217 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 60.6 mt-10 -56.2 -38.03 70.44 Favored 'General case' 0 CA--C 1.533 0.307 0 N-CA-C 112.839 0.681 . . . . 2.7599999999999998 112.839 175.528 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 1.8 tm? -62.97 -51.66 65.99 Favored 'General case' 0 C--O 1.231 0.106 0 N-CA-C 108.083 -1.08 . . . . 2.5499999999999998 108.083 -178.784 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 12.6 m -68.85 -48.66 69.52 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.345 0 CA-C-N 115.861 -0.608 . . . . 0.70999999999999996 109.726 -172.913 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 47.1 m -53.64 -54.95 30.48 Favored 'General case' 0 N--CA 1.453 -0.323 0 C-N-CA 123.991 0.916 . . . . 0.92000000000000004 110.931 175.662 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -77.18 -56.4 4.6 Favored 'General case' 0 N--CA 1.451 -0.41 0 O-C-N 122.362 -0.211 . . . . 1.8999999999999999 110.745 -168.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 18.3 mm100 -80.91 -50.75 9.37 Favored 'General case' 0 N--CA 1.455 -0.197 0 N-CA-C 113.552 0.945 . . . . 3.0499999999999998 113.552 -164.97 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 9.6 mp -61.23 -21.28 0.74 Allowed Pre-proline 0 CA--C 1.536 0.413 0 N-CA-C 115.022 1.49 . . . . 2.2200000000000002 115.022 -157.014 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -62.98 -11.56 25.27 Favored 'Trans proline' 0 CA--C 1.543 0.975 0 C-N-CA 121.59 -2.254 . . . . 1.9399999999999999 111.467 -74.407 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 9.8 t60 -107.39 -37.01 6.34 Favored 'General case' 0 C--N 1.342 0.264 0 C-N-CA 125.512 1.525 . . . . 2.4900000000000002 110.993 -174.884 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . 0.452 ' CD2' HD13 ' B' ' 83' ' ' LEU . 28.5 tp -47.39 -46.3 25.96 Favored 'General case' 0 C--N 1.342 0.257 0 C-N-CA 124.313 1.045 . . . . 1.3999999999999999 111.765 -172.432 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 89.2 mt -108.27 131.05 55.1 Favored 'General case' 0 N--CA 1.451 -0.404 0 N-CA-C 105.696 -1.965 . . . . 1.74 105.696 153.641 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 12.9 ptpt -105.37 -175.09 2.69 Favored 'General case' 0 C--N 1.328 -0.345 0 C-N-CA 125.609 1.564 . . . . 5.7999999999999998 109.15 -178.403 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . 0.25 3.7 p30 44.5 47.25 8.32 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 125.227 1.411 . . . . 4.6299999999999999 110.917 178.731 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -52.85 -14.84 0.6 Allowed 'Isoleucine or valine' 0 N--CA 1.452 -0.34 0 C-N-CA 128.082 2.553 . . . . 2.8399999999999999 113.589 -178.587 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -48.61 -59.58 6.51 Favored Glycine 0 CA--C 1.531 1.063 0 N-CA-C 110.197 -1.161 . . . . 2.3500000000000001 110.197 162.835 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 23.2 t -73.97 39.49 0.11 Allowed 'General case' 0 CA--C 1.538 0.517 0 C-N-CA 128.212 2.605 . . . . 2.6499999999999999 113.15 -169.244 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 2.3 tm? -67.77 -31.66 71.7 Favored 'General case' 0 N--CA 1.446 -0.639 0 C-N-CA 125.786 1.634 . . . . 1.0900000000000001 110.131 -178.393 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -43.75 -52.64 6.45 Favored 'General case' 0 CA--C 1.532 0.277 0 C-N-CA 125.604 1.562 . . . . 4.3300000000000001 112.602 177.795 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -59.56 -40.43 87.3 Favored 'General case' 0 CA--C 1.535 0.386 0 CA-C-N 119.625 1.102 . . . . 4.1100000000000003 111.17 -176.308 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 10.6 mmpt? -62.05 -58.99 5.75 Favored 'General case' 0 N--CA 1.452 -0.364 0 N-CA-C 108.866 -0.791 . . . . 4.6600000000000001 108.866 172.12 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -44.48 -50.74 9.29 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-N 119.112 0.869 . . . . 1.6499999999999999 111.4 -179.118 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 10.9 tptp -55.3 -46.03 76.24 Favored 'General case' 0 CA--C 1.534 0.335 0 C-N-CA 124.284 1.033 . . . . 4.0800000000000001 111.333 177.052 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 20.0 m -71.79 -29.06 64.05 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 123.54 0.736 . . . . 1.4399999999999999 112.356 179.783 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 65.6 mt -81.3 -57.91 3.28 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 124.857 1.263 . . . . 1.2 111.212 -175.935 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . . 35.0 t0 -57.68 -10.96 1.8 Allowed 'General case' 0 CA--C 1.538 0.515 0 C-N-CA 126.797 2.039 . . . . 1.8400000000000001 115.773 -166.047 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 30.2 m -35.9 -25.84 0.01 OUTLIER 'Isoleucine or valine' 0 CA--C 1.535 0.385 0 C-N-CA 130.618 3.567 . . . . 1.8799999999999999 119.173 -130.92 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 21.6 p-10 -61.71 -24.62 66.91 Favored 'General case' 0 CA--C 1.536 0.428 0 CA-C-N 120.846 1.657 . . . . 3.3399999999999999 110.645 169.051 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 3.3 tp60 65.7 65.07 0.55 Allowed 'General case' 0 N--CA 1.45 -0.47 0 C-N-CA 126.711 2.005 . . . . 4.8499999999999996 112.047 176.067 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 35.7 p30 -109.48 -8.57 15.0 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 126.664 1.986 . . . . 2.3999999999999999 110.542 176.798 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 15.5 m 63.66 16.24 9.55 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.304 1.041 . . . . 1.8799999999999999 113.402 -170.384 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 16.0 mt-10 -108.62 101.08 10.26 Favored 'General case' 0 N--CA 1.449 -0.503 0 N-CA-C 105.861 -1.903 . . . . 3.1499999999999999 105.861 158.377 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -66.82 94.97 0.34 Allowed 'General case' 0 N--CA 1.456 -0.174 0 N-CA-C 105.026 -2.213 . . . . 1.54 105.026 166.482 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 46.5 tptt -83.14 162.42 21.3 Favored 'General case' 0 N--CA 1.454 -0.261 0 C-N-CA 122.999 0.519 . . . . 5.3600000000000003 111.007 -155.009 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 1.0 OUTLIER -83.11 64.4 7.65 Favored 'General case' 0 CA--C 1.534 0.357 0 N-CA-C 109.044 -0.725 . . . . 4.2199999999999998 109.044 162.413 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -163.97 51.67 0.14 Allowed 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 115.66 -2.416 . . . . 5.1900000000000004 113.303 82.397 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 82.5 mt-10 -85.85 -53.06 5.34 Favored 'General case' 0 CA--C 1.532 0.25 0 C-N-CA 126.855 2.062 . . . . 2.2400000000000002 108.213 153.035 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 28.5 t80 -40.9 -43.2 2.02 Favored 'General case' 0 C--N 1.343 0.315 0 C-N-CA 127.571 2.348 . . . . 3.5299999999999998 113.077 -169.523 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.512 ' C ' ' CD1' ' B' ' 77' ' ' TRP . 0.0 OUTLIER -39.09 -48.51 1.69 Allowed 'General case' 0 C--N 1.343 0.29 0 O-C-N 124.124 0.89 . . . . 4.54 109.078 178.031 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 30.6 mmt180 -38.8 -46.39 1.26 Allowed 'General case' 0 C--O 1.219 -0.529 0 C-N-CA 124.127 0.971 . . . . 4.9199999999999999 112.948 -168.477 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 5.4 tp -57.59 -46.24 84.27 Favored 'General case' 0 CA--C 1.532 0.281 0 CA-C-N 119.943 1.247 . . . . 0.85999999999999999 112.966 178.534 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 15.7 mt -66.04 -41.42 89.6 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.25 0 N-CA-C 106.95 -1.5 . . . . 2.02 106.95 177.596 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . . . . . . . . . . . -43.64 -56.6 4.89 Favored Glycine 0 N--CA 1.44 -1.064 0 N-CA-C 108.739 -1.744 . . . . 1.8 108.739 171.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 1.3 mt-10 -69.32 -61.66 1.7 Allowed 'General case' 0 N--CA 1.437 -1.117 0 C-N-CA 125.567 1.547 . . . . 2.2000000000000002 108.803 -171.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.483 HD12 HG21 ' A' ' 13' ' ' ILE . 4.5 pp -53.18 -29.92 34.54 Favored 'General case' 0 CA--C 1.536 0.435 0 N-CA-C 111.802 0.297 . . . . 1.95 111.802 -171.79 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -51.12 -48.22 61.8 Favored 'General case' 0 CA--C 1.534 0.342 0 N-CA-C 113.988 1.107 . . . . 1.51 113.988 169.148 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.27 0.0 OUTLIER -77.18 -39.8 47.59 Favored 'General case' 0 C--N 1.343 0.308 0 CA-C-N 119.781 1.173 . . . . 1.77 111.743 172.286 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -55.84 -34.01 65.02 Favored 'General case' 0 C--N 1.339 0.117 0 CA-C-O 118.36 -0.829 . . . . 2.9399999999999999 112.715 -166.37 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 10.0 tt -42.65 -45.75 1.16 Allowed 'Isoleucine or valine' 0 CA--C 1.534 0.344 0 CA-C-N 118.749 0.704 . . . . 0.93000000000000005 111.363 173.381 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 63.8 ttt-85 -83.67 -43.78 15.21 Favored 'General case' 0 N--CA 1.449 -0.504 0 C-N-CA 124.097 0.959 . . . . 3.8999999999999999 111.684 172.464 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 45.2 tttt -133.09 71.55 1.47 Allowed 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.682 1.364 . . . . 6.1799999999999997 114.682 -144.032 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -46.63 -31.15 2.68 Favored 'General case' 0 CA--C 1.545 0.786 0 N-CA-C 115.518 1.673 . . . . 6.0099999999999998 115.518 179.702 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -87.41 -41.69 13.38 Favored 'General case' 0 CA--C 1.539 0.541 0 O-C-N 120.79 -1.193 . . . . 9.9199999999999999 114.174 -161.405 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . . . . . . . . . 32.4 t0 -84.28 74.78 10.28 Favored 'General case' 0 CA--C 1.533 0.324 0 O-C-N 121.504 -0.747 . . . . 8.2799999999999994 110.989 -159.97 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -131.33 -50.77 1.01 Allowed 'General case' 0 CA--C 1.535 0.403 0 N-CA-C 113.314 0.857 . . . . 5.5999999999999996 113.314 176.704 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 43.2 mttp -80.26 77.84 6.98 Favored 'General case' 0 CA--C 1.533 0.308 0 O-C-N 121.213 -0.929 . . . . 7.7599999999999998 110.969 -170.055 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 7.8 tp -116.88 141.94 32.85 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 125.324 1.45 . . . . 8.75 109.879 173.93 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 31.0 ttp-105 -162.48 136.45 6.38 Favored 'General case' 0 CA--C 1.53 0.187 0 N-CA-C 107.293 -1.373 . . . . 7.9699999999999998 107.293 168.68 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 23.6 tptp -177.3 137.08 0.21 Allowed 'General case' 0 CA--C 1.53 0.183 0 C-N-CA 125.388 1.475 . . . . 8.2899999999999991 107.199 176.8 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 8.1 tmtt? . . . . . 0 C--O 1.252 1.218 0 CA-C-O 114.958 -2.448 . . . . 9.6999999999999993 104.789 -165.398 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.9 mtt . . . . . 0 N--CA 1.476 0.865 0 N-CA-C 106.789 -1.56 . . . . 7.8300000000000001 106.789 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -82.68 52.67 2.16 Favored 'General case' 0 N--CA 1.467 0.382 0 CA-C-N 119.931 1.241 . . . . 6.5800000000000001 112.227 -173.684 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . 28.1 -40.82 0.0 OUTLIER 'General case' 0 CA--C 1.54 0.576 1 C-N-CA 134.626 5.171 . . . . 4.3099999999999996 120.688 -175.003 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 166.88 81.01 0.02 OUTLIER Pre-proline 0 CA--C 1.541 0.618 0 C-N-CA 125.878 1.671 . . . . 5.4699999999999998 109.719 -170.919 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -66.87 142.33 62.37 Favored 'Trans proline' 0 N--CA 1.458 -0.59 0 C-N-CA 121.392 1.395 . . . . 2.23 108.662 171.335 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' LEU . . . . . . . . . . . . . 42.7 mt -111.6 -173.86 2.34 Favored 'General case' 0 CA--C 1.535 0.399 0 C-N-CA 123.562 0.745 . . . . 1.4099999999999999 110.086 -169.158 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' THR . . . . . . . . . . . . . 8.2 t -91.09 151.34 21.04 Favored 'General case' 0 CA--C 1.531 0.22 0 C-N-CA 123.331 0.652 . . . . 2.0099999999999998 110.202 -178.542 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 20.4 mt-10 -37.2 -54.52 1.02 Allowed 'General case' 0 C--N 1.339 0.134 0 C-N-CA 125.998 1.719 . . . . 2.1299999999999999 113.456 -177.353 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 32.1 mt -63.7 -47.32 81.65 Favored 'General case' 0 CA--C 1.533 0.319 0 CA-C-O 117.739 -1.125 . . . . 1.78 110.392 -175.857 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -48.21 -61.15 2.14 Favored 'General case' 0 CA--C 1.534 0.364 0 C-N-CA 124.713 1.205 . . . . 4.9699999999999998 110.392 170.044 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -48.7 -51.23 29.7 Favored 'General case' 0 N--CA 1.453 -0.314 0 C-N-CA 124.195 0.998 . . . . 3.77 109.318 -178.359 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 81.3 p -62.5 -48.42 79.63 Favored 'General case' 0 CA--C 1.537 0.467 0 N-CA-C 112.626 0.602 . . . . 1.72 112.626 179.783 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' ILE . . . . . 0.456 HG21 HD12 ' B' ' 83' ' ' LEU 0.309 2.7 pp -60.42 -41.66 88.27 Favored 'Isoleucine or valine' 0 C--N 1.344 0.362 0 CA-C-N 119.459 1.027 . . . . 0.95999999999999996 110.537 179.685 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' GLU . . . . . . . . . . . . . 2.7 tm-20 -60.41 -53.05 62.24 Favored 'General case' 0 N--CA 1.452 -0.372 0 C-N-CA 119.261 -0.976 . . . . 2.8700000000000001 109.234 173.962 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -53.62 -36.78 62.38 Favored 'General case' 0 CA--C 1.537 0.469 0 N-CA-C 112.81 0.67 . . . . 1.3300000000000001 112.81 -174.849 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' VAL . . . . . . . . . . . . . 16.3 m -78.52 -45.2 26.01 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.477 0 CA-C-N 119.311 0.96 . . . . 0.98999999999999999 111.156 172.8 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' VAL . . . . . . . . . . . . . 45.5 t -57.47 -40.75 76.39 Favored 'Isoleucine or valine' 0 C--O 1.223 -0.333 0 CA-C-O 118.553 -0.737 . . . . 1.02 110.834 -176.891 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' THR . . . . . . . . . . . . . 13.0 t -59.61 -48.05 83.2 Favored 'General case' 0 C--O 1.237 0.395 0 CA-C-N 119.729 1.15 . . . . 0.94999999999999996 110.335 176.027 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' THR . . . . . . . . . . . . . 2.7 m -53.19 -59.23 4.81 Favored 'General case' 0 C--N 1.344 0.335 0 N-CA-C 109.005 -0.739 . . . . 1.01 109.005 175.147 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 15.0 m-85 -59.11 -43.52 91.91 Favored 'General case' 0 C--O 1.222 -0.359 0 N-CA-C 112.052 0.39 . . . . 7.8899999999999997 112.052 -176.127 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 76.1 t80 -61.18 -53.97 50.25 Favored 'General case' 0 N--CA 1.456 -0.174 0 C-N-CA 125.515 1.526 . . . . 3.6899999999999999 110.409 -178.605 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 40.0 p -57.3 -50.51 72.69 Favored 'General case' 0 N--CA 1.455 -0.216 0 N-CA-C 109.074 -0.713 . . . . 2.3500000000000001 109.074 177.07 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -51.89 -47.04 64.75 Favored 'General case' 0 C--O 1.22 -0.485 0 CA-C-O 121.637 0.732 . . . . 3.1699999999999999 111.63 176.806 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' ALA . . . . . . . . . . . . . . . -60.65 -17.16 45.71 Favored 'General case' 0 N--CA 1.447 -0.617 0 C-N-CA 126.55 1.94 . . . . 1.1000000000000001 111.973 -178.041 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -64.01 -24.12 67.59 Favored 'General case' 0 N--CA 1.451 -0.385 0 CA-C-O 117.657 -1.163 . . . . 4.9100000000000001 111.351 171.598 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 1.2 tp60 -42.61 -62.45 0.98 Allowed 'General case' 0 C--N 1.346 0.431 0 C-N-CA 124.378 1.071 . . . . 2.1600000000000001 112.082 -174.056 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' GLU . . . . . . . . . . . . . 39.4 mt-10 -122.44 173.17 7.83 Favored 'General case' 0 N--CA 1.45 -0.471 0 C-N-CA 127.816 2.446 . . . . 2.5899999999999999 107.606 -177.271 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -22.36 133.33 0.01 OUTLIER Glycine 0 CA--C 1.533 1.201 0 C-N-CA 127.458 2.456 . . . . 1.3700000000000001 115.348 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' ARG . . . . . . . . . . . . . 38.1 mtt85 64.47 103.49 0.03 OUTLIER 'General case' 0 C--O 1.239 0.503 0 C-N-CA 125.319 1.448 . . . . 5.29 111.907 179.509 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -72.38 58.25 0.39 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.194 1.398 . . . . 5.04 112.015 173.424 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 57.4 p-10 -170.94 -45.97 0.02 OUTLIER 'General case' 0 C--N 1.33 -0.255 0 C-N-CA 126.109 1.764 . . . . 3.2000000000000002 108.61 170.391 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 12.5 m -84.16 139.87 32.13 Favored 'General case' 0 N--CA 1.444 -0.741 0 C-N-CA 125.152 1.381 . . . . 3.4199999999999999 109.639 -179.379 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -89.8 175.11 7.36 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 124.44 1.096 . . . . 1.97 108.563 -178.447 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 35.2 m -153.56 170.13 21.55 Favored 'General case' 0 C--N 1.329 -0.312 0 N-CA-C 105.845 -1.909 . . . . 2.9900000000000002 105.845 179.365 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 9.3 p -51.63 -57.75 3.01 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.413 0 CA-C-N 119.873 1.215 . . . . 2.3100000000000001 113.443 -167.001 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' ASN . . . . . . . . . . . . . 3.5 t30 -67.03 -47.26 71.97 Favored 'General case' 0 N--CA 1.454 -0.229 0 N-CA-C 109.907 -0.405 . . . . 1.7 109.907 -176.419 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 1.8 mt-10 -38.62 -51.54 1.64 Allowed 'General case' 0 C--O 1.231 0.12 0 C-N-CA 125.83 1.652 . . . . 1.8300000000000001 110.863 167.839 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -59.56 -58.05 10.27 Favored 'General case' 0 N--CA 1.443 -0.787 0 CA-C-N 115.431 -0.804 . . . . 3.3199999999999998 109.665 176.916 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 46.9 tttm -53.13 -47.45 68.67 Favored 'General case' 0 N--CA 1.449 -0.5 0 CA-C-O 118.849 -0.596 . . . . 3.1000000000000001 111.555 -175.106 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 66.4 mt-10 -51.36 -41.58 60.72 Favored 'General case' 0 CA--C 1.535 0.375 0 CA-C-N 118.378 0.535 . . . . 2.2799999999999998 110.986 175.795 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' LEU . . . . . . . . . . . . . 14.9 tp -64.96 -49.92 68.42 Favored 'General case' 0 C--O 1.232 0.141 0 CA-C-N 119.204 0.911 . . . . 2.6899999999999999 109.028 -174.876 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' VAL . . . . . . . . . . . . . 2.3 m -70.31 -46.52 71.09 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.192 0 CA-C-O 121.519 0.676 . . . . 1.05 109.215 -173.696 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.4 m -59.6 -49.29 78.33 Favored 'General case' 0 N--CA 1.447 -0.593 0 C-N-CA 123.79 0.836 . . . . 1.6200000000000001 109.941 179.877 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' GLN . . . . . . . . . . . . . 15.7 tt0 -81.11 -56.13 4.29 Favored 'General case' 0 CA--C 1.534 0.351 0 CA-C-O 118.914 -0.565 . . . . 4.1600000000000001 112.13 -171.527 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -113.01 39.43 2.55 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 119.223 0.92 . . . . 5.0800000000000001 113.44 -173.753 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' LEU . . . . . . . . . . . . . 4.1 tp -150.19 70.83 9.26 Favored Pre-proline 0 CA--C 1.536 0.43 0 CA-C-N 119.273 0.942 . . . . 1.8799999999999999 110.231 173.062 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 43.7 Cg_endo -67.08 -49.38 1.39 Allowed 'Trans proline' 0 N--CA 1.451 -1.017 0 C-N-CA 123.221 2.614 . . . . 1.8500000000000001 113.084 -165.067 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' HIS . . . . . . . . . . . . . 3.7 t-160 -120.24 -29.41 4.85 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 118.373 0.533 . . . . 3.0499999999999998 112.082 -167.27 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' LEU . . . . . 0.463 HD23 HD22 ' A' ' 83' ' ' LEU . 13.6 tp -45.43 -62.98 1.05 Allowed 'General case' 0 N--CA 1.451 -0.418 0 C-N-CA 124.241 1.017 . . . . 1.3 113.242 -170.065 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.3 mt -84.87 -64.13 1.21 Allowed 'General case' 0 N--CA 1.452 -0.351 0 N-CA-C 108.186 -1.042 . . . . 3.48 108.186 174.132 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' LYS . . . . . . . . . . . . . 17.5 tptm 68.59 157.65 0.14 Allowed 'General case' 0 N--CA 1.433 -1.307 0 C-N-CA 124.656 1.182 . . . . 6.6399999999999997 111.665 -170.284 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' ASP . . . . . . . . . . . . . 59.6 t0 50.13 68.69 0.71 Allowed 'General case' 0 N--CA 1.45 -0.428 0 CA-C-O 123.626 1.679 . . . . 4.5599999999999996 109.145 -147.739 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 34.7 m -82.64 29.91 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 CA-C-N 112.999 -1.91 . . . . 2.2000000000000002 109.893 160.484 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -101.85 -58.43 0.8 Allowed Glycine 0 C--N 1.341 0.823 0 N-CA-C 108.278 -1.929 . . . . 1.6499999999999999 108.278 172.834 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' SER . . . . . . . . . . . . . 7.1 t -74.1 57.14 0.63 Allowed 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 125.386 1.474 . . . . 2.1899999999999999 110.682 179.851 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -69.33 -42.53 75.19 Favored 'General case' 0 N--CA 1.439 -0.976 0 C-N-CA 124.035 0.934 . . . . 1.4299999999999999 109.528 -175.889 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . . . . . . . . . 1.2 m-20 -39.46 -50.31 2.12 Favored 'General case' 0 CA--C 1.53 0.181 0 C-N-CA 126.065 1.746 . . . . 4.25 112.961 -179.096 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -52.88 -52.47 57.36 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-O 121.596 0.712 . . . . 3.0699999999999998 110.291 176.618 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -67.59 -38.01 83.39 Favored 'General case' 0 N--CA 1.449 -0.499 0 C-N-CA 123.213 0.605 . . . . 3.3999999999999999 109.549 -177.346 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' MET . . . . . . . . . . . . . 1.9 tmt? -55.34 -49.84 71.2 Favored 'General case' 0 N--CA 1.455 -0.214 0 N-CA-C 109.506 -0.553 . . . . 1.49 109.506 174.095 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' LYS . . . . . . . . . . . . . 42.8 mtmt -64.52 -39.01 92.98 Favored 'General case' 0 CA--C 1.536 0.405 0 CA-C-N 117.933 0.333 . . . . 3.0800000000000001 111.353 177.04 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' SER . . . . . . . . . . . . . 15.8 m -58.06 -41.82 84.16 Favored 'General case' 0 CA--C 1.537 0.46 0 O-C-N 121.768 -0.583 . . . . 2.2999999999999998 111.072 174.978 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' LEU . . . . . . . . . . . . . 36.7 mt -70.0 -68.44 0.42 Allowed 'General case' 0 N--CA 1.451 -0.379 0 C-N-CA 123.881 0.872 . . . . 1.98 109.067 178.363 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 18.1 t70 -77.46 75.83 4.0 Favored 'General case' 0 N--CA 1.45 -0.455 0 C-N-CA 124.801 1.24 . . . . 1.79 110.069 -171.775 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 27.7 m -46.24 -35.96 2.51 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 124.718 1.207 . . . . 1.8700000000000001 113.625 -177.824 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' ASN . . . . . . . . . . . . . 1.5 p30 -84.95 -14.62 47.02 Favored 'General case' 0 N--CA 1.465 0.276 0 C-N-CA 124.707 1.203 . . . . 1.9299999999999999 112.879 -178.214 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 51.89 46.64 26.25 Favored 'General case' 0 CA--C 1.535 0.385 0 C-N-CA 125.028 1.331 . . . . 4.2699999999999996 110.805 -176.535 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' ASP . . . . . . . . . . . . . 35.1 p30 -86.38 -18.5 31.68 Favored 'General case' 0 CA--C 1.537 0.446 0 C-N-CA 123.666 0.787 . . . . 1.9299999999999999 109.909 168.168 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . . . . . . . . . 11.0 t 71.45 16.06 6.05 Favored 'General case' 0 C--O 1.234 0.254 0 C-N-CA 125.872 1.669 . . . . 2.7799999999999998 112.743 -178.886 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -120.84 104.92 10.23 Favored 'General case' 0 N--CA 1.447 -0.614 0 N-CA-C 105.76 -1.941 . . . . 3.8300000000000001 105.76 172.397 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -88.07 92.91 9.32 Favored 'General case' 0 N--CA 1.451 -0.398 0 N-CA-C 107.221 -1.399 . . . . 1.1899999999999999 107.221 -174.012 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . 0.41 ' NZ ' ' OD1' ' B' ' 92' ' ' ASP . 33.5 tttt -55.13 160.03 2.27 Favored 'General case' 0 CA--C 1.535 0.38 0 N-CA-C 108.878 -0.786 . . . . 6.0899999999999999 108.878 172.385 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' PHE . . . . . . . . . . . . . 6.0 t80 -39.77 -57.62 1.51 Allowed 'General case' 0 CA--C 1.536 0.428 0 C-N-CA 124.422 1.089 . . . . 5.3099999999999996 112.777 -178.75 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' ASN . . . . . . . . . . . . . 6.9 t30 -60.46 -38.25 83.58 Favored 'General case' 0 CA--C 1.535 0.391 0 C-N-CA 123.087 0.555 . . . . 1.8600000000000001 112.01 179.08 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' GLU . . . . . . . . . . . . . 55.0 mt-10 -66.77 -50.55 62.34 Favored 'General case' 0 N--CA 1.453 -0.277 0 N-CA-C 109.822 -0.436 . . . . 2.1400000000000001 109.822 -178.024 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' TYR . . . . . . . . . . . . . 0.5 OUTLIER -58.88 -43.98 91.03 Favored 'General case' 0 N--CA 1.465 0.279 0 C-N-CA 119.818 -0.753 . . . . 6.7699999999999996 109.628 175.778 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' TRP . . . . . 0.611 ' CZ2' ' CE2' ' B' ' 77' ' ' TRP . 3.8 t-105 -48.5 -34.04 10.53 Favored 'General case' 0 N--CA 1.449 -0.48 0 CA-C-O 117.714 -1.136 . . . . 3.8900000000000001 112.019 -177.142 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' ARG . . . . . . . . . . . . . 62.7 mtp85 -39.25 -47.49 1.68 Allowed 'General case' 0 N--CA 1.475 0.791 0 CA-C-N 119.726 1.148 . . . . 3.8799999999999999 111.549 174.072 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' LEU . . . . . . . . . . . . . 13.1 tp -45.66 -47.45 15.0 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 123.408 0.683 . . . . 1.0800000000000001 111.164 179.208 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' ILE . . . . . . . . . . . . . 3.8 mp -64.08 -21.37 28.73 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-O 120.874 0.368 . . . . 1.8799999999999999 110.265 -169.57 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' GLY . . . . . 0.541 ' N ' ' CZ2' ' B' ' 77' ' ' TRP . . . -76.67 -44.69 14.88 Favored Glycine 0 CA--C 1.496 -1.106 0 N-CA-C 109.012 -1.635 . . . . 1.5800000000000001 109.012 179.452 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' GLU . . . . . . . . . . . . . 2.8 mm-40 -63.98 -43.23 96.36 Favored 'General case' 0 N--CA 1.429 -1.488 0 N-CA-C 105.802 -1.925 . . . . 2.6400000000000001 105.802 -179.53 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' LEU . . . . . 0.463 HD22 HD23 ' A' ' 49' ' ' LEU . 5.5 mt -54.62 -60.28 3.56 Favored 'General case' 0 CA--C 1.54 0.58 0 O-C-N 121.447 -0.783 . . . . 2.7799999999999998 111.71 171.094 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' ALA . . . . . . . . . . . . . . . -57.7 -27.74 63.2 Favored 'General case' 0 CA--C 1.535 0.378 0 C-N-CA 124.281 1.032 . . . . 1.28 112.46 -176.908 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -80.53 -48.77 12.27 Favored 'General case' 0 N--CA 1.451 -0.385 0 C-N-CA 125.5 1.52 . . . . 1.95 110.054 177.202 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 -55.46 -45.67 76.88 Favored 'General case' 0 C--O 1.232 0.166 0 C-N-CA 126.038 1.735 . . . . 2.3700000000000001 110.694 -179.967 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' ILE . . . . . . . . . . . . . 7.0 tt -63.69 0.3 0.53 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.658 0 N-CA-C 113.271 0.841 . . . . 1.75 113.271 175.661 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.71 -59.54 1.82 Allowed 'General case' 0 C--O 1.236 0.367 0 O-C-N 120.552 -1.343 . . . . 7.7599999999999998 109.821 162.975 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.71 -44.15 64.66 Favored 'General case' 0 C--N 1.342 0.261 0 N-CA-C 114.339 1.237 . . . . 3.3599999999999999 114.339 -168.812 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' LYS . . . . . . . . . . . . . 12.2 ttpt -68.01 -18.29 64.67 Favored 'General case' 0 N--CA 1.466 0.362 0 CA-C-N 118.597 0.635 . . . . 8.0099999999999998 112.368 -159.689 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' LYS . . . . . . . . . . . . . 1.7 mtpm? -72.34 -74.44 0.16 Allowed 'General case' 0 N--CA 1.444 -0.758 0 C-N-CA 126.907 2.083 . . . . 11.67 111.544 -172.024 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' ASP . . . . . . . . . . . . . 8.8 m-20 -82.93 65.98 8.33 Favored 'General case' 0 N--CA 1.453 -0.288 0 C-N-CA 123.568 0.747 . . . . 8.3499999999999996 110.876 -157.321 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -139.06 -48.3 0.49 Allowed 'General case' 0 CA--C 1.53 0.184 0 C-N-CA 123.806 0.843 . . . . 7.6200000000000001 110.8 168.436 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -157.39 45.1 0.37 Allowed 'General case' 0 CA--C 1.532 0.264 0 CA-C-O 121.464 0.65 . . . . 10.619999999999999 111.885 176.076 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' ILE . . . . . . . . . . . . . 0.0 OUTLIER -154.7 155.97 5.49 Favored 'Isoleucine or valine' 0 CA--C 1.536 0.406 0 N-CA-C 104.697 -2.335 . . . . 10.75 104.697 166.144 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' ARG . . . . . . . . . . . . . 98.8 mtt180 -44.06 -72.67 0.05 Allowed 'General case' 0 CA--C 1.537 0.458 0 N-CA-C 113.504 0.927 . . . . 15.619999999999999 113.504 -160.847 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER 174.91 53.49 0.0 OUTLIER 'General case' 0 N--CA 1.468 0.439 0 C-N-CA 126.434 1.894 . . . . 9.7400000000000002 108.942 -177.015 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' LYS . . . . . . . . . . . . . 95.9 mttt . . . . . 0 C--O 1.251 1.183 0 C-N-CA 127.899 2.48 . . . . 12.66 105.852 -142.927 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 27.6 mmm . . . . . 0 C--O 1.236 0.383 0 CA-C-O 117.825 -1.083 . . . . 8.1199999999999992 109.767 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 2' ' ' ALA . . . . . . . . . . . . 2.329 . . -142.18 -174.82 4.21 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 130.944 3.698 . . . . 5.5099999999999998 108.918 -171.387 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 3' ' ' ALA . . . . . . . . . . . . . . . 88.73 87.12 0.02 OUTLIER 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 127.419 2.288 . . . . 6.5899999999999999 114.785 165.783 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 4' ' ' GLU . . . . . . . . . . . . . 3.9 mt-10 -179.76 161.68 0.9 Allowed Pre-proline 0 CA--C 1.544 0.719 0 C-N-CA 129.061 2.944 . . . . 6.6399999999999997 108.521 152.608 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 5' ' ' PRO . . . . . . . . . . . . . 47.2 Cg_endo -87.9 173.5 5.04 Favored 'Trans proline' 0 CA--C 1.535 0.525 0 C-N-CA 123.98 3.12 . . . . 2.71 111.391 -173.805 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 6' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -169.14 176.58 5.2 Favored 'General case' 0 CA--C 1.541 0.599 0 C-N-CA 125.24 1.416 . . . . 2.4399999999999999 109.088 -176.007 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 7' ' ' THR . . . . . . . . . . . . . 13.7 t -79.57 -176.62 5.4 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.875 0.87 . . . . 2.2200000000000002 111.828 -166.706 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 8' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -62.98 -67.58 0.41 Allowed 'General case' 0 CA--C 1.531 0.217 0 C-N-CA 123.491 0.716 . . . . 3.27 112.26 -165.278 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 9' ' ' LEU . . . . . . . . . . . . . 18.6 mt -50.07 -45.46 52.49 Favored 'General case' 0 CA--C 1.533 0.304 0 O-C-N 121.03 -1.044 . . . . 1.1599999999999999 111.244 176.139 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 10' ' ' GLU . . . . . . . . . . . . . 86.6 mt-10 -56.93 -37.46 71.52 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 124.252 1.021 . . . . 3.6899999999999999 111.686 177.123 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 11' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -74.72 -44.21 51.09 Favored 'General case' 0 C--O 1.226 -0.138 0 C-N-CA 124.195 0.998 . . . . 4.1900000000000004 109.241 179.521 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 12' ' ' SER . . . . . . . . . . . . . 25.7 t -57.39 -46.95 82.89 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 123.272 0.629 . . . . 1.7 110.07 -179.031 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 13' ' ' ILE . . . . . . . . . . . . 0.275 2.7 pp -65.98 -18.93 24.83 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 O-C-N 121.172 -0.955 . . . . 1.78 112.282 174.505 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 14' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -74.38 -56.17 5.16 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 119.751 1.16 . . . . 3.1699999999999999 110.639 167.496 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 3.1 t -47.48 -43.91 24.83 Favored 'General case' 0 CA--C 1.541 0.606 0 CA-C-N 120.051 1.296 . . . . 1.3799999999999999 111.422 -169.836 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 16' ' ' VAL . . . . . . . . . . . . . 15.4 m -69.36 -37.93 76.42 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.52 0 O-C-N 121.562 -0.711 . . . . 1.05 112.128 178.032 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 17' ' ' VAL . . . . . . . . . . . . . 45.9 t -63.65 -42.36 95.76 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.324 0 C-N-CA 124.133 0.973 . . . . 1.3200000000000001 109.585 175.011 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 18' ' ' THR . . . . . . . . . . . . 0.269 9.8 t -68.26 -36.9 80.14 Favored 'General case' 0 CA--C 1.54 0.57 0 O-C-N 120.774 -1.204 . . . . 1.3500000000000001 111.358 174.69 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 19' ' ' THR . . . . . . . . . . . . . 6.0 m -53.59 -57.52 10.45 Favored 'General case' 0 C--N 1.345 0.382 0 CA-C-N 120.705 1.593 . . . . 1.3999999999999999 109.248 169.632 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 20' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -41.59 -55.54 2.87 Favored 'General case' 0 CA--C 1.532 0.28 0 C-N-CA 124.269 1.028 . . . . 4.2599999999999998 110.539 172.503 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 21' ' ' PHE . . . . . . . . . . . . . 20.0 t80 -58.28 -53.21 60.81 Favored 'General case' 0 CA--C 1.53 0.174 0 C-N-CA 124.251 1.02 . . . . 2.3799999999999999 111.1 -174.624 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 40.3 p -56.1 -52.9 62.63 Favored 'General case' 0 CA--C 1.53 0.202 0 C-N-CA 122.729 0.411 . . . . 2.3100000000000001 110.893 -178.955 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 23' ' ' PHE . . . . . . . . . . . . . 40.2 m-85 -61.47 -47.8 84.01 Favored 'General case' 0 C--O 1.22 -0.463 0 CA-C-N 118.042 0.383 . . . . 2.8700000000000001 110.632 177.699 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -56.19 -29.55 61.04 Favored 'General case' 0 C--N 1.329 -0.289 0 C-N-CA 126.221 1.809 . . . . 0.98999999999999999 111.271 -176.176 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 25' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -62.16 -15.67 47.7 Favored 'General case' 0 N--CA 1.45 -0.463 0 CA-C-O 117.951 -1.023 . . . . 3.46 113.038 176.524 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 26' ' ' GLN . . . . . 0.412 ' CB ' ' HG2' ' B' ' 37' ' ' GLU . 1.1 tp-100 -58.13 -65.13 0.69 Allowed 'General case' 0 CA--C 1.537 0.474 0 N-CA-C 116.131 1.9 . . . . 1.98 116.131 -166.801 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 27' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 -88.02 -77.88 0.34 Allowed 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 118.371 0.532 . . . . 2.98 112.205 -163.199 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.39 164.9 25.94 Favored Glycine 0 C--N 1.339 0.728 0 C-N-CA 128.048 2.737 . . . . 1.8300000000000001 110.609 150.805 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 29' ' ' ARG . . . . . . . . . . . . . 17.9 mmt85 53.47 98.96 0.01 OUTLIER 'General case' 0 C--O 1.24 0.591 0 N-CA-C 115.326 1.602 . . . . 3.5499999999999998 115.326 135.565 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 30' ' ' LYS . . . . . . . . . . . . . 61.6 pttt -72.82 60.68 0.52 Allowed 'General case' 0 CA--C 1.535 0.383 0 C-N-CA 126.018 1.727 . . . . 3.3300000000000001 112.261 178.615 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 31' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -164.25 -61.24 0.04 OUTLIER 'General case' 0 N--CA 1.452 -0.368 0 N-CA-C 106.716 -1.587 . . . . 4.0199999999999996 106.716 -171.406 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 32' ' ' SER . . . . . . . . . . . . . 87.6 p -58.88 138.94 57.09 Favored 'General case' 0 N--CA 1.447 -0.623 0 CA-C-O 118.008 -0.996 . . . . 2.3199999999999998 109.938 168.774 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 33' ' ' LEU . . . . . . . . . . . . . 6.5 mp -102.08 101.45 11.81 Favored 'General case' 0 N--CA 1.455 -0.195 0 N-CA-C 108.248 -1.019 . . . . 2.4399999999999999 108.248 152.353 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 34' ' ' SER . . . . . . . . . . . . . 1.4 p -84.25 176.11 8.96 Favored 'General case' 0 CA--C 1.535 0.394 0 C-N-CA 124.684 1.194 . . . . 2.5099999999999998 108.521 168.841 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 35' ' ' VAL . . . . . . . . . . . . . 7.8 p -91.6 50.94 0.1 Allowed 'Isoleucine or valine' 0 CA--C 1.533 0.305 0 O-C-N 120.516 -1.365 . . . . 2.5499999999999998 111.492 -170.523 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 36' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -156.37 52.78 0.54 Allowed 'General case' 0 N--CA 1.452 -0.34 0 N-CA-C 106.376 -1.712 . . . . 2.6400000000000001 106.376 149.254 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 37' ' ' GLU . . . . . 0.412 ' HG2' ' CB ' ' B' ' 26' ' ' GLN . 91.8 mt-10 -158.68 -54.83 0.07 Allowed 'General case' 0 CA--C 1.52 -0.183 0 C-N-CA 130.915 3.686 . . . . 1.72 104.046 -178.099 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 38' ' ' PHE . . . . . . . . . . . . . 1.5 t80 -62.63 -57.64 10.34 Favored 'General case' 0 N--CA 1.445 -0.682 0 CA-C-N 114.801 -1.09 . . . . 2.1400000000000001 109.105 173.683 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 39' ' ' LYS . . . . . . . . . . . . . 34.9 tttt -59.13 -41.52 88.42 Favored 'General case' 0 CA--C 1.531 0.242 0 N-CA-C 110.061 -0.348 . . . . 2.7599999999999998 110.061 -175.334 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 40' ' ' GLU . . . . . . . . . . . . . 81.6 mt-10 -47.88 -41.94 25.55 Favored 'General case' 0 CA--C 1.535 0.399 0 N-CA-C 112.621 0.6 . . . . 3.54 112.621 170.549 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 41' ' ' LEU . . . . . . . . . . . . . 5.0 tp -63.24 -52.4 62.29 Favored 'General case' 0 C--O 1.231 0.122 0 CA-C-N 119.115 0.871 . . . . 1.9399999999999999 108.807 -175.018 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 42' ' ' VAL . . . . . . . . . . . . . 3.3 m -68.51 -48.52 71.9 Favored 'Isoleucine or valine' 0 N--CA 1.452 -0.373 0 CA-C-N 115.436 -0.802 . . . . 0.63 109.242 -173.307 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 43' ' ' THR . . . . . . . . . . . . . 68.2 m -56.67 -54.87 41.09 Favored 'General case' 0 N--CA 1.447 -0.592 0 C-N-CA 123.909 0.884 . . . . 0.87 111.178 177.34 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 44' ' ' GLN . . . . . . . . . . . . . 16.2 tt0 -80.68 -59.38 2.7 Favored 'General case' 0 N--CA 1.452 -0.367 0 CA-C-N 117.792 0.269 . . . . 2.48 111.627 -170.375 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 45' ' ' GLN . . . . . . . . . . . . . 4.7 tp60 -81.3 -48.51 11.9 Favored 'General case' 0 N--CA 1.456 -0.136 0 N-CA-C 112.404 0.52 . . . . 3.1099999999999999 112.404 -160.075 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 46' ' ' LEU . . . . . . . . . . . . . 11.1 mp -64.77 -24.43 1.21 Allowed Pre-proline 0 CA--C 1.534 0.361 0 N-CA-C 113.727 1.01 . . . . 2.3700000000000001 113.727 -164.178 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 47' ' ' PRO . . . . . . . . . . . . . 18.0 Cg_endo -61.79 -10.72 18.0 Favored 'Trans proline' 0 CA--C 1.543 0.932 0 C-N-CA 122.027 -2.072 . . . . 1.6399999999999999 112.365 -82.837 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 48' ' ' HIS . . . . . . . . . . . . . 70.1 t60 -95.98 -34.95 11.59 Favored 'General case' 0 N--CA 1.452 -0.367 0 C-N-CA 125.02 1.328 . . . . 2.52 111.15 179.761 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 49' ' ' LEU . . . . . . . . . . . . . 33.5 tp -55.08 -66.6 0.38 Allowed 'General case' 0 C--O 1.236 0.343 0 CA-C-N 119.014 0.824 . . . . 1.03 110.313 -169.078 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 50' ' ' LEU . . . . . . . . . . . . . 80.3 mt -92.14 156.33 17.42 Favored 'General case' 0 N--CA 1.453 -0.307 0 N-CA-C 105.984 -1.858 . . . . 2.0600000000000001 105.984 152.186 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 51' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -153.45 -166.19 2.35 Favored 'General case' 0 N--CA 1.451 -0.382 0 N-CA-C 106.42 -1.696 . . . . 6.0599999999999996 106.42 -170.945 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 52' ' ' ASP . . . . . . . . . . . . . 44.0 m-20 57.53 33.38 23.19 Favored 'General case' 0 CA--C 1.532 0.278 0 CA-C-O 122.651 1.215 . . . . 4.7000000000000002 109.456 -177.356 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 53' ' ' VAL . . . . . . . . . . . . . 21.1 m -56.71 -29.98 31.33 Favored 'Isoleucine or valine' 0 N--CA 1.453 -0.304 0 C-N-CA 125.756 1.622 . . . . 1.99 111.328 -166.564 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 54' ' ' GLY . . . . . . . . . . . . . . . -41.78 -46.38 4.87 Favored Glycine 0 CA--C 1.529 0.93 0 C-N-CA 123.688 0.661 . . . . 2.9300000000000002 111.737 172.869 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 55' ' ' SER . . . . . . . . . . . . . 2.4 t -93.7 19.72 8.35 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 123.626 0.77 . . . . 2.6800000000000002 112.48 -174.389 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 56' ' ' LEU . . . . . . . . . . . . . 1.9 tm? -42.65 -41.65 3.18 Favored 'General case' 0 C--N 1.343 0.319 0 C-N-CA 124.313 1.045 . . . . 1.0700000000000001 111.201 178.693 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 57' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -34.58 -44.54 0.21 Allowed 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 127.05 2.14 . . . . 4.2199999999999998 113.722 173.569 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 58' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -65.11 -43.16 92.91 Favored 'General case' 0 CA--C 1.533 0.297 0 O-C-N 121.001 -1.062 . . . . 3.6699999999999999 110.844 178.074 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 59' ' ' LYS . . . . . . . . . . . . . 5.0 mmpt? -65.67 -44.94 84.75 Favored 'General case' 0 N--CA 1.447 -0.597 0 CA-C-O 118.539 -0.743 . . . . 4.2300000000000004 109.283 177.431 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 60' ' ' MET . . . . . . . . . . . . . 1.8 tmt? -47.15 -53.55 12.71 Favored 'General case' 0 CA--C 1.529 0.152 0 CA-C-N 119.196 0.907 . . . . 1.8899999999999999 109.651 170.628 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 61' ' ' LYS . . . . . . . . . . . . . 39.4 mttm -61.38 -39.26 90.0 Favored 'General case' 0 CA--C 1.535 0.374 0 O-C-N 122.182 -0.324 . . . . 3.6299999999999999 111.568 -178.531 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 62' ' ' SER . . . . . . . . . . . . . 32.4 t -61.52 -41.96 98.1 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 123.846 0.859 . . . . 1.5600000000000001 111.754 173.852 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 63' ' ' LEU . . . . . . . . . . . . . 33.9 mt -77.94 -53.52 7.36 Favored 'General case' 0 C--N 1.331 -0.197 0 C-N-CA 124.305 1.042 . . . . 1.51 110.254 -171.606 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 64' ' ' ASP . . . . . . . . . . . . 0.256 17.9 t0 -59.41 -8.88 1.98 Allowed 'General case' 0 C--O 1.222 -0.349 0 C-N-CA 127.011 2.124 . . . . 1.4199999999999999 116.535 -164.09 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 65' ' ' VAL . . . . . . . . . . . . . 33.0 m -33.76 -19.26 0.0 OUTLIER 'Isoleucine or valine' 0 CA--C 1.54 0.593 0 C-N-CA 131.111 3.764 . . . . 1.45 119.414 -131.66 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 66' ' ' ASN . . . . . . . . . . . . . 1.8 p-10 -58.39 -28.2 64.96 Favored 'General case' 0 CA--C 1.538 0.494 0 CA-C-N 120.962 1.71 . . . . 3.0099999999999998 111.321 158.083 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 67' ' ' GLN . . . . . . . . . . . . . 75.0 mt-30 59.42 62.34 1.8 Allowed 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.427 1.491 . . . . 3.9100000000000001 110.991 175.401 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 68' ' ' ASP . . . . . . . . . . . . . 44.2 p30 -103.18 -15.34 16.05 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 126.202 1.801 . . . . 1.96 111.591 175.21 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 69' ' ' SER . . . . . . . . . . . . . 11.8 m 73.79 21.92 2.62 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 125.783 1.633 . . . . 2.04 113.464 -175.254 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 70' ' ' GLU . . . . . . . . . . . . . 14.1 mt-10 -129.52 109.7 11.25 Favored 'General case' 0 C--O 1.236 0.388 0 C-N-CA 125.36 1.464 . . . . 3.5 107.592 162.135 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 71' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -77.77 106.38 9.56 Favored 'General case' 0 N--CA 1.454 -0.255 0 N-CA-C 107.847 -1.168 . . . . 1.05 107.847 176.931 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 72' ' ' LYS . . . . . . . . . . . . . 12.0 ptmt -85.54 -178.46 6.68 Favored 'General case' 0 C--O 1.238 0.461 0 C-N-CA 126.551 1.94 . . . . 3.8999999999999999 112.115 -174.803 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 73' ' ' PHE . . . . . . . . . . . . . 65.2 m-85 -75.65 82.55 2.65 Favored 'General case' 0 C--N 1.341 0.232 0 C-N-CA 124.591 1.156 . . . . 3.8300000000000001 108.284 -172.539 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 74' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER 96.53 47.79 0.0 OUTLIER 'General case' 0 N--CA 1.453 -0.314 1 C-N-CA 133.554 4.742 . . . . 2.25 108.295 178.088 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 75' ' ' GLU . . . . . . . . . . . . . 54.1 mt-10 -89.63 -60.93 1.81 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 107.934 -1.136 . . . . 1.9399999999999999 107.934 120.467 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 76' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -38.71 -53.67 1.63 Allowed 'General case' 0 C--N 1.344 0.358 0 C-N-CA 127.049 2.14 . . . . 3.4500000000000002 111.529 -174.172 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 77' ' ' TRP . . . . . 0.611 ' CE2' ' CZ2' ' A' ' 77' ' ' TRP . 43.0 t90 -43.4 -38.42 2.75 Favored 'General case' 0 N--CA 1.441 -0.919 0 C-N-CA 125.989 1.716 . . . . 4.0999999999999996 112.42 -171.292 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 78' ' ' ARG . . . . . . . . . . . . . 1.2 mmm180 -38.85 -48.66 1.57 Allowed 'General case' 0 C--N 1.342 0.25 0 C-N-CA 123.866 0.866 . . . . 5.2300000000000004 111.746 174.988 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 79' ' ' LEU . . . . . . . . . . . . . 6.0 tp -52.12 -48.05 65.01 Favored 'General case' 0 N--CA 1.453 -0.301 0 C-N-CA 123.033 0.533 . . . . 0.89000000000000001 111.504 -177.271 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 80' ' ' ILE . . . . . . . . . . . . . 64.5 mt -62.16 -30.68 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.449 -0.499 0 N-CA-C 107.529 -1.285 . . . . 1.3700000000000001 107.529 -178.255 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 81' ' ' GLY . . . . . 0.577 ' CA ' ' CZ2' ' A' ' 77' ' ' TRP . . . -69.33 -52.94 19.75 Favored Glycine 0 CA--C 1.496 -1.154 0 C-N-CA 124.894 1.235 . . . . 1.29 111.392 179.965 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 82' ' ' GLU . . . . . . . . . . . . . 61.7 mt-10 -50.54 -63.22 1.19 Allowed 'General case' 0 N--CA 1.439 -0.981 0 N-CA-C 107.192 -1.41 . . . . 3.3700000000000001 107.192 174.047 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 83' ' ' LEU . . . . . 0.456 HD12 HG21 ' A' ' 13' ' ' ILE 0.289 4.5 pp -58.98 -34.05 71.38 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 112.941 0.719 . . . . 1.9399999999999999 112.941 -173.645 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 84' ' ' ALA . . . . . . . . . . . . . . . -56.91 -38.62 73.1 Favored 'General case' 0 N--CA 1.454 -0.254 0 CA-C-O 118.265 -0.874 . . . . 1.1699999999999999 111.966 174.939 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 85' ' ' LYS . . . . . . . . . . . . 0.315 0.0 OUTLIER -80.39 -41.12 25.2 Favored 'General case' 0 C--N 1.346 0.416 0 CA-C-O 116.101 -1.904 . . . . 3.3900000000000001 112.189 166.451 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' B' B ' 86' ' ' GLU . . . . . . . . . . . . . 71.3 mm-40 -45.62 -36.05 4.5 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 121.331 1.878 . . . . 2.6200000000000001 112.914 -169.862 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 87' ' ' ILE . . . . . . . . . . . . . 10.5 tt -44.05 -50.85 1.69 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 CA-C-N 118.316 0.507 . . . . 0.95999999999999996 111.969 171.914 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 88' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -84.44 -50.18 8.0 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 127.861 2.464 . . . . 4.1399999999999997 112.613 175.133 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 89' ' ' LYS . . . . . . . . . . . . . 10.5 tttm -63.49 131.21 47.41 Favored 'General case' 0 CA--C 1.531 0.241 0 C-N-CA 126.04 1.736 . . . . 5.96 112.313 -168.68 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 90' ' ' LYS . . . . . . . . . . . . . 5.2 mmpt? -81.68 -60.93 2.08 Favored 'General case' 0 CA--C 1.533 0.303 0 N-CA-C 109.979 -0.378 . . . . 4.8700000000000001 109.979 161.0 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 91' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -152.8 36.62 0.5 Allowed 'General case' 0 CA--C 1.539 0.54 0 N-CA-C 113.147 0.795 . . . . 6.6200000000000001 113.147 178.459 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 92' ' ' ASP . . . . . 0.41 ' OD1' ' NZ ' ' A' ' 72' ' ' LYS . 36.2 t70 -66.79 77.08 0.12 Allowed 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.973 0.909 . . . . 6.9500000000000002 111.705 172.036 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 93' ' ' LEU . . . . . . . . . . . . . 20.6 tp -150.38 -81.08 0.11 Allowed 'General case' 0 N--CA 1.442 -0.835 0 N-CA-C 106.927 -1.508 . . . . 5.0999999999999996 106.927 168.008 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 154.77 174.64 0.01 OUTLIER 'General case' 0 CA--C 1.531 0.213 0 C-N-CA 130.317 3.447 . . . . 7.2199999999999998 106.552 -177.536 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 95' ' ' ILE . . . . . . . . . . . . . 5.5 tp -151.87 68.86 0.05 OUTLIER 'Isoleucine or valine' 0 CA--C 1.534 0.328 0 CA-C-O 121.656 0.741 . . . . 8.7400000000000002 109.631 -179.565 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 96' ' ' ARG . . . . . . . . . . . . . 5.0 ttt-85 -170.09 174.76 5.31 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 123.316 0.646 . . . . 9.8599999999999994 110.207 173.978 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 97' ' ' LYS . . . . . . . . . . . . . 84.4 tttt -178.21 140.82 0.23 Allowed 'General case' 0 N--CA 1.452 -0.336 0 C-N-CA 129.614 3.166 . . . . 9.6199999999999992 105.078 177.893 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 98' ' ' LYS . . . . . . . . . . . . . 4.1 ttpt . . . . . 0 C--O 1.254 1.296 0 N-CA-C 103.955 -2.609 . . . . 10.279999999999999 103.955 151.907 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 197' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 198' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 199' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 200' ' ' ' CA' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_