data_5vav_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 5vav _Structure_validation_residue.Date_analyzed 2017-05-05 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 full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.363 0 N-CA-C 112.489 -0.244 . . . . 52.4 112.489 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.0 ttt180 -59.93 154.95 17.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.908 0.385 . . . . 70.44 110.889 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.9 t -161.14 160.49 30.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.47 . . . . 73.23 110.84 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.9 p -91.14 134.49 34.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 73.33 111.151 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -72.93 -36.61 67.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 70.23 110.948 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -107.24 -175.07 2.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 75.12 111.101 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.482 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.7 m0 -89.74 161.31 39.24 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-O 121.584 0.707 . . . . 74.34 110.91 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.482 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.7 Cg_endo -69.76 167.64 70.32 Favored 'Cis proline' 0 C--N 1.341 0.173 0 C-N-CA 122.712 -1.787 . . . . 72.23 112.304 -0.004 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 84.37 0.66 Allowed 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.654 2.236 . . . . 70.21 112.315 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.0 mm -110.49 109.42 28.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 74.24 111.13 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.37 132.34 56.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 70.32 110.865 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -84.9 160.58 55.2 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.639 0.733 . . . . 73.43 110.892 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -32.16 19.13 Favored 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.68 2.253 . . . . 75.2 112.368 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.4 t70 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 71.44 110.868 179.896 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.346 0 N-CA-C 112.496 -0.241 . . . . 72.53 112.496 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -51.71 153.95 2.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.824 0.345 . . . . 74.31 110.888 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.9 t -161.56 163.28 30.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 71.42 110.894 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.9 p -108.7 113.41 26.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 74.34 111.169 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -62.31 -43.56 98.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.254 -0.43 . . . . 73.13 110.893 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -96.87 144.99 26.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 74.44 111.058 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.492 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.1 m0 -53.75 161.26 1.72 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.543 0.687 . . . . 75.23 110.929 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.492 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.7 Cg_endo -69.75 167.7 70.07 Favored 'Cis proline' 0 C--N 1.342 0.207 0 C-N-CA 122.684 -1.798 . . . . 64.12 112.374 -0.074 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.65 81.59 0.78 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.69 2.26 . . . . 72.13 112.356 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 40.6 mm -117.28 109.45 27.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 72.32 111.127 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.4 t -120.49 132.03 55.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 73.35 110.849 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -76.09 160.5 78.12 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.601 0.715 . . . . 74.23 110.907 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 -46.21 1.31 Allowed 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.691 2.261 . . . . 74.51 112.342 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 116.211 -0.449 . . . . 75.3 110.883 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.308 0 N-CA-C 112.512 -0.235 . . . . 54.11 112.512 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -51.59 167.06 0.11 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.852 0.358 . . . . 73.42 110.885 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.7 m -149.23 165.61 31.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 73.21 110.827 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 26.6 p -83.22 120.69 26.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 71.33 111.146 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -64.84 -52.6 55.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 74.13 110.922 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -89.91 165.7 13.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 72.42 111.11 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.488 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.0 m0 -70.6 161.13 78.9 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.539 0.685 . . . . 75.24 110.976 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.488 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.3 Cg_endo -69.81 167.71 70.22 Favored 'Cis proline' 0 C--O 1.232 0.177 0 C-N-CA 122.714 -1.786 . . . . 73.53 112.308 0.034 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 82.05 0.77 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.713 2.275 . . . . 63.54 112.363 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 27.4 mm -117.31 150.65 19.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.458 . . . . 75.22 111.136 179.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.7 m -135.45 141.14 45.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 72.24 110.858 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -76.14 160.43 78.16 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.666 0.746 . . . . 74.02 110.848 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -42.7 3.2 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.698 2.265 . . . . 73.53 112.35 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 63.32 110.87 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 N-CA-C 112.498 -0.241 . . . . 75.21 112.498 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 90.2 mtt180 -63.11 156.73 24.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.881 0.372 . . . . 73.11 110.878 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.8 m -138.96 171.85 13.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.469 . . . . 70.34 110.853 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 23.7 p -101.5 113.92 27.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.123 -0.49 . . . . 74.1 111.16 -179.988 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -59.54 -35.57 74.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 72.33 110.928 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -97.04 -169.46 1.87 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.149 -0.478 . . . . 64.31 111.112 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.486 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.2 m0 -104.99 161.18 23.54 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.587 0.708 . . . . 73.52 110.916 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.486 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 54.0 Cg_endo -69.71 164.76 78.25 Favored 'Cis proline' 0 C--N 1.342 0.194 0 C-N-CA 122.659 -1.809 . . . . 74.23 112.327 -0.065 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.8 80.08 0.92 Allowed 'Trans proline' 0 C--N 1.341 0.14 0 C-N-CA 122.714 2.276 . . . . 64.23 112.311 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.6 tt -117.54 114.31 45.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 74.23 111.18 179.869 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 2.1 m -98.63 130.99 45.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 73.22 110.903 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -64.48 160.95 47.31 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.664 0.745 . . . . 72.21 110.895 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.7 -32.4 18.9 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.664 2.243 . . . . 75.35 112.324 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 t70 . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.205 -0.452 . . . . 73.22 110.895 179.948 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 N-CA-C 112.495 -0.242 . . . . 75.42 112.495 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.23 151.15 4.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.882 0.372 . . . . 74.04 110.9 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.92 168.71 17.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 74.43 110.865 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.2 p -91.64 135.47 33.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 74.5 111.195 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -75.3 -41.7 56.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 62.52 110.903 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -97.23 175.03 6.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 71.32 111.109 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.487 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 1.1 m0 -86.22 161.28 49.66 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.611 0.719 . . . . 73.12 110.882 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.487 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 54.0 Cg_endo -69.74 167.78 69.78 Favored 'Cis proline' 0 C--N 1.342 0.187 0 C-N-CA 122.644 -1.815 . . . . 74.22 112.349 -0.074 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.83 86.4 0.59 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.638 2.226 . . . . 73.44 112.327 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 47.6 mt -111.23 147.2 15.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.221 -0.445 . . . . 64.12 111.167 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -141.45 132.17 25.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 52.42 110.875 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -79.39 160.51 70.11 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.676 0.751 . . . . 71.42 110.828 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -42.05 3.74 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.679 2.253 . . . . 71.43 112.34 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 63.42 110.871 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.3 0 N-CA-C 112.501 -0.24 . . . . 72.33 112.501 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.3 mmm-85 -58.66 149.44 25.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.843 0.354 . . . . 73.41 110.877 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 52.8 m -122.78 171.83 8.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 63.14 110.884 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.9 p -82.08 177.3 8.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 74.25 111.107 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -108.03 -64.55 1.2 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 74.01 110.871 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -89.96 149.48 22.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 74.44 111.122 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.489 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.9 m0 -55.46 160.97 3.25 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.537 0.684 . . . . 74.21 110.934 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.489 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.0 Cg_endo -69.79 167.81 69.81 Favored 'Cis proline' 0 C--N 1.341 0.168 0 C-N-CA 122.643 -1.815 . . . . 74.31 112.319 -0.018 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 97.25 0.63 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.696 2.264 . . . . 71.24 112.325 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.7 mt -117.29 150.2 19.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 64.14 111.159 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.8 m -146.97 131.19 17.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.451 . . . . 74.02 110.876 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -77.64 160.34 74.91 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.69 0.757 . . . . 72.41 110.839 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 -37.86 8.6 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.646 2.231 . . . . 74.24 112.343 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 75.03 110.861 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.503 -0.239 . . . . 74.3 112.503 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -60.7 151.78 28.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.866 0.365 . . . . 73.01 110.83 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 61.8 m -120.11 171.83 8.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 75.44 110.857 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.4 p -80.8 176.98 9.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.162 -0.472 . . . . 73.54 111.118 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -109.27 -61.83 1.57 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 74.41 110.897 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -90.02 143.24 26.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 62.04 111.049 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.487 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.9 m0 -51.98 160.99 1.02 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.578 0.704 . . . . 74.03 110.918 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.487 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.7 Cg_endo -69.8 167.84 69.75 Favored 'Cis proline' 0 C--O 1.232 0.175 0 C-N-CA 122.673 -1.803 . . . . 64.41 112.344 0.022 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 95.33 0.55 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.663 2.242 . . . . 72.14 112.327 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.6 mt -117.38 149.98 19.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 72.44 111.105 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.0 m -141.46 130.93 23.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 73.21 110.899 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -74.38 160.36 81.5 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.668 0.746 . . . . 73.12 110.865 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -38.08 8.26 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.667 2.245 . . . . 61.52 112.358 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.456 . . . . 74.44 110.831 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 N-CA-C 112.5 -0.24 . . . . 52.12 112.5 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -78.62 166.78 22.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.851 0.357 . . . . 74.44 110.915 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.7 m -133.21 171.8 13.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 65.11 110.878 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 20.6 p -109.69 114.87 28.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 72.25 111.153 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -54.19 -35.9 62.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 74.12 110.873 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -97.88 -169.64 1.86 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.463 . . . . 63.01 111.104 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.49 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 2.9 m0 -105.05 161.21 23.44 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.583 0.706 . . . . 75.04 110.907 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.49 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.4 Cg_endo -69.8 164.28 79.75 Favored 'Cis proline' 0 C--N 1.342 0.2 0 C-N-CA 122.704 -1.79 . . . . 73.34 112.294 0.035 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.83 80.82 0.88 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.647 2.231 . . . . 74.05 112.329 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.1 pp -117.53 148.62 20.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 73.33 111.119 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 76.3 m -141.23 142.7 33.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 71.12 110.883 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -77.46 160.27 75.51 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.633 0.73 . . . . 72.11 110.88 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.77 -39.25 6.72 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.666 2.244 . . . . 72.4 112.306 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.239 -0.437 . . . . 74.52 110.873 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 N-CA-C 112.502 -0.239 . . . . 43.24 112.502 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 43.0 ttm-85 -51.04 143.92 9.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.814 0.34 . . . . 75.41 110.907 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.1 t -159.19 139.73 12.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 74.01 110.883 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 35.2 p -76.19 124.06 26.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.21 -0.45 . . . . 73.13 111.152 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -63.88 -39.58 94.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.445 . . . . 74.42 110.871 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.78 -176.03 3.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 73.13 111.06 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.493 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 2.6 m0 -91.08 161.23 35.81 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-O 121.574 0.702 . . . . 73.44 110.912 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.493 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.8 Cg_endo -69.83 167.73 70.22 Favored 'Cis proline' 0 C--N 1.341 0.174 0 C-N-CA 122.643 -1.815 . . . . 75.34 112.315 0.041 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 81.84 0.8 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.655 2.236 . . . . 74.44 112.35 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 50.3 mm -117.34 111.44 34.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 60.32 111.098 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.5 m -138.03 158.97 43.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 74.1 110.874 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -110.06 160.35 28.54 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.655 0.741 . . . . 73.21 110.84 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 -37.2 9.42 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.698 2.265 . . . . 71.31 112.335 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 74.04 110.898 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 N-CA-C 112.507 -0.237 . . . . 71.33 112.507 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 67.4 mtt85 -56.52 146.58 24.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.825 0.345 . . . . 74.32 110.894 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.8 t -130.63 156.1 45.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 72.22 110.878 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 13.8 p -74.02 116.71 14.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.465 . . . . 72.12 111.128 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -56.29 -36.01 68.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.445 . . . . 52.14 110.893 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -98.75 -169.38 1.77 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 63.22 111.13 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.491 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 2.8 m0 -100.87 160.94 25.34 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.549 0.69 . . . . 71.41 110.912 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.491 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 54.3 Cg_endo -69.7 165.15 77.2 Favored 'Cis proline' 0 C--O 1.232 0.182 0 C-N-CA 122.656 -1.81 . . . . 75.34 112.375 -0.097 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 81.68 0.8 Allowed 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.694 2.263 . . . . 75.2 112.338 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 6.8 tt -117.64 123.08 71.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 74.4 111.146 179.912 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 68.9 m -113.77 138.9 49.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.169 -0.468 . . . . 74.14 110.92 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -76.94 160.52 76.25 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.689 0.757 . . . . 74.43 110.855 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.77 -33.29 16.84 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.699 2.266 . . . . 73.21 112.315 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 75.34 110.865 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.298 0 N-CA-C 112.453 -0.259 . . . . 55.42 112.453 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.04 145.89 9.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.895 0.378 . . . . 74.32 110.825 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.3 t -161.49 145.95 13.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.473 . . . . 73.5 110.896 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 66.0 p -90.29 119.08 30.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.222 -0.445 . . . . 54.22 111.172 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -61.21 -43.06 99.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.19 -0.459 . . . . 72.02 110.914 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -89.93 -169.13 2.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.454 . . . . 74.32 111.135 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.49 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.0 m0 -100.72 160.27 27.27 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.56 0.695 . . . . 73.24 110.918 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.49 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 54.2 Cg_endo -69.71 163.11 82.54 Favored 'Cis proline' 0 C--O 1.232 0.192 0 C-N-CA 122.695 -1.794 . . . . 75.1 112.365 -0.126 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 77.74 1.04 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.679 2.253 . . . . 75.32 112.348 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 10.2 tt -118.32 119.32 60.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 74.44 111.139 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.4 m -138.48 143.73 39.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.192 -0.458 . . . . 64.35 110.881 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -79.62 161.18 67.8 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.633 0.73 . . . . 71.11 110.903 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.71 -28.7 25.18 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.655 2.237 . . . . 71.02 112.376 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 74.44 110.867 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 N-CA-C 112.478 -0.249 . . . . 75.45 112.478 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -60.75 146.03 47.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.848 0.356 . . . . 74.13 110.872 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.3 m -118.74 171.83 7.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.169 -0.469 . . . . 74.22 110.889 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 18.1 p -91.37 119.19 31.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.464 . . . . 74.21 111.13 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -61.9 -35.94 79.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.244 -0.435 . . . . 73.01 110.939 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -105.95 138.69 41.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.225 -0.443 . . . . 73.24 111.088 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.489 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.5 m0 -51.92 161.12 0.98 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.527 0.68 . . . . 75.21 110.939 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.489 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.3 Cg_endo -69.78 163.65 81.35 Favored 'Cis proline' 0 C--O 1.232 0.19 0 C-N-CA 122.707 -1.789 . . . . 74.51 112.347 -0.001 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 78.55 0.98 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.726 2.284 . . . . 75.13 112.378 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 6.1 tt -117.68 125.67 74.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 72.31 111.095 179.971 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.3 t -121.31 130.93 53.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 74.15 110.918 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -72.04 161.16 80.33 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.611 0.72 . . . . 73.12 110.904 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -32.39 18.59 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.689 2.259 . . . . 71.55 112.362 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.1 p30 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 74.23 110.9 179.884 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 112.461 -0.256 . . . . 71.25 112.461 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.8 ttm-85 -59.42 141.53 54.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.86 0.362 . . . . 74.21 110.89 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.2 t -116.42 156.63 26.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.155 -0.475 . . . . 73.11 110.872 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 19.5 p -72.5 123.3 22.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 73.35 111.093 -179.95 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -61.74 -40.42 95.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.204 -0.453 . . . . 73.22 110.938 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.87 -169.21 1.96 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 62.03 111.103 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.488 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 4.2 m0 -102.85 160.93 24.71 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.625 0.726 . . . . 74.53 110.919 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.488 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.6 Cg_endo -69.75 162.94 83.07 Favored 'Cis proline' 0 C--N 1.342 0.234 0 C-N-CA 122.669 -1.805 . . . . 72.34 112.352 -0.091 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 78.49 1.0 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.724 2.283 . . . . 74.31 112.362 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.1 pp -117.67 118.89 59.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.226 -0.443 . . . . 72.34 111.183 179.929 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 34.7 m -103.95 151.47 23.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 64.22 110.866 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -89.33 160.93 41.44 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.63 0.728 . . . . 74.3 110.902 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -33.81 15.95 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.678 2.252 . . . . 72.23 112.344 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.6 p30 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 75.23 110.815 179.98 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 N-CA-C 112.47 -0.252 . . . . 52.53 112.47 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 27.9 ttt-85 -51.76 155.26 1.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.825 0.345 . . . . 72.55 110.88 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 m -155.68 163.12 40.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 75.51 110.899 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 53.0 p -102.7 141.02 36.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 73.25 111.147 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -86.21 -35.84 19.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 64.1 110.97 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -90.86 -172.58 3.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 64.22 111.118 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.506 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 1.1 p90 -105.57 157.68 33.99 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.569 0.7 . . . . 74.33 110.875 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.506 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.1 Cg_endo -69.84 167.61 70.66 Favored 'Cis proline' 0 C--N 1.342 0.193 0 C-N-CA 122.632 -1.82 . . . . 74.1 112.322 0.011 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 84.32 0.66 Allowed 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.698 2.265 . . . . 73.14 112.327 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 50.5 mm -107.08 109.3 27.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 73.44 111.167 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -112.59 130.84 55.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 65.51 110.874 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -70.19 160.67 79.93 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.665 0.745 . . . . 73.3 110.888 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -46.0 1.38 Allowed 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.668 2.245 . . . . 73.44 112.345 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.216 -0.447 . . . . 61.11 110.896 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.369 0 N-CA-C 112.473 -0.251 . . . . 73.14 112.473 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 20.6 ttt180 -51.95 156.93 1.38 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.81 0.338 . . . . 62.21 110.873 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 21.9 m -144.62 171.88 13.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.205 -0.452 . . . . 73.52 110.915 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 33.7 p -108.17 113.69 27.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 70.43 111.12 -179.944 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -57.16 -36.14 70.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.233 -0.44 . . . . 72.24 110.955 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.3 -170.38 2.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 73.31 111.139 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.488 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 2.7 m0 -105.15 161.17 23.56 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.576 0.703 . . . . 75.52 110.896 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.488 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 54.0 Cg_endo -69.74 165.59 76.18 Favored 'Cis proline' 0 C--N 1.341 0.167 0 C-N-CA 122.714 -1.786 . . . . 73.11 112.314 -0.053 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 83.03 0.72 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.679 2.253 . . . . 75.44 112.386 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 8.2 tp -117.47 128.48 74.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 75.14 111.155 179.923 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.3 m -124.12 130.92 53.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 74.34 110.848 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -68.5 160.54 75.84 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.624 0.726 . . . . 74.24 110.886 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 -32.7 18.14 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.667 2.245 . . . . 73.21 112.39 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 74.0 110.878 179.916 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.491 -0.243 . . . . 45.32 112.491 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -51.62 158.52 0.92 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.85 0.357 . . . . 74.03 110.853 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 28.4 t -154.25 140.88 18.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.444 . . . . 64.25 110.873 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 18.5 p -60.56 116.95 4.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 74.31 111.172 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.9 mm100 -68.48 -38.08 80.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 74.43 110.878 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.95 148.28 25.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 70.43 111.097 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.514 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 1.6 p90 -51.03 157.26 1.47 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.536 0.684 . . . . 73.23 110.938 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.514 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.5 Cg_endo -69.72 166.66 73.37 Favored 'Cis proline' 0 C--O 1.231 0.164 0 C-N-CA 122.748 -1.772 . . . . 71.13 112.334 -0.069 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 78.15 1.03 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.672 2.248 . . . . 75.51 112.336 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 58.8 mt -117.48 142.42 31.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.233 -0.439 . . . . 71.24 111.12 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 83.9 m -142.05 135.36 29.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 44.4 110.883 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -64.37 160.69 48.52 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.654 0.74 . . . . 65.2 110.874 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 -32.4 18.77 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.705 2.27 . . . . 72.41 112.354 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.241 -0.436 . . . . 72.01 110.833 179.949 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 N-CA-C 112.458 -0.257 . . . . 73.41 112.458 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 19.1 ttp180 -53.27 154.3 3.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.798 0.332 . . . . 73.02 110.866 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.4 m -147.92 167.9 23.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.214 -0.448 . . . . 73.1 110.923 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 70.0 p -100.26 140.67 34.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 74.32 111.118 -179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -91.42 -36.38 13.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 73.43 110.952 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -90.24 127.57 36.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 74.22 111.135 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.519 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 55.3 p-90 -51.68 156.27 2.41 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-O 121.566 0.698 . . . . 71.23 110.902 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.519 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.1 Cg_endo -69.85 167.11 72.44 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.651 -1.812 . . . . 62.2 112.321 0.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 80.01 0.91 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.685 2.257 . . . . 74.11 112.37 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 46.1 mm -101.76 109.42 25.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 73.54 111.128 179.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.3 m -108.59 131.18 55.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 71.14 110.868 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -75.09 160.6 80.04 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.65 0.738 . . . . 75.43 110.892 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -33.1 17.12 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.655 2.237 . . . . 73.35 112.301 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 t70 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.25 -0.432 . . . . 72.45 110.847 179.942 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.297 0 N-CA-C 112.499 -0.241 . . . . 61.41 112.499 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -51.79 154.57 2.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.896 0.379 . . . . 75.42 110.815 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.3 t -161.5 137.66 8.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.153 -0.476 . . . . 74.54 110.915 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 27.5 p -80.58 117.81 21.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 74.3 111.166 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -73.88 -36.96 64.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.448 . . . . 75.52 110.923 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.48 142.58 27.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 64.31 111.099 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.505 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 55.6 p-90 -51.58 156.22 2.35 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-O 121.565 0.697 . . . . 74.33 110.922 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.7 Cg_endo -69.78 167.46 71.0 Favored 'Cis proline' 0 C--N 1.342 0.197 0 C-N-CA 122.642 -1.816 . . . . 63.31 112.369 -0.039 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 85.06 0.63 Allowed 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.666 2.244 . . . . 74.14 112.382 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.6 mt -117.31 146.51 21.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 72.31 111.151 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 t -148.68 134.64 19.09 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.21 -0.45 . . . . 74.45 110.88 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -79.39 160.45 70.25 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.665 0.745 . . . . 63.22 110.898 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 -46.22 1.33 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.696 2.264 . . . . 74.42 112.322 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 75.11 110.868 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 N-CA-C 112.514 -0.235 . . . . 71.42 112.514 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.7 tpp180 -56.61 148.4 19.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.848 0.356 . . . . 61.54 110.844 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.5 m -150.54 153.92 36.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 75.13 110.895 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 62.8 p -88.4 133.51 34.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 71.31 111.137 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -88.43 -37.41 15.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 71.44 110.897 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -89.96 134.96 33.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 72.22 111.142 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.508 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 56.1 p-90 -51.68 156.08 2.51 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.58 0.705 . . . . 73.05 110.91 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.508 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 54.2 Cg_endo -69.81 167.53 70.86 Favored 'Cis proline' 0 C--O 1.232 0.179 0 C-N-CA 122.678 -1.801 . . . . 73.51 112.359 0.004 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 95.01 0.54 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.697 2.265 . . . . 73.54 112.327 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 47.0 mt -117.33 149.44 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.215 -0.448 . . . . 74.04 111.113 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -149.54 130.89 14.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 74.44 110.869 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -84.72 160.7 55.45 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.674 0.75 . . . . 74.31 110.88 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -32.78 17.83 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.67 2.246 . . . . 72.34 112.386 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.5 t70 . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.224 -0.444 . . . . 51.24 110.86 179.907 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 N-CA-C 112.502 -0.239 . . . . 71.22 112.502 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -52.11 155.05 2.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.829 0.347 . . . . 72.54 110.902 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.12 170.41 11.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.238 -0.437 . . . . 73.1 110.886 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.1 p -87.94 169.74 11.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 75.5 111.133 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -103.63 -35.6 8.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.225 -0.443 . . . . 71.25 110.947 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -97.4 -176.22 3.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.156 -0.475 . . . . 72.14 111.121 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' TRP . . . . . 0.506 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 14.6 m0 -105.08 158.9 31.07 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.513 0.673 . . . . 74.52 110.934 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.506 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.8 Cg_endo -69.75 164.73 78.46 Favored 'Cis proline' 0 C--N 1.341 0.146 0 C-N-CA 122.691 -1.796 . . . . 71.04 112.343 -0.102 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 99.17 0.73 Allowed 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 122.709 2.272 . . . . 74.13 112.355 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 8.8 tt -117.46 126.83 74.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 72.24 111.13 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.51 134.87 53.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 71.24 110.879 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -74.57 160.6 80.71 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.663 0.744 . . . . 74.4 110.892 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 -32.61 18.17 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.746 2.297 . . . . 72.13 112.305 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.9 p30 . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 72.12 110.825 179.946 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.363 0 N-CA-C 112.489 -0.244 . . . . 45.03 112.489 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.0 ttt180 -59.93 154.95 17.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.908 0.385 . . . . 70.44 110.889 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.9 t -161.14 160.49 30.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.47 . . . . 63.4 110.84 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.9 p -91.14 134.49 34.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 73.25 111.151 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -72.93 -36.61 67.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 70.23 110.948 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -107.24 -175.07 2.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 75.12 111.101 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.494 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.7 m0 -89.74 161.31 39.24 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-O 121.584 0.707 . . . . 72.01 110.91 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.494 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.7 Cg_endo -69.76 167.64 70.32 Favored 'Cis proline' 0 C--N 1.341 0.173 0 C-N-CA 122.712 -1.787 . . . . 72.23 112.304 -0.004 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 84.37 0.66 Allowed 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.654 2.236 . . . . 54.41 112.315 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.0 mm -110.49 109.42 28.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 61.44 111.13 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.37 132.34 56.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 70.32 110.865 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -84.9 160.58 55.2 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.639 0.733 . . . . 52.42 110.892 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -32.16 19.13 Favored 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.68 2.253 . . . . 75.2 112.368 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.4 t70 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 64.21 110.868 179.896 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.346 0 N-CA-C 112.496 -0.241 . . . . 72.53 112.496 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -51.71 153.95 2.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.824 0.345 . . . . 74.15 110.888 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.9 t -161.56 163.28 30.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 71.42 110.894 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.9 p -108.7 113.41 26.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 74.34 111.169 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -62.31 -43.56 98.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.254 -0.43 . . . . 73.13 110.893 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -96.87 144.99 26.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 74.44 111.058 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.503 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.1 m0 -53.75 161.26 1.72 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.543 0.687 . . . . 75.23 110.929 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.503 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.7 Cg_endo -69.75 167.7 70.07 Favored 'Cis proline' 0 C--N 1.342 0.207 0 C-N-CA 122.684 -1.798 . . . . 64.12 112.374 -0.074 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.65 81.59 0.78 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.69 2.26 . . . . 51.35 112.356 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 40.6 mm -117.28 109.45 27.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 71.01 111.127 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.4 t -120.49 132.03 55.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 71.15 110.849 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -76.09 160.5 78.12 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.601 0.715 . . . . 74.23 110.907 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 -46.21 1.31 Allowed 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.691 2.261 . . . . 61.33 112.342 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 116.211 -0.449 . . . . 75.3 110.883 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.308 0 N-CA-C 112.512 -0.235 . . . . 51.52 112.512 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -51.59 167.06 0.11 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.852 0.358 . . . . 72.41 110.885 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.7 m -149.23 165.61 31.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 72.52 110.827 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.477 HG21 ' HB ' ' A' ' 10' ' ' ILE . 26.6 p -83.22 120.69 26.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 71.33 111.146 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -64.84 -52.6 55.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 74.13 110.922 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -89.91 165.7 13.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 72.25 111.11 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.499 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.0 m0 -70.6 161.13 78.9 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.539 0.685 . . . . 75.24 110.976 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.499 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.3 Cg_endo -69.81 167.71 70.22 Favored 'Cis proline' 0 C--O 1.232 0.177 0 C-N-CA 122.714 -1.786 . . . . 61.21 112.308 0.034 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 82.05 0.77 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.713 2.275 . . . . 61.04 112.363 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.477 ' HB ' HG21 ' A' ' 4' ' ' THR . 27.4 mm -117.31 150.65 19.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.458 . . . . 75.02 111.136 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.7 m -135.45 141.14 45.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 72.24 110.858 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -76.14 160.43 78.16 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.666 0.746 . . . . 73.3 110.848 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -42.7 3.2 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.698 2.265 . . . . 73.53 112.35 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 63.32 110.87 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 N-CA-C 112.498 -0.241 . . . . 32.31 112.498 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 90.2 mtt180 -63.11 156.73 24.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.881 0.372 . . . . 73.11 110.878 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.8 m -138.96 171.85 13.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.469 . . . . 50.21 110.853 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.519 HG21 HG23 ' A' ' 10' ' ' ILE . 23.7 p -101.5 113.92 27.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.123 -0.49 . . . . 74.1 111.16 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -59.54 -35.57 74.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 71.13 110.928 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -97.04 -169.46 1.87 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.149 -0.478 . . . . 64.31 111.112 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.498 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.2 m0 -104.99 161.18 23.54 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.587 0.708 . . . . 73.52 110.916 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.498 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 54.0 Cg_endo -69.71 164.76 78.25 Favored 'Cis proline' 0 C--N 1.342 0.194 0 C-N-CA 122.659 -1.809 . . . . 73.54 112.327 -0.065 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.8 80.08 0.92 Allowed 'Trans proline' 0 C--N 1.341 0.14 0 C-N-CA 122.714 2.276 . . . . 61.33 112.311 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.519 HG23 HG21 ' A' ' 4' ' ' THR . 10.6 tt -117.54 114.31 45.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 74.23 111.18 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 2.1 m -98.63 130.99 45.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 73.22 110.903 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -64.48 160.95 47.31 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.664 0.745 . . . . 72.21 110.895 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.7 -32.4 18.9 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.664 2.243 . . . . 75.35 112.324 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 t70 . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.205 -0.452 . . . . 51.5 110.895 179.948 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 N-CA-C 112.495 -0.242 . . . . 73.21 112.495 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.23 151.15 4.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.882 0.372 . . . . 74.04 110.9 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.92 168.71 17.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 54.35 110.865 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.2 p -91.64 135.47 33.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 74.5 111.195 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -75.3 -41.7 56.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 54.13 110.903 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -97.23 175.03 6.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 71.32 111.109 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.498 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 1.1 m0 -86.22 161.28 49.66 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.611 0.719 . . . . 73.12 110.882 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.498 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 54.0 Cg_endo -69.74 167.78 69.78 Favored 'Cis proline' 0 C--N 1.342 0.187 0 C-N-CA 122.644 -1.815 . . . . 74.22 112.349 -0.074 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.83 86.4 0.59 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.638 2.226 . . . . 73.44 112.327 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 47.6 mt -111.23 147.2 15.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.221 -0.445 . . . . 54.13 111.167 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -141.45 132.17 25.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 52.42 110.875 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -79.39 160.51 70.11 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.676 0.751 . . . . 71.42 110.828 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -42.05 3.74 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.679 2.253 . . . . 61.21 112.34 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 61.42 110.871 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.3 0 N-CA-C 112.501 -0.24 . . . . 72.33 112.501 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.3 mmm-85 -58.66 149.44 25.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.843 0.354 . . . . 73.41 110.877 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 52.8 m -122.78 171.83 8.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 44.21 110.884 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.9 p -82.08 177.3 8.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 74.25 111.107 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -108.03 -64.55 1.2 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 74.01 110.871 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -89.96 149.48 22.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 74.44 111.122 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.502 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.9 m0 -55.46 160.97 3.25 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.537 0.684 . . . . 74.21 110.934 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.502 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.0 Cg_endo -69.79 167.81 69.81 Favored 'Cis proline' 0 C--N 1.341 0.168 0 C-N-CA 122.643 -1.815 . . . . 74.31 112.319 -0.018 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 97.25 0.63 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.696 2.264 . . . . 41.05 112.325 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.7 mt -117.29 150.2 19.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 64.14 111.159 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.8 m -146.97 131.19 17.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.451 . . . . 74.02 110.876 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -77.64 160.34 74.91 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.69 0.757 . . . . 72.41 110.839 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 -37.86 8.6 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.646 2.231 . . . . 74.24 112.343 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 75.03 110.861 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.503 -0.239 . . . . 13.12 112.503 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -60.7 151.78 28.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.866 0.365 . . . . 73.01 110.83 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 61.8 m -120.11 171.83 8.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 52.31 110.857 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.4 p -80.8 176.98 9.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.162 -0.472 . . . . 73.54 111.118 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -109.27 -61.83 1.57 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 73.02 110.897 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -90.02 143.24 26.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 62.04 111.049 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.499 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.9 m0 -51.98 160.99 1.02 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.578 0.704 . . . . 72.03 110.918 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.499 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.7 Cg_endo -69.8 167.84 69.75 Favored 'Cis proline' 0 C--O 1.232 0.175 0 C-N-CA 122.673 -1.803 . . . . 64.41 112.344 0.022 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 95.33 0.55 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.663 2.242 . . . . 72.14 112.327 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.6 mt -117.38 149.98 19.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 72.44 111.105 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.0 m -141.46 130.93 23.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 73.21 110.899 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -74.38 160.36 81.5 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.668 0.746 . . . . 73.12 110.865 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -38.08 8.26 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.667 2.245 . . . . 61.52 112.358 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.456 . . . . 74.03 110.831 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 N-CA-C 112.5 -0.24 . . . . 52.12 112.5 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -78.62 166.78 22.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.851 0.357 . . . . 74.44 110.915 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.7 m -133.21 171.8 13.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 64.03 110.878 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 20.6 p -109.69 114.87 28.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 43.13 111.153 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -54.19 -35.9 62.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 74.12 110.873 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -97.88 -169.64 1.86 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.463 . . . . 55.53 111.104 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.501 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 2.9 m0 -105.05 161.21 23.44 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.583 0.706 . . . . 73.42 110.907 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.501 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.4 Cg_endo -69.8 164.28 79.75 Favored 'Cis proline' 0 C--N 1.342 0.2 0 C-N-CA 122.704 -1.79 . . . . 53.13 112.294 0.035 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.83 80.82 0.88 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.647 2.231 . . . . 73.0 112.329 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.1 pp -117.53 148.62 20.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 73.33 111.119 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 76.3 m -141.23 142.7 33.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 71.12 110.883 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -77.46 160.27 75.51 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.633 0.73 . . . . 72.11 110.88 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.77 -39.25 6.72 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.666 2.244 . . . . 72.4 112.306 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.239 -0.437 . . . . 74.52 110.873 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 N-CA-C 112.502 -0.239 . . . . 21.21 112.502 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 43.0 ttm-85 -51.04 143.92 9.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.814 0.34 . . . . 73.5 110.907 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.1 t -159.19 139.73 12.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 74.01 110.883 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 35.2 p -76.19 124.06 26.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.21 -0.45 . . . . 73.13 111.152 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -63.88 -39.58 94.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.445 . . . . 74.42 110.871 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.78 -176.03 3.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 71.21 111.06 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.505 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 2.6 m0 -91.08 161.23 35.81 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-O 121.574 0.702 . . . . 72.53 110.912 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.8 Cg_endo -69.83 167.73 70.22 Favored 'Cis proline' 0 C--N 1.341 0.174 0 C-N-CA 122.643 -1.815 . . . . 75.34 112.315 0.041 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 81.84 0.8 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.655 2.236 . . . . 74.44 112.35 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 50.3 mm -117.34 111.44 34.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 60.32 111.098 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.5 m -138.03 158.97 43.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 70.22 110.874 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -110.06 160.35 28.54 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.655 0.741 . . . . 73.21 110.84 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 -37.2 9.42 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.698 2.265 . . . . 71.31 112.335 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 74.04 110.898 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 N-CA-C 112.507 -0.237 . . . . 71.33 112.507 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 67.4 mtt85 -56.52 146.58 24.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.825 0.345 . . . . 72.33 110.894 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.8 t -130.63 156.1 45.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 60.24 110.878 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 13.8 p -74.02 116.71 14.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.465 . . . . 64.15 111.128 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -56.29 -36.01 68.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.445 . . . . 52.14 110.893 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -98.75 -169.38 1.77 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 44.43 111.13 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.503 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 2.8 m0 -100.87 160.94 25.34 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.549 0.69 . . . . 65.51 110.912 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.503 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 54.3 Cg_endo -69.7 165.15 77.2 Favored 'Cis proline' 0 C--O 1.232 0.182 0 C-N-CA 122.656 -1.81 . . . . 74.25 112.375 -0.097 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 81.68 0.8 Allowed 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.694 2.263 . . . . 75.2 112.338 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.414 HG23 ' O ' ' A' ' 10' ' ' ILE . 6.8 tt -117.64 123.08 71.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 63.21 111.146 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 68.9 m -113.77 138.9 49.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.169 -0.468 . . . . 74.14 110.92 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -76.94 160.52 76.25 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.689 0.757 . . . . 74.43 110.855 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.77 -33.29 16.84 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.699 2.266 . . . . 71.32 112.315 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 73.33 110.865 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.298 0 N-CA-C 112.453 -0.259 . . . . 55.42 112.453 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.04 145.89 9.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.895 0.378 . . . . 70.23 110.825 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.3 t -161.49 145.95 13.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.473 . . . . 73.5 110.896 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 66.0 p -90.29 119.08 30.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.222 -0.445 . . . . 53.15 111.172 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -61.21 -43.06 99.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.19 -0.459 . . . . 72.02 110.914 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -89.93 -169.13 2.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.454 . . . . 74.32 111.135 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.502 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.0 m0 -100.72 160.27 27.27 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.56 0.695 . . . . 73.24 110.918 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.502 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 54.2 Cg_endo -69.71 163.11 82.54 Favored 'Cis proline' 0 C--O 1.232 0.192 0 C-N-CA 122.695 -1.794 . . . . 73.4 112.365 -0.126 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 77.74 1.04 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.679 2.253 . . . . 71.15 112.348 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.439 HG23 ' O ' ' A' ' 10' ' ' ILE . 10.2 tt -118.32 119.32 60.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 74.44 111.139 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.4 m -138.48 143.73 39.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.192 -0.458 . . . . 55.25 110.881 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -79.62 161.18 67.8 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.633 0.73 . . . . 71.11 110.903 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.71 -28.7 25.18 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.655 2.237 . . . . 71.02 112.376 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 74.44 110.867 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 N-CA-C 112.478 -0.249 . . . . 71.32 112.478 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -60.75 146.03 47.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.848 0.356 . . . . 62.13 110.872 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.3 m -118.74 171.83 7.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.169 -0.469 . . . . 72.13 110.889 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 18.1 p -91.37 119.19 31.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.464 . . . . 74.21 111.13 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -61.9 -35.94 79.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.244 -0.435 . . . . 70.44 110.939 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -105.95 138.69 41.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.225 -0.443 . . . . 73.24 111.088 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.5 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.5 m0 -51.92 161.12 0.98 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.527 0.68 . . . . 75.21 110.939 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.5 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.3 Cg_endo -69.78 163.65 81.35 Favored 'Cis proline' 0 C--O 1.232 0.19 0 C-N-CA 122.707 -1.789 . . . . 74.51 112.347 -0.001 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 78.55 0.98 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.726 2.284 . . . . 74.22 112.378 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.4 HG23 ' O ' ' A' ' 10' ' ' ILE . 6.1 tt -117.68 125.67 74.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 72.31 111.095 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.3 t -121.31 130.93 53.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 74.15 110.918 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -72.04 161.16 80.33 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.611 0.72 . . . . 73.12 110.904 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -32.39 18.59 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.689 2.259 . . . . 60.24 112.362 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.1 p30 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 74.23 110.9 179.884 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 112.461 -0.256 . . . . 71.25 112.461 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.8 ttm-85 -59.42 141.53 54.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.86 0.362 . . . . 74.21 110.89 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.2 t -116.42 156.63 26.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.155 -0.475 . . . . 73.11 110.872 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.576 HG21 HD11 ' A' ' 10' ' ' ILE . 19.5 p -72.5 123.3 22.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 73.35 111.093 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -61.74 -40.42 95.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.204 -0.453 . . . . 70.54 110.938 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.87 -169.21 1.96 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 62.03 111.103 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.501 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 4.2 m0 -102.85 160.93 24.71 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.625 0.726 . . . . 74.45 110.919 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.501 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.6 Cg_endo -69.75 162.94 83.07 Favored 'Cis proline' 0 C--N 1.342 0.234 0 C-N-CA 122.669 -1.805 . . . . 72.34 112.352 -0.091 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 78.49 1.0 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.724 2.283 . . . . 74.31 112.362 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.576 HD11 HG21 ' A' ' 4' ' ' THR . 1.1 pp -117.67 118.89 59.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.226 -0.443 . . . . 55.4 111.183 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 34.7 m -103.95 151.47 23.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 43.4 110.866 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -89.33 160.93 41.44 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.63 0.728 . . . . 74.3 110.902 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -33.81 15.95 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.678 2.252 . . . . 72.23 112.344 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.6 p30 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 73.2 110.815 179.98 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 N-CA-C 112.47 -0.252 . . . . 52.53 112.47 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 27.9 ttt-85 -51.76 155.26 1.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.825 0.345 . . . . 72.55 110.88 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 m -155.68 163.12 40.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 75.51 110.899 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 53.0 p -102.7 141.02 36.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 73.25 111.147 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -86.21 -35.84 19.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 63.14 110.97 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -90.86 -172.58 3.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 63.34 111.118 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.517 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 1.1 p90 -105.57 157.68 33.99 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.569 0.7 . . . . 73.14 110.875 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.517 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.1 Cg_endo -69.84 167.61 70.66 Favored 'Cis proline' 0 C--N 1.342 0.193 0 C-N-CA 122.632 -1.82 . . . . 74.1 112.322 0.011 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 84.32 0.66 Allowed 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.698 2.265 . . . . 73.14 112.327 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 50.5 mm -107.08 109.3 27.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 64.13 111.167 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -112.59 130.84 55.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 32.4 110.874 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -70.19 160.67 79.93 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.665 0.745 . . . . 62.42 110.888 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -46.0 1.38 Allowed 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.668 2.245 . . . . 73.44 112.345 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.216 -0.447 . . . . 53.44 110.896 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.369 0 N-CA-C 112.473 -0.251 . . . . 31.31 112.473 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 20.6 ttt180 -51.95 156.93 1.38 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.81 0.338 . . . . 55.45 110.873 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 21.9 m -144.62 171.88 13.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.205 -0.452 . . . . 73.52 110.915 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.402 HG21 ' CG2' ' A' ' 10' ' ' ILE . 33.7 p -108.17 113.69 27.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 70.43 111.12 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -57.16 -36.14 70.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.233 -0.44 . . . . 63.34 110.955 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.3 -170.38 2.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 50.33 111.139 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.501 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 2.7 m0 -105.15 161.17 23.56 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.576 0.703 . . . . 75.52 110.896 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.501 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 54.0 Cg_endo -69.74 165.59 76.18 Favored 'Cis proline' 0 C--N 1.341 0.167 0 C-N-CA 122.714 -1.786 . . . . 73.11 112.314 -0.053 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 83.03 0.72 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.679 2.253 . . . . 72.24 112.386 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.402 ' CG2' HG21 ' A' ' 4' ' ' THR . 8.2 tp -117.47 128.48 74.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 73.21 111.155 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.3 m -124.12 130.92 53.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 74.34 110.848 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -68.5 160.54 75.84 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.624 0.726 . . . . 74.24 110.886 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 -32.7 18.14 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.667 2.245 . . . . 71.3 112.39 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 62.42 110.878 179.916 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.491 -0.243 . . . . 45.32 112.491 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -51.62 158.52 0.92 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.85 0.357 . . . . 74.03 110.853 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 28.4 t -154.25 140.88 18.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.444 . . . . 61.21 110.873 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 18.5 p -60.56 116.95 4.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 74.31 111.172 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.9 mm100 -68.48 -38.08 80.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 74.43 110.878 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.95 148.28 25.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 54.41 111.097 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.527 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 1.6 p90 -51.03 157.26 1.47 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.536 0.684 . . . . 71.51 110.938 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.527 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.5 Cg_endo -69.72 166.66 73.37 Favored 'Cis proline' 0 C--O 1.231 0.164 0 C-N-CA 122.748 -1.772 . . . . 71.13 112.334 -0.069 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 78.15 1.03 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.672 2.248 . . . . 72.02 112.336 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 58.8 mt -117.48 142.42 31.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.233 -0.439 . . . . 52.12 111.12 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 83.9 m -142.05 135.36 29.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 44.4 110.883 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -64.37 160.69 48.52 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.654 0.74 . . . . 64.21 110.874 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 -32.4 18.77 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.705 2.27 . . . . 72.41 112.354 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.241 -0.436 . . . . 72.01 110.833 179.949 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 N-CA-C 112.458 -0.257 . . . . 73.41 112.458 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 19.1 ttp180 -53.27 154.3 3.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.798 0.332 . . . . 44.5 110.866 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.4 m -147.92 167.9 23.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.214 -0.448 . . . . 73.1 110.923 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' THR . . . . . 0.424 HG23 ' O ' ' A' ' 10' ' ' ILE . 70.0 p -100.26 140.67 34.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 74.32 111.118 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -91.42 -36.38 13.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 73.43 110.952 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -90.24 127.57 36.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 71.31 111.135 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.531 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 55.3 p-90 -51.68 156.27 2.41 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-O 121.566 0.698 . . . . 71.23 110.902 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.531 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.1 Cg_endo -69.85 167.11 72.44 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.651 -1.812 . . . . 62.2 112.321 0.051 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 80.01 0.91 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.685 2.257 . . . . 74.11 112.37 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.424 ' O ' HG23 ' A' ' 4' ' ' THR . 46.1 mm -101.76 109.42 25.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 55.03 111.128 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.3 m -108.59 131.18 55.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 71.14 110.868 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -75.09 160.6 80.04 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.65 0.738 . . . . 75.43 110.892 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -33.1 17.12 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.655 2.237 . . . . 63.52 112.301 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 t70 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.25 -0.432 . . . . 72.45 110.847 179.942 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.297 0 N-CA-C 112.499 -0.241 . . . . 53.22 112.499 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -51.79 154.57 2.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.896 0.379 . . . . 74.21 110.815 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.3 t -161.5 137.66 8.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.153 -0.476 . . . . 74.54 110.915 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 27.5 p -80.58 117.81 21.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 74.3 111.166 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -73.88 -36.96 64.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.448 . . . . 73.11 110.923 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.48 142.58 27.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 60.23 111.099 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.517 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 55.6 p-90 -51.58 156.22 2.35 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-O 121.565 0.697 . . . . 71.21 110.922 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.517 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.7 Cg_endo -69.78 167.46 71.0 Favored 'Cis proline' 0 C--N 1.342 0.197 0 C-N-CA 122.642 -1.816 . . . . 63.31 112.369 -0.039 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 85.06 0.63 Allowed 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.666 2.244 . . . . 71.12 112.382 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.6 mt -117.31 146.51 21.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 72.31 111.151 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 t -148.68 134.64 19.09 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.21 -0.45 . . . . 52.11 110.88 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -79.39 160.45 70.25 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.665 0.745 . . . . 62.52 110.898 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 -46.22 1.33 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.696 2.264 . . . . 74.42 112.322 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 75.11 110.868 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 N-CA-C 112.514 -0.235 . . . . 61.44 112.514 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.7 tpp180 -56.61 148.4 19.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.848 0.356 . . . . 61.54 110.844 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.5 m -150.54 153.92 36.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 75.13 110.895 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 62.8 p -88.4 133.51 34.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 62.4 111.137 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -88.43 -37.41 15.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 63.13 110.897 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -89.96 134.96 33.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 72.22 111.142 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.52 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 56.1 p-90 -51.68 156.08 2.51 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.58 0.705 . . . . 73.02 110.91 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.52 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 54.2 Cg_endo -69.81 167.53 70.86 Favored 'Cis proline' 0 C--O 1.232 0.179 0 C-N-CA 122.678 -1.801 . . . . 61.41 112.359 0.004 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 95.01 0.54 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.697 2.265 . . . . 72.23 112.327 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 47.0 mt -117.33 149.44 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.215 -0.448 . . . . 73.33 111.113 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -149.54 130.89 14.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 74.44 110.869 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -84.72 160.7 55.45 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.674 0.75 . . . . 72.41 110.88 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -32.78 17.83 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.67 2.246 . . . . 72.34 112.386 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.5 t70 . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.224 -0.444 . . . . 51.24 110.86 179.907 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 N-CA-C 112.502 -0.239 . . . . 43.05 112.502 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -52.11 155.05 2.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.829 0.347 . . . . 72.03 110.902 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.12 170.41 11.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.238 -0.437 . . . . 73.1 110.886 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.1 p -87.94 169.74 11.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 73.1 111.133 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -103.63 -35.6 8.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.225 -0.443 . . . . 54.33 110.947 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -97.4 -176.22 3.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.156 -0.475 . . . . 62.31 111.121 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' TRP . . . . . 0.519 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 14.6 m0 -105.08 158.9 31.07 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.513 0.673 . . . . 74.52 110.934 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.519 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.8 Cg_endo -69.75 164.73 78.46 Favored 'Cis proline' 0 C--N 1.341 0.146 0 C-N-CA 122.691 -1.796 . . . . 71.04 112.343 -0.102 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 99.17 0.73 Allowed 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 122.709 2.272 . . . . 74.13 112.355 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 8.8 tt -117.46 126.83 74.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 65.13 111.13 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.51 134.87 53.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 62.53 110.879 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -74.57 160.6 80.71 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.663 0.744 . . . . 74.15 110.892 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 -32.61 18.17 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.746 2.297 . . . . 52.04 112.305 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.9 p30 . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 70.13 110.825 179.946 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.363 0 N-CA-C 112.489 -0.244 . . . . 45.030000000000001 112.489 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 8.0 ttt180 -59.93 154.95 17.6 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-O 120.908 0.385 . . . . 70.439999999999998 110.889 -179.891 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.9 t -161.14 160.49 30.31 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.165 -0.47 . . . . 63.399999999999999 110.84 -179.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 4.9 p -91.14 134.49 34.49 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.133 -0.485 . . . . 73.25 111.151 -179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.6 mm100 -72.93 -36.61 67.26 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.23 -0.441 . . . . 70.230000000000004 110.948 -179.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -107.24 -175.07 2.69 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.186 -0.461 . . . . 75.120000000000005 111.101 179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.494 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.7 m0 -89.74 161.31 39.24 Favored Pre-proline 0 C--N 1.327 -0.386 0 CA-C-O 121.584 0.707 . . . . 72.010000000000005 110.91 -179.934 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.494 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.7 Cg_endo -69.76 167.64 70.32 Favored 'Cis proline' 0 C--N 1.341 0.173 0 C-N-CA 122.712 -1.787 . . . . 72.230000000000004 112.304 -0.004 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 84.37 0.66 Allowed 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.654 2.236 . . . . 54.409999999999997 112.315 179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.0 mm -110.49 109.42 28.4 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.304 0 CA-C-N 116.206 -0.452 . . . . 61.439999999999998 111.13 179.851 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -116.37 132.34 56.7 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.196 -0.456 . . . . 70.319999999999993 110.865 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.1 m-85 -84.9 160.58 55.2 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.639 0.733 . . . . 52.420000000000002 110.892 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 -32.16 19.13 Favored 'Trans proline' 0 C--O 1.231 0.16 0 C-N-CA 122.68 2.253 . . . . 75.200000000000003 112.368 179.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.4 t70 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.223 -0.444 . . . . 64.209999999999994 110.868 179.896 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.346 0 N-CA-C 112.496 -0.241 . . . . 72.530000000000001 112.496 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -51.71 153.95 2.2 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.824 0.345 . . . . 74.150000000000006 110.888 -179.897 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 2.9 t -161.56 163.28 30.21 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.193 -0.458 . . . . 71.420000000000002 110.894 -179.971 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.9 p -108.7 113.41 26.35 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.188 -0.46 . . . . 74.340000000000003 111.169 -179.963 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 13.9 pt20 -62.31 -43.56 98.55 Favored 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.254 -0.43 . . . . 73.129999999999995 110.893 -179.948 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -96.87 144.99 26.29 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.221 -0.445 . . . . 74.439999999999998 111.058 179.936 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.503 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.1 m0 -53.75 161.26 1.72 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.543 0.687 . . . . 75.230000000000004 110.929 -179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.503 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.7 Cg_endo -69.75 167.7 70.07 Favored 'Cis proline' 0 C--N 1.342 0.207 0 C-N-CA 122.684 -1.798 . . . . 64.120000000000005 112.374 -0.074 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.65 81.59 0.78 Allowed 'Trans proline' 0 C--O 1.232 0.214 0 C-N-CA 122.69 2.26 . . . . 51.350000000000001 112.356 179.923 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 40.6 mm -117.28 109.45 27.77 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.285 -0.416 . . . . 71.010000000000005 111.127 179.919 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.4 t -120.49 132.03 55.0 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.185 -0.461 . . . . 71.150000000000006 110.849 179.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.7 m-85 -76.09 160.5 78.12 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.601 0.715 . . . . 74.230000000000004 110.907 -179.986 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 -46.21 1.31 Allowed 'Trans proline' 0 C--O 1.232 0.186 0 C-N-CA 122.691 2.261 . . . . 61.329999999999998 112.342 179.982 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.327 -0.372 0 CA-C-N 116.211 -0.449 . . . . 75.299999999999997 110.883 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.308 0 N-CA-C 112.512 -0.235 . . . . 51.520000000000003 112.512 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 9.2 mmm180 -51.59 167.06 0.11 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.852 0.358 . . . . 72.409999999999997 110.885 -179.865 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 35.7 m -149.23 165.61 31.38 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.19 -0.459 . . . . 72.519999999999996 110.827 -179.943 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.477 HG21 ' HB ' ' A' ' 10' ' ' ILE . 26.6 p -83.22 120.69 26.13 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.143 -0.481 . . . . 71.329999999999998 111.146 179.993 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 73.5 mt-30 -64.84 -52.6 55.79 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.238 -0.437 . . . . 74.129999999999995 110.922 179.933 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -89.91 165.7 13.94 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.164 -0.471 . . . . 72.25 111.11 179.941 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.499 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.0 m0 -70.6 161.13 78.9 Favored Pre-proline 0 C--N 1.328 -0.346 0 CA-C-O 121.539 0.685 . . . . 75.239999999999995 110.976 179.981 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.499 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.3 Cg_endo -69.81 167.71 70.22 Favored 'Cis proline' 0 C--O 1.232 0.177 0 C-N-CA 122.714 -1.786 . . . . 61.210000000000001 112.308 0.034 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 82.05 0.77 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.713 2.275 . . . . 61.039999999999999 112.363 179.929 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.477 ' HB ' HG21 ' A' ' 4' ' ' THR . 27.4 mm -117.31 150.65 19.31 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.325 0 CA-C-N 116.191 -0.458 . . . . 75.019999999999996 111.136 179.951 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.7 m -135.45 141.14 45.33 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.194 -0.457 . . . . 72.239999999999995 110.858 179.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -76.14 160.43 78.16 Favored Pre-proline 0 C--N 1.329 -0.319 0 CA-C-O 121.666 0.746 . . . . 73.299999999999997 110.848 -179.958 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -42.7 3.2 Favored 'Trans proline' 0 C--N 1.341 0.137 0 C-N-CA 122.698 2.265 . . . . 73.530000000000001 112.35 179.971 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 63.32 110.87 179.924 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 N-CA-C 112.498 -0.241 . . . . 32.310000000000002 112.498 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 90.2 mtt180 -63.11 156.73 24.13 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.881 0.372 . . . . 73.109999999999999 110.878 -179.884 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 16.8 m -138.96 171.85 13.71 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.169 -0.469 . . . . 50.210000000000001 110.853 -179.936 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.519 HG21 HG23 ' A' ' 10' ' ' ILE . 23.7 p -101.5 113.92 27.47 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.123 -0.49 . . . . 74.099999999999994 111.16 -179.988 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 7.8 pt20 -59.54 -35.57 74.47 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.219 -0.446 . . . . 71.129999999999995 110.928 179.981 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -97.04 -169.46 1.87 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.149 -0.478 . . . . 64.310000000000002 111.112 179.915 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.498 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.2 m0 -104.99 161.18 23.54 Favored Pre-proline 0 C--N 1.328 -0.342 0 CA-C-O 121.587 0.708 . . . . 73.519999999999996 110.916 -179.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.498 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 54.0 Cg_endo -69.71 164.76 78.25 Favored 'Cis proline' 0 C--N 1.342 0.194 0 C-N-CA 122.659 -1.809 . . . . 73.540000000000006 112.327 -0.065 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.8 80.08 0.92 Allowed 'Trans proline' 0 C--N 1.341 0.14 0 C-N-CA 122.714 2.276 . . . . 61.329999999999998 112.311 179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.519 HG23 HG21 ' A' ' 4' ' ' THR . 10.6 tt -117.54 114.31 45.14 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.294 0 CA-C-N 116.21 -0.45 . . . . 74.230000000000004 111.18 179.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 2.1 m -98.63 130.99 45.17 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 116.236 -0.438 . . . . 73.219999999999999 110.903 179.926 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.6 m-85 -64.48 160.95 47.31 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.664 0.745 . . . . 72.209999999999994 110.895 -179.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.7 -32.4 18.9 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.664 2.243 . . . . 75.349999999999994 112.324 -179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.8 t70 . . . . . 0 C--N 1.328 -0.338 0 CA-C-N 116.205 -0.452 . . . . 51.5 110.895 179.948 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.288 0 N-CA-C 112.495 -0.242 . . . . 73.209999999999994 112.495 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.23 151.15 4.06 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-O 120.882 0.372 . . . . 74.040000000000006 110.9 -179.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -131.92 168.71 17.4 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.204 -0.453 . . . . 54.350000000000001 110.865 -179.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 71.2 p -91.64 135.47 33.85 Favored 'General case' 0 C--N 1.33 -0.265 0 CA-C-N 116.162 -0.472 . . . . 74.5 111.195 -179.975 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.5 mt-30 -75.3 -41.7 56.35 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.226 -0.443 . . . . 54.130000000000003 110.903 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -97.23 175.03 6.42 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.168 -0.469 . . . . 71.319999999999993 111.109 179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.498 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 1.1 m0 -86.22 161.28 49.66 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.611 0.719 . . . . 73.120000000000005 110.882 -179.956 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.498 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 54.0 Cg_endo -69.74 167.78 69.78 Favored 'Cis proline' 0 C--N 1.342 0.187 0 C-N-CA 122.644 -1.815 . . . . 74.219999999999999 112.349 -0.074 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.83 86.4 0.59 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.638 2.226 . . . . 73.439999999999998 112.327 179.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 47.6 mt -111.23 147.2 15.38 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.34 0 CA-C-N 116.221 -0.445 . . . . 54.130000000000003 111.167 179.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -141.45 132.17 25.69 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.168 -0.469 . . . . 52.420000000000002 110.875 179.961 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 5.3 m-85 -79.39 160.51 70.11 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.676 0.751 . . . . 71.420000000000002 110.828 -179.924 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.76 -42.05 3.74 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.679 2.253 . . . . 61.210000000000001 112.34 179.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.34 0 CA-C-N 116.213 -0.449 . . . . 61.420000000000002 110.871 179.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.3 0 N-CA-C 112.501 -0.24 . . . . 72.329999999999998 112.501 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 51.3 mmm-85 -58.66 149.44 25.97 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-O 120.843 0.354 . . . . 73.409999999999997 110.877 -179.847 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 52.8 m -122.78 171.83 8.89 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.184 -0.462 . . . . 44.210000000000001 110.884 -179.935 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 7.9 p -82.08 177.3 8.9 Favored 'General case' 0 C--N 1.33 -0.251 0 CA-C-N 116.199 -0.455 . . . . 74.25 111.107 -179.977 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 62.6 mt-30 -108.03 -64.55 1.2 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.172 -0.467 . . . . 74.010000000000005 110.871 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -89.96 149.48 22.56 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.201 -0.454 . . . . 74.439999999999998 111.122 179.946 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.502 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.9 m0 -55.46 160.97 3.25 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.537 0.684 . . . . 74.209999999999994 110.934 -179.96 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.502 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.0 Cg_endo -69.79 167.81 69.81 Favored 'Cis proline' 0 C--N 1.341 0.168 0 C-N-CA 122.643 -1.815 . . . . 74.310000000000002 112.319 -0.018 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.79 97.25 0.63 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.696 2.264 . . . . 41.049999999999997 112.325 179.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 30.7 mt -117.29 150.2 19.39 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.237 -0.438 . . . . 64.140000000000001 111.159 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 13.8 m -146.97 131.19 17.43 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.209 -0.451 . . . . 74.019999999999996 110.876 179.925 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.8 m-85 -77.64 160.34 74.91 Favored Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.69 0.757 . . . . 72.409999999999997 110.839 -179.96 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.76 -37.86 8.6 Favored 'Trans proline' 0 C--N 1.342 0.223 0 C-N-CA 122.646 2.231 . . . . 74.239999999999995 112.343 -179.99 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.226 -0.443 . . . . 75.030000000000001 110.861 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.503 -0.239 . . . . 13.119999999999999 112.503 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.5 ttm180 -60.7 151.78 28.39 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.866 0.365 . . . . 73.010000000000005 110.83 -179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 61.8 m -120.11 171.83 8.19 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.179 -0.464 . . . . 52.310000000000002 110.857 -179.95 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 15.4 p -80.8 176.98 9.34 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.162 -0.472 . . . . 73.540000000000006 111.118 -179.961 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.9 tp-100 -109.27 -61.83 1.57 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.216 -0.447 . . . . 73.019999999999996 110.897 179.992 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -90.02 143.24 26.95 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 62.039999999999999 111.049 179.963 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.499 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.9 m0 -51.98 160.99 1.02 Allowed Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.578 0.704 . . . . 72.030000000000001 110.918 -179.968 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.499 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.7 Cg_endo -69.8 167.84 69.75 Favored 'Cis proline' 0 C--O 1.232 0.175 0 C-N-CA 122.673 -1.803 . . . . 64.409999999999997 112.344 0.022 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 95.33 0.55 Allowed 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.663 2.242 . . . . 72.140000000000001 112.327 179.965 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 32.6 mt -117.38 149.98 19.55 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.314 0 CA-C-N 116.159 -0.473 . . . . 72.439999999999998 111.105 179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 22.0 m -141.46 130.93 23.81 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.138 -0.483 . . . . 73.209999999999994 110.899 179.914 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -74.38 160.36 81.5 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.668 0.746 . . . . 73.120000000000005 110.865 -179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -38.08 8.26 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.667 2.245 . . . . 61.520000000000003 112.358 179.999 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.196 -0.456 . . . . 74.030000000000001 110.831 179.932 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.343 0 N-CA-C 112.5 -0.24 . . . . 52.119999999999997 112.5 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.2 mpt_? -78.62 166.78 22.14 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-O 120.851 0.357 . . . . 74.439999999999998 110.915 -179.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.7 m -133.21 171.8 13.53 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.215 -0.448 . . . . 64.030000000000001 110.878 -179.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 20.6 p -109.69 114.87 28.82 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.169 -0.469 . . . . 43.130000000000003 111.153 -179.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 mm100 -54.19 -35.9 62.85 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.253 -0.431 . . . . 74.120000000000005 110.873 -179.959 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -97.88 -169.64 1.86 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.18 -0.463 . . . . 55.530000000000001 111.104 179.916 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.501 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 2.9 m0 -105.05 161.21 23.44 Favored Pre-proline 0 C--N 1.327 -0.373 0 CA-C-O 121.583 0.706 . . . . 73.420000000000002 110.907 -179.921 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.501 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.4 Cg_endo -69.8 164.28 79.75 Favored 'Cis proline' 0 C--N 1.342 0.2 0 C-N-CA 122.704 -1.79 . . . . 53.130000000000003 112.294 0.035 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.83 80.82 0.88 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.647 2.231 . . . . 73.0 112.329 179.948 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 1.1 pp -117.53 148.62 20.18 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.282 0 CA-C-N 116.198 -0.455 . . . . 73.329999999999998 111.119 179.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 76.3 m -141.23 142.7 33.92 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.182 -0.463 . . . . 71.120000000000005 110.883 179.923 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.7 m-85 -77.46 160.27 75.51 Favored Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.633 0.73 . . . . 72.109999999999999 110.88 -179.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.77 -39.25 6.72 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.666 2.244 . . . . 72.400000000000006 112.306 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.293 0 CA-C-N 116.239 -0.437 . . . . 74.519999999999996 110.873 179.973 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.347 0 N-CA-C 112.502 -0.239 . . . . 21.210000000000001 112.502 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 43.0 ttm-85 -51.04 143.92 9.72 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.814 0.34 . . . . 73.5 110.907 -179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 42.1 t -159.19 139.73 12.38 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.234 -0.439 . . . . 74.010000000000005 110.883 -179.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 35.2 p -76.19 124.06 26.86 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.21 -0.45 . . . . 73.129999999999995 111.152 -179.952 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 8.0 pt20 -63.88 -39.58 94.53 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.222 -0.445 . . . . 74.420000000000002 110.871 -179.978 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -99.78 -176.03 3.14 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.25 -0.432 . . . . 71.209999999999994 111.06 179.959 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.505 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 2.6 m0 -91.08 161.23 35.81 Favored Pre-proline 0 C--N 1.327 -0.372 0 CA-C-O 121.574 0.702 . . . . 72.530000000000001 110.912 -179.931 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.505 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.8 Cg_endo -69.83 167.73 70.22 Favored 'Cis proline' 0 C--N 1.341 0.174 0 C-N-CA 122.643 -1.815 . . . . 75.340000000000003 112.315 0.041 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 81.84 0.8 Allowed 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.655 2.236 . . . . 74.439999999999998 112.35 179.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 50.3 mm -117.34 111.44 34.82 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.296 0 CA-C-N 116.227 -0.442 . . . . 60.32 111.098 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 14.5 m -138.03 158.97 43.24 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.171 -0.468 . . . . 70.219999999999999 110.874 179.957 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 17.3 m-85 -110.06 160.35 28.54 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.655 0.741 . . . . 73.209999999999994 110.84 -179.935 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 -37.2 9.42 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.698 2.265 . . . . 71.310000000000002 112.335 179.991 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.208 -0.451 . . . . 74.040000000000006 110.898 179.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.275 0 N-CA-C 112.507 -0.237 . . . . 71.329999999999998 112.507 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 67.4 mtt85 -56.52 146.58 24.42 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.825 0.345 . . . . 72.329999999999998 110.894 -179.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.8 t -130.63 156.1 45.44 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.189 -0.46 . . . . 60.240000000000002 110.878 -179.971 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 13.8 p -74.02 116.71 14.97 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.178 -0.465 . . . . 64.150000000000006 111.128 -179.957 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 15.3 tt0 -56.29 -36.01 68.14 Favored 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.22 -0.445 . . . . 52.140000000000001 110.893 -179.977 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -98.75 -169.38 1.77 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.181 -0.463 . . . . 44.43 111.13 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.503 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 2.8 m0 -100.87 160.94 25.34 Favored Pre-proline 0 C--N 1.328 -0.361 0 CA-C-O 121.549 0.69 . . . . 65.510000000000005 110.912 -179.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.503 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 54.3 Cg_endo -69.7 165.15 77.2 Favored 'Cis proline' 0 C--O 1.232 0.182 0 C-N-CA 122.656 -1.81 . . . . 74.25 112.375 -0.097 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 81.68 0.8 Allowed 'Trans proline' 0 C--O 1.231 0.155 0 C-N-CA 122.694 2.263 . . . . 75.200000000000003 112.338 179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.414 ' O ' HG23 ' A' ' 10' ' ' ILE . 6.8 tt -117.64 123.08 71.24 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.299 0 CA-C-N 116.197 -0.456 . . . . 63.210000000000001 111.146 179.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 68.9 m -113.77 138.9 49.62 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.169 -0.468 . . . . 74.140000000000001 110.92 179.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -76.94 160.52 76.25 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.689 0.757 . . . . 74.430000000000007 110.855 -179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.77 -33.29 16.84 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.699 2.266 . . . . 71.319999999999993 112.315 -179.949 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.19 -0.459 . . . . 73.329999999999998 110.865 179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.298 0 N-CA-C 112.453 -0.259 . . . . 55.420000000000002 112.453 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -52.04 145.89 9.56 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.895 0.378 . . . . 70.230000000000004 110.825 -179.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.3 t -161.49 145.95 13.19 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.158 -0.473 . . . . 73.5 110.896 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 66.0 p -90.29 119.08 30.3 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.222 -0.445 . . . . 53.149999999999999 111.172 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 32.9 tt0 -61.21 -43.06 99.48 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 116.19 -0.459 . . . . 72.019999999999996 110.914 -179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -89.93 -169.13 2.33 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.2 -0.454 . . . . 74.319999999999993 111.135 179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.502 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.0 m0 -100.72 160.27 27.27 Favored Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.56 0.695 . . . . 73.239999999999995 110.918 -179.945 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.502 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 54.2 Cg_endo -69.71 163.11 82.54 Favored 'Cis proline' 0 C--O 1.232 0.192 0 C-N-CA 122.695 -1.794 . . . . 73.400000000000006 112.365 -0.126 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 77.74 1.04 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.679 2.253 . . . . 71.150000000000006 112.348 179.952 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.439 ' O ' HG23 ' A' ' 10' ' ' ILE . 10.2 tt -118.32 119.32 60.94 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.212 -0.449 . . . . 74.439999999999998 111.139 179.901 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 17.4 m -138.48 143.73 39.73 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.192 -0.458 . . . . 55.25 110.881 179.95 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.3 m-85 -79.62 161.18 67.8 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.633 0.73 . . . . 71.109999999999999 110.903 -179.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.6 Cg_endo -69.71 -28.7 25.18 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.655 2.237 . . . . 71.019999999999996 112.376 179.995 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.323 0 CA-C-N 116.221 -0.445 . . . . 74.439999999999998 110.867 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.276 0 N-CA-C 112.478 -0.249 . . . . 71.319999999999993 112.478 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 9.1 ptm180 -60.75 146.03 47.41 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.848 0.356 . . . . 62.130000000000003 110.872 -179.848 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.3 m -118.74 171.83 7.93 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.169 -0.469 . . . . 72.129999999999995 110.889 -179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 18.1 p -91.37 119.19 31.17 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.178 -0.464 . . . . 74.209999999999994 111.13 -179.951 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -61.9 -35.94 79.84 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-N 116.244 -0.435 . . . . 70.439999999999998 110.939 179.962 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -105.95 138.69 41.71 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.225 -0.443 . . . . 73.239999999999995 111.088 179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.5 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 3.5 m0 -51.92 161.12 0.98 Allowed Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.527 0.68 . . . . 75.209999999999994 110.939 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.5 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.3 Cg_endo -69.78 163.65 81.35 Favored 'Cis proline' 0 C--O 1.232 0.19 0 C-N-CA 122.707 -1.789 . . . . 74.510000000000005 112.347 -0.001 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 78.55 0.98 Allowed 'Trans proline' 0 C--N 1.341 0.157 0 C-N-CA 122.726 2.284 . . . . 74.219999999999999 112.378 179.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.4 ' O ' HG23 ' A' ' 10' ' ' ILE . 6.1 tt -117.68 125.67 74.25 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.187 -0.46 . . . . 72.310000000000002 111.095 179.971 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 10.3 t -121.31 130.93 53.91 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.142 -0.481 . . . . 74.150000000000006 110.918 179.921 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 3.9 m-85 -72.04 161.16 80.33 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.611 0.72 . . . . 73.120000000000005 110.904 -179.92 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -32.39 18.59 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.689 2.259 . . . . 60.240000000000002 112.362 -179.955 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.1 p30 . . . . . 0 C--N 1.329 -0.312 0 CA-C-N 116.223 -0.444 . . . . 74.230000000000004 110.9 179.884 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.304 0 N-CA-C 112.461 -0.256 . . . . 71.25 112.461 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 58.8 ttm-85 -59.42 141.53 54.44 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-O 120.86 0.362 . . . . 74.209999999999994 110.89 -179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.2 t -116.42 156.63 26.46 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.155 -0.475 . . . . 73.109999999999999 110.872 -179.916 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.576 HG21 HD11 ' A' ' 10' ' ' ILE . 19.5 p -72.5 123.3 22.85 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.172 -0.467 . . . . 73.349999999999994 111.093 -179.95 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -61.74 -40.42 95.02 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.204 -0.453 . . . . 70.540000000000006 110.938 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.87 -169.21 1.96 Allowed 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.181 -0.463 . . . . 62.030000000000001 111.103 179.91 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.501 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 4.2 m0 -102.85 160.93 24.71 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.625 0.726 . . . . 74.450000000000003 110.919 -179.982 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.501 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.6 Cg_endo -69.75 162.94 83.07 Favored 'Cis proline' 0 C--N 1.342 0.234 0 C-N-CA 122.669 -1.805 . . . . 72.340000000000003 112.352 -0.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 78.49 1.0 Allowed 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.724 2.283 . . . . 74.310000000000002 112.362 179.954 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.576 HD11 HG21 ' A' ' 4' ' ' THR . 1.1 pp -117.67 118.89 59.93 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.342 0 CA-C-N 116.226 -0.443 . . . . 55.399999999999999 111.183 179.929 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 34.7 m -103.95 151.47 23.14 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.202 -0.454 . . . . 43.399999999999999 110.866 179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 11.3 m-85 -89.33 160.93 41.44 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.63 0.728 . . . . 74.299999999999997 110.902 -179.974 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -33.81 15.95 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.678 2.252 . . . . 72.230000000000004 112.344 -179.985 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.6 p30 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.216 -0.447 . . . . 73.200000000000003 110.815 179.98 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.327 0 N-CA-C 112.47 -0.252 . . . . 52.530000000000001 112.47 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 27.9 ttt-85 -51.76 155.26 1.74 Allowed 'General case' 0 C--N 1.329 -0.296 0 CA-C-O 120.825 0.345 . . . . 72.549999999999997 110.88 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.6 m -155.68 163.12 40.31 Favored 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.203 -0.453 . . . . 75.510000000000005 110.899 -179.963 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 53.0 p -102.7 141.02 36.21 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-N 116.159 -0.473 . . . . 73.25 111.147 -179.976 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 10.3 pt20 -86.21 -35.84 19.81 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.196 -0.456 . . . . 63.140000000000001 110.97 179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -90.86 -172.58 3.41 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.169 -0.469 . . . . 63.340000000000003 111.118 179.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.517 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 1.1 p90 -105.57 157.68 33.99 Favored Pre-proline 0 C--N 1.328 -0.35 0 CA-C-O 121.569 0.7 . . . . 73.140000000000001 110.875 -179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.517 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.1 Cg_endo -69.84 167.61 70.66 Favored 'Cis proline' 0 C--N 1.342 0.193 0 C-N-CA 122.632 -1.82 . . . . 74.099999999999994 112.322 0.011 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 84.32 0.66 Allowed 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.698 2.265 . . . . 73.140000000000001 112.327 179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 50.5 mm -107.08 109.3 27.65 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.301 0 CA-C-N 116.242 -0.435 . . . . 64.129999999999995 111.167 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.2 m -112.59 130.84 55.89 Favored 'General case' 0 C--N 1.328 -0.342 0 CA-C-N 116.191 -0.459 . . . . 32.399999999999999 110.874 179.979 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 5.4 m-85 -70.19 160.67 79.93 Favored Pre-proline 0 C--N 1.329 -0.326 0 CA-C-O 121.665 0.745 . . . . 62.420000000000002 110.888 -179.973 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 -46.0 1.38 Allowed 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.668 2.245 . . . . 73.439999999999998 112.345 -179.955 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.216 -0.447 . . . . 53.439999999999998 110.896 179.904 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.45 -0.369 0 N-CA-C 112.473 -0.251 . . . . 31.309999999999999 112.473 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 20.6 ttt180 -51.95 156.93 1.38 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 120.81 0.338 . . . . 55.450000000000003 110.873 -179.86 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 21.9 m -144.62 171.88 13.77 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.205 -0.452 . . . . 73.519999999999996 110.915 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.402 HG21 ' CG2' ' A' ' 10' ' ' ILE . 33.7 p -108.17 113.69 27.01 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.197 -0.456 . . . . 70.430000000000007 111.12 -179.944 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 38.7 mt-30 -57.16 -36.14 70.38 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.233 -0.44 . . . . 63.340000000000003 110.955 179.963 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -94.3 -170.38 2.27 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.206 -0.452 . . . . 50.329999999999998 111.139 179.889 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.501 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 2.7 m0 -105.15 161.17 23.56 Favored Pre-proline 0 C--N 1.328 -0.348 0 CA-C-O 121.576 0.703 . . . . 75.519999999999996 110.896 -179.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.501 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 54.0 Cg_endo -69.74 165.59 76.18 Favored 'Cis proline' 0 C--N 1.341 0.167 0 C-N-CA 122.714 -1.786 . . . . 73.109999999999999 112.314 -0.053 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.77 83.03 0.72 Allowed 'Trans proline' 0 C--N 1.342 0.191 0 C-N-CA 122.679 2.253 . . . . 72.239999999999995 112.386 179.903 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.402 ' CG2' HG21 ' A' ' 4' ' ' THR . 8.2 tp -117.47 128.48 74.73 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.303 0 CA-C-N 116.211 -0.449 . . . . 73.209999999999994 111.155 179.923 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 33.3 m -124.12 130.92 53.37 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.156 -0.475 . . . . 74.340000000000003 110.848 179.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 13.4 m-85 -68.5 160.54 75.84 Favored Pre-proline 0 C--N 1.329 -0.294 0 CA-C-O 121.624 0.726 . . . . 74.239999999999995 110.886 179.966 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 -32.7 18.14 Favored 'Trans proline' 0 C--N 1.341 0.152 0 C-N-CA 122.667 2.245 . . . . 71.299999999999997 112.39 179.97 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 7.8 p-10 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.176 -0.465 . . . . 62.420000000000002 110.878 179.916 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.303 0 N-CA-C 112.491 -0.243 . . . . 45.32 112.491 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -51.62 158.52 0.92 Allowed 'General case' 0 C--N 1.329 -0.304 0 CA-C-O 120.85 0.357 . . . . 74.030000000000001 110.853 -179.85 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 28.4 t -154.25 140.88 18.94 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.444 . . . . 61.210000000000001 110.873 -179.968 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 18.5 p -60.56 116.95 4.73 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.17 -0.468 . . . . 74.310000000000002 111.172 179.995 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.9 mm100 -68.48 -38.08 80.7 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.228 -0.442 . . . . 74.430000000000007 110.878 -179.999 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -102.95 148.28 25.87 Favored 'General case' 0 C--N 1.328 -0.339 0 CA-C-N 116.206 -0.452 . . . . 54.409999999999997 111.097 179.929 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.527 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 1.6 p90 -51.03 157.26 1.47 Allowed Pre-proline 0 C--N 1.328 -0.362 0 CA-C-O 121.536 0.684 . . . . 71.510000000000005 110.938 -179.986 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.527 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.5 Cg_endo -69.72 166.66 73.37 Favored 'Cis proline' 0 C--O 1.231 0.164 0 C-N-CA 122.748 -1.772 . . . . 71.129999999999995 112.334 -0.069 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 78.15 1.03 Allowed 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.672 2.248 . . . . 72.019999999999996 112.336 179.951 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 58.8 mt -117.48 142.42 31.7 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.283 0 CA-C-N 116.233 -0.439 . . . . 52.119999999999997 111.12 179.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 83.9 m -142.05 135.36 29.13 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.194 -0.457 . . . . 44.399999999999999 110.883 179.912 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.4 m-85 -64.37 160.69 48.52 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.654 0.74 . . . . 64.209999999999994 110.874 -179.966 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 -32.4 18.77 Favored 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.705 2.27 . . . . 72.409999999999997 112.354 -180.0 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.6 p-10 . . . . . 0 C--N 1.328 -0.348 0 CA-C-N 116.241 -0.436 . . . . 72.010000000000005 110.833 179.949 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.301 0 N-CA-C 112.458 -0.257 . . . . 73.409999999999997 112.458 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 19.1 ttp180 -53.27 154.3 3.33 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.798 0.332 . . . . 44.5 110.866 -179.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 13.4 m -147.92 167.9 23.66 Favored 'General case' 0 C--N 1.328 -0.353 0 CA-C-N 116.214 -0.448 . . . . 73.099999999999994 110.923 -179.991 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . 0.424 HG23 ' O ' ' A' ' 10' ' ' ILE . 70.0 p -100.26 140.67 34.17 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.176 -0.466 . . . . 74.319999999999993 111.118 -179.939 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -91.42 -36.38 13.82 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.178 -0.464 . . . . 73.430000000000007 110.952 179.94 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -90.24 127.57 36.17 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.202 -0.454 . . . . 71.310000000000002 111.135 179.918 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.531 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 55.3 p-90 -51.68 156.27 2.41 Favored Pre-proline 0 C--N 1.327 -0.385 0 CA-C-O 121.566 0.698 . . . . 71.230000000000004 110.902 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.531 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.1 Cg_endo -69.85 167.11 72.44 Favored 'Cis proline' 0 C--N 1.342 0.186 0 C-N-CA 122.651 -1.812 . . . . 62.200000000000003 112.321 0.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 80.01 0.91 Allowed 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.685 2.257 . . . . 74.109999999999999 112.37 179.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.424 ' O ' HG23 ' A' ' 4' ' ' THR . 46.1 mm -101.76 109.42 25.96 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.283 0 CA-C-N 116.202 -0.454 . . . . 55.030000000000001 111.128 179.951 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.3 m -108.59 131.18 55.12 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.155 -0.475 . . . . 71.140000000000001 110.868 179.933 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 4.7 m-85 -75.09 160.6 80.04 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.65 0.738 . . . . 75.430000000000007 110.892 -179.965 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.8 -33.1 17.12 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.655 2.237 . . . . 63.520000000000003 112.301 -179.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.3 t70 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.25 -0.432 . . . . 72.450000000000003 110.847 179.942 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.297 0 N-CA-C 112.499 -0.241 . . . . 53.219999999999999 112.499 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 43.9 ttm180 -51.79 154.57 2.01 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-O 120.896 0.379 . . . . 74.209999999999994 110.815 -179.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 3.3 t -161.5 137.66 8.09 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.153 -0.476 . . . . 74.540000000000006 110.915 -179.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 27.5 p -80.58 117.81 21.61 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.211 -0.449 . . . . 74.299999999999997 111.166 -179.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 16.9 pt20 -73.88 -36.96 64.84 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.213 -0.448 . . . . 73.109999999999999 110.923 -179.99 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -95.48 142.58 27.67 Favored 'General case' 0 C--N 1.329 -0.285 0 CA-C-N 116.225 -0.443 . . . . 60.229999999999997 111.099 179.939 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.517 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 55.6 p-90 -51.58 156.22 2.35 Favored Pre-proline 0 C--N 1.328 -0.369 0 CA-C-O 121.565 0.697 . . . . 71.209999999999994 110.922 -179.964 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.517 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.7 Cg_endo -69.78 167.46 71.0 Favored 'Cis proline' 0 C--N 1.342 0.197 0 C-N-CA 122.642 -1.816 . . . . 63.310000000000002 112.369 -0.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 85.06 0.63 Allowed 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.666 2.244 . . . . 71.120000000000005 112.382 179.952 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.6 mt -117.31 146.51 21.66 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.32 0 CA-C-N 116.217 -0.447 . . . . 72.310000000000002 111.151 179.978 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 1.6 t -148.68 134.64 19.09 Favored 'General case' 0 C--N 1.328 -0.345 0 CA-C-N 116.21 -0.45 . . . . 52.109999999999999 110.88 179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.1 m-85 -79.39 160.45 70.25 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.665 0.745 . . . . 62.520000000000003 110.898 -179.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.7 -46.22 1.33 Allowed 'Trans proline' 0 C--N 1.342 0.199 0 C-N-CA 122.696 2.264 . . . . 74.420000000000002 112.322 -179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--N 1.328 -0.333 0 CA-C-N 116.241 -0.436 . . . . 75.109999999999999 110.868 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.451 -0.35 0 N-CA-C 112.514 -0.235 . . . . 61.439999999999998 112.514 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.7 tpp180 -56.61 148.4 19.98 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.848 0.356 . . . . 61.539999999999999 110.844 -179.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 11.5 m -150.54 153.92 36.66 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.188 -0.46 . . . . 75.129999999999995 110.895 -179.986 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 62.8 p -88.4 133.51 34.08 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.182 -0.463 . . . . 62.399999999999999 111.137 -179.94 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 5.5 tp-100 -88.43 -37.41 15.87 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.23 -0.441 . . . . 63.130000000000003 110.897 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -89.96 134.96 33.93 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.226 -0.443 . . . . 72.219999999999999 111.142 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.52 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 56.1 p-90 -51.68 156.08 2.51 Favored Pre-proline 0 C--N 1.328 -0.356 0 CA-C-O 121.58 0.705 . . . . 73.019999999999996 110.91 -179.954 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.52 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 54.2 Cg_endo -69.81 167.53 70.86 Favored 'Cis proline' 0 C--O 1.232 0.179 0 C-N-CA 122.678 -1.801 . . . . 61.409999999999997 112.359 0.004 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 95.01 0.54 Allowed 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.697 2.265 . . . . 72.230000000000004 112.327 179.972 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 47.0 mt -117.33 149.44 19.62 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.334 0 CA-C-N 116.215 -0.448 . . . . 73.329999999999998 111.113 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.8 OUTLIER -149.54 130.89 14.67 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.195 -0.457 . . . . 74.439999999999998 110.869 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 7.4 m-85 -84.72 160.7 55.45 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.674 0.75 . . . . 72.409999999999997 110.88 179.996 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.78 -32.78 17.83 Favored 'Trans proline' 0 C--O 1.232 0.21 0 C-N-CA 122.67 2.246 . . . . 72.340000000000003 112.386 179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.5 t70 . . . . . 0 C--N 1.328 -0.353 0 CA-C-N 116.224 -0.444 . . . . 51.240000000000002 110.86 179.907 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.452 -0.291 0 N-CA-C 112.502 -0.239 . . . . 43.049999999999997 112.502 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 7.0 mpt_? -52.11 155.05 2.03 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-O 120.829 0.347 . . . . 72.030000000000001 110.902 -179.854 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -126.12 170.41 11.81 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.238 -0.437 . . . . 73.099999999999994 110.886 -179.959 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' THR . . . . . . . . . . . . . 1.1 p -87.94 169.74 11.74 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.188 -0.46 . . . . 73.099999999999994 111.133 -179.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -103.63 -35.6 8.21 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.225 -0.443 . . . . 54.329999999999998 110.947 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -97.4 -176.22 3.44 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.156 -0.475 . . . . 62.310000000000002 111.121 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' TRP . . . . . 0.519 ' HA ' ' C ' ' A' ' 8' ' ' PRO . 14.6 m0 -105.08 158.9 31.07 Favored Pre-proline 0 C--N 1.328 -0.355 0 CA-C-O 121.513 0.673 . . . . 74.519999999999996 110.934 -179.974 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.519 ' C ' ' HA ' ' A' ' 7' ' ' TRP . 53.8 Cg_endo -69.75 164.73 78.46 Favored 'Cis proline' 0 C--N 1.341 0.146 0 C-N-CA 122.691 -1.796 . . . . 71.040000000000006 112.343 -0.102 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.75 99.17 0.73 Allowed 'Trans proline' 0 N--CA 1.465 -0.183 0 C-N-CA 122.709 2.272 . . . . 74.129999999999995 112.355 179.965 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 8.8 tt -117.46 126.83 74.88 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.221 -0.445 . . . . 65.129999999999995 111.13 179.967 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -112.51 134.87 53.81 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-N 116.207 -0.451 . . . . 62.530000000000001 110.879 179.962 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PHE . . . . . . . . . . . . . 8.3 m-85 -74.57 160.6 80.71 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.663 0.744 . . . . 74.150000000000006 110.892 -179.956 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.77 -32.61 18.17 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.746 2.297 . . . . 52.039999999999999 112.305 -179.948 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 3.9 p30 . . . . . 0 C--N 1.329 -0.292 0 CA-C-N 116.232 -0.44 . . . . 70.129999999999995 110.825 179.946 . . . . . . . . 0 0 . 1 stop_ save_