data_6qb1_residue ############################ # Computer software used # ############################ 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 6qb1 _Structure_validation_residue.Date_analyzed 2019-02-22 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' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.836 0.35 . . . . 75.11 110.925 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 105.62 -90.81 0.71 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.733 -0.746 . . . . 62.24 112.51 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -133.53 29.82 3.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.758 0.313 . . . . 70.32 110.925 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -99.68 147.94 24.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 72.01 110.938 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.2 pm0 -145.46 157.57 52.15 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.6 0.714 . . . . 74.24 110.939 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 84.19 0.67 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.682 2.255 . . . . 73.53 112.34 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -62.09 160.42 30.66 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.609 0.719 . . . . 75.11 111.102 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.77 167.74 23.58 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.696 2.264 . . . . 73.21 112.301 -179.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 142.19 47.4 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.679 2.253 . . . . 64.33 112.36 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -108.97 110.52 21.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 74.32 110.901 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -140.24 72.55 32.47 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.622 0.725 . . . . 75.34 110.928 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 134.47 28.13 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.722 2.282 . . . . 74.35 112.325 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 75.12 110.914 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.23 0.042 0 CA-C-O 120.872 0.368 . . . . 75.31 110.931 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 175.25 133.33 1.72 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.703 -0.761 . . . . 74.34 112.495 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -105.69 39.54 1.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.76 0.314 . . . . 74.25 110.915 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -87.36 57.45 4.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 74.34 110.909 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -132.82 70.02 79.05 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.585 0.707 . . . . 74.22 110.938 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.74 165.14 31.97 Favored 'Trans proline' 0 C--N 1.34 0.127 0 C-N-CA 122.697 2.264 . . . . 71.31 112.354 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -125.09 70.93 62.05 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.575 0.703 . . . . 75.4 111.054 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 167.8 23.43 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.607 2.205 . . . . 72.11 112.368 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 141.1 44.23 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 122.729 2.286 . . . . 75.22 112.375 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.48 153.37 27.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 72.55 110.912 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 54.48 69.18 2.22 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.611 0.719 . . . . 75.31 110.916 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.78 87.32 0.56 Allowed 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.66 2.24 . . . . 62.24 112.36 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.8 t80 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.225 -0.443 . . . . 73.22 110.91 -179.907 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.812 0.339 . . . . 75.14 110.918 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 72.88 88.49 0.16 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.746 -0.74 . . . . 64.21 112.507 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -160.25 90.17 0.88 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.744 0.307 . . . . 74.01 110.854 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -160.68 122.5 3.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 73.42 110.918 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -157.38 73.38 4.37 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.583 0.706 . . . . 74.52 110.914 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 103.24 1.14 Allowed 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.661 2.241 . . . . 74.1 112.33 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -173.7 71.22 0.36 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.557 0.694 . . . . 73.54 111.07 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 167.75 23.53 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.741 2.294 . . . . 71.23 112.329 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 112.29 3.05 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.683 2.255 . . . . 72.03 112.328 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -70.58 88.46 0.69 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 74.12 110.909 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -164.97 71.47 1.45 Allowed Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.568 0.699 . . . . 74.35 110.903 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 88.17 0.54 Allowed 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.66 2.24 . . . . 72.42 112.328 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 58.3 t80 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 74.54 110.928 -179.923 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.059 0 CA-C-O 120.877 0.37 . . . . 73.13 110.913 . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 100.87 116.2 3.98 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.759 -0.734 . . . . 72.23 112.458 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 62.32 49.47 4.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.708 0.289 . . . . 75.04 110.889 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -157.87 80.0 0.86 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 75.31 110.89 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -133.54 68.76 76.66 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.565 0.698 . . . . 73.24 110.974 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 -175.9 1.31 Allowed 'Trans proline' 0 C--N 1.341 0.132 0 C-N-CA 122.671 2.247 . . . . 74.13 112.339 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.64 72.38 49.8 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.573 0.702 . . . . 73.24 111.103 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 167.73 23.64 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.68 2.253 . . . . 73.11 112.327 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 -176.98 1.65 Allowed 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.725 2.283 . . . . 62.14 112.352 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -127.31 82.65 2.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 72.43 110.918 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 60.22 69.74 1.14 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.612 0.72 . . . . 74.13 110.884 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.72 -179.28 2.78 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.648 2.232 . . . . 75.42 112.342 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 75.24 110.948 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.832 0.349 . . . . 74.22 110.922 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -143.56 -93.67 0.18 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.727 -0.749 . . . . 52.32 112.481 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.16 27.1 2.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.762 0.315 . . . . 74.24 110.862 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.47 155.77 24.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 73.52 110.923 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.44 72.5 14.25 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.536 0.684 . . . . 74.24 110.879 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 132.57 23.57 Favored 'Trans proline' 0 C--O 1.231 0.148 0 C-N-CA 122.68 2.253 . . . . 72.43 112.31 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -123.23 68.51 37.77 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.593 0.711 . . . . 71.33 111.063 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 167.73 23.58 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.73 2.287 . . . . 74.53 112.331 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 88.69 0.54 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.673 2.249 . . . . 74.42 112.349 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.49 103.1 2.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 72.21 110.971 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.4 tp60 -144.9 73.3 14.91 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.596 0.713 . . . . 71.35 110.878 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 125.53 12.28 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.685 2.257 . . . . 54.43 112.378 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 59.9 t80 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.448 . . . . 75.11 110.905 -179.904 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.9 pp . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.873 0.368 . . . . 74.41 110.883 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 90.96 116.25 1.92 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.754 -0.736 . . . . 75.03 112.472 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -102.54 54.98 0.78 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.754 0.311 . . . . 75.4 110.952 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -90.43 102.18 14.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 73.22 110.904 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 52.03 69.47 2.43 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.569 0.7 . . . . 75.11 110.92 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 87.19 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.633 2.222 . . . . 71.25 112.324 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -150.19 71.75 9.3 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.584 0.707 . . . . 65.2 111.122 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 167.73 23.6 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.727 2.284 . . . . 61.33 112.335 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 79.53 0.95 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.687 2.258 . . . . 71.34 112.316 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -79.32 151.85 30.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.219 -0.446 . . . . 73.12 110.876 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 55.82 68.69 2.23 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.595 0.712 . . . . 75.51 110.892 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -174.94 0.99 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.655 2.237 . . . . 74.44 112.332 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 74.24 110.941 -179.928 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.871 0.367 . . . . 74.4 110.895 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -162.96 115.59 0.66 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.689 -0.767 . . . . 72.44 112.478 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -140.81 68.2 1.35 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.785 0.326 . . . . 70.33 110.941 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -167.06 47.48 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 73.43 110.919 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 51.99 69.21 2.58 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.583 0.706 . . . . 71.11 110.892 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 179.79 3.43 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.723 2.282 . . . . 71.33 112.348 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -140.5 72.93 30.55 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.583 0.706 . . . . 73.23 111.073 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 167.72 23.65 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.709 2.273 . . . . 74.54 112.331 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 127.07 14.04 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.641 2.227 . . . . 74.24 112.356 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -68.51 131.83 45.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 74.11 110.947 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -112.15 160.57 29.56 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.593 0.711 . . . . 75.34 110.925 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 147.21 62.37 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.706 2.27 . . . . 74.54 112.342 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.228 -0.442 . . . . 74.43 110.895 -179.881 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.7 pp . . . . . 0 C--O 1.23 0.038 0 CA-C-O 120.882 0.372 . . . . 73.5 110.905 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 88.07 56.63 2.03 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.736 -0.745 . . . . 61.34 112.506 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.3 85.93 0.8 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.767 0.318 . . . . 74.11 110.919 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 56.67 88.96 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 74.31 110.932 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -130.35 160.58 65.11 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.595 0.712 . . . . 71.53 110.927 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 120.57 7.34 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.742 2.295 . . . . 62.14 112.36 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 53.73 72.82 1.03 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.581 0.705 . . . . 75.34 111.079 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 167.72 23.67 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.69 2.26 . . . . 65.22 112.361 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 174.87 8.88 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.725 2.283 . . . . 73.32 112.356 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -108.71 140.91 41.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.248 -0.433 . . . . 72.53 110.894 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -143.89 69.58 16.64 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.574 0.702 . . . . 70.55 110.921 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -172.8 0.61 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.702 2.268 . . . . 74.52 112.324 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 14.0 t80 . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 71.1 110.938 -179.928 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.23 0.047 0 CA-C-O 120.855 0.36 . . . . 75.33 110.908 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -173.02 69.3 0.1 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.753 -0.737 . . . . 61.25 112.478 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -101.37 60.71 0.91 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.741 0.305 . . . . 74.1 110.879 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -153.47 117.14 4.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 72.22 110.912 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 54.34 73.1 0.95 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.57 0.7 . . . . 72.01 110.912 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 118.05 5.45 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.714 2.276 . . . . 71.54 112.373 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -164.42 68.29 1.46 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.609 0.719 . . . . 74.25 111.134 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.82 167.76 23.58 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.681 2.254 . . . . 55.14 112.304 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 116.28 4.49 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.708 2.272 . . . . 61.21 112.303 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -78.86 102.99 8.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 73.21 110.921 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.58 160.56 25.7 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.602 0.715 . . . . 75.22 110.928 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 169.59 18.5 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.703 2.269 . . . . 75.12 112.295 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 74.51 110.944 -179.978 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.229 0.022 0 CA-C-O 120.88 0.371 . . . . 74.24 110.919 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -175.74 -67.9 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.761 -0.733 . . . . 64.22 112.469 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -148.01 47.08 1.08 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.723 0.297 . . . . 73.24 110.93 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -149.1 28.03 0.84 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.456 . . . . 70.13 110.958 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -153.05 70.38 7.01 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.585 0.707 . . . . 75.03 110.888 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 128.57 16.23 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.681 2.254 . . . . 72.12 112.329 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 59.25 72.04 0.86 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.554 0.693 . . . . 70.4 111.104 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 167.73 23.58 Favored 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.685 2.257 . . . . 74.43 112.406 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.82 178.53 4.51 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.676 2.251 . . . . 74.43 112.315 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -123.81 176.83 6.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.449 . . . . 74.11 110.933 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -144.36 160.6 47.92 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.579 0.704 . . . . 71.01 110.936 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 138.06 37.03 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.682 2.255 . . . . 75.51 112.329 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 73.24 110.95 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.856 0.36 . . . . 74.54 110.922 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -157.53 74.73 0.22 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.729 -0.748 . . . . 74.23 112.488 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 58.97 55.29 4.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.701 0.286 . . . . 73.52 110.876 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -81.9 140.49 34.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 71.01 110.879 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.4 160.57 78.61 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.571 0.701 . . . . 72.33 110.888 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 156.11 64.09 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.674 2.25 . . . . 75.2 112.336 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 58.16 68.84 1.68 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.587 0.708 . . . . 74.33 111.136 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.72 167.75 23.48 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.655 2.236 . . . . 64.31 112.318 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 155.79 64.97 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.682 2.255 . . . . 72.42 112.35 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.45 141.82 47.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 71.5 110.929 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 54.67 73.04 0.95 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.602 0.715 . . . . 72.42 110.924 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 88.51 0.54 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.667 2.245 . . . . 74.42 112.327 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 64.31 110.941 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 9.0 tp . . . . . 0 C--O 1.23 0.027 0 CA-C-O 120.892 0.377 . . . . 73.45 110.914 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -131.18 -117.8 1.93 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.703 -0.761 . . . . 72.11 112.496 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -139.99 88.59 2.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.76 0.314 . . . . 74.12 110.901 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -144.8 94.96 2.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 63.53 110.918 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.1 160.56 11.34 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.621 0.724 . . . . 75.34 110.92 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 86.23 0.59 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.692 2.261 . . . . 62.13 112.341 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.82 73.34 4.15 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.545 0.688 . . . . 73.35 111.068 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 167.77 23.5 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.667 2.245 . . . . 73.34 112.367 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 172.23 13.04 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.685 2.257 . . . . 74.4 112.279 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -123.1 125.0 44.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.164 -0.471 . . . . 74.03 110.911 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 53.82 68.34 2.9 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.592 0.71 . . . . 75.5 110.943 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.69 157.39 60.67 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.653 2.235 . . . . 72.33 112.359 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.3 t80 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 75.12 110.93 -179.919 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.808 0.337 . . . . 75.04 110.961 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -63.35 -50.93 58.69 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.718 -0.753 . . . . 73.2 112.474 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 52.77 30.83 9.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.691 0.281 . . . . 73.54 110.844 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -55.54 137.66 48.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 73.44 110.907 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 61.26 69.86 0.99 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.601 0.715 . . . . 74.25 110.858 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -177.03 1.69 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.7 2.266 . . . . 63.31 112.332 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 63.65 160.42 0.12 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.617 0.723 . . . . 74.15 111.142 179.916 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 167.76 23.48 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.685 2.257 . . . . 74.34 112.351 -179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 171.16 14.98 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.703 2.269 . . . . 71.53 112.342 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -107.78 83.67 1.83 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 74.0 110.94 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -141.6 68.99 25.61 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.589 0.709 . . . . 71.23 110.896 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 83.94 0.68 Allowed 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.699 2.266 . . . . 73.43 112.352 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.253 -0.431 . . . . 74.3 110.893 -179.887 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.82 0.343 . . . . 75.5 110.951 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 168.43 115.62 0.33 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.756 -0.735 . . . . 74.0 112.508 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -166.35 45.1 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.76 0.314 . . . . 75.5 110.951 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -146.99 119.52 8.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 72.31 110.881 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 61.21 70.8 0.87 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.59 0.71 . . . . 75.32 110.879 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 89.05 0.53 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.703 2.269 . . . . 75.24 112.352 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -105.88 160.37 26.36 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.617 0.722 . . . . 74.22 111.061 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.75 167.76 23.51 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.666 2.244 . . . . 74.22 112.332 -179.986 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 142.08 46.96 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.723 2.282 . . . . 74.31 112.327 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.9 27.54 8.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.247 -0.433 . . . . 73.34 110.885 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 58.62 72.16 0.89 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.599 0.714 . . . . 73.13 110.921 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 93.82 0.52 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.696 2.264 . . . . 63.13 112.32 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 56.4 t80 . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 75.41 110.929 -179.931 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.2 pp . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.869 0.366 . . . . 74.23 110.87 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 109.1 46.03 0.97 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.693 -0.765 . . . . 54.14 112.53 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -152.06 31.83 0.54 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.736 0.303 . . . . 74.13 110.927 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -136.87 147.29 46.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 64.33 110.937 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -136.24 73.28 57.8 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.569 0.7 . . . . 73.52 110.939 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 173.57 10.77 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.631 2.221 . . . . 75.24 112.32 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -82.64 160.42 61.58 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.581 0.705 . . . . 75.44 111.106 179.9 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 167.77 23.47 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.634 2.223 . . . . 74.42 112.318 -179.967 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.81 119.99 6.84 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.66 2.24 . . . . 64.41 112.293 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -108.04 27.34 9.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 72.04 110.908 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 59.5 69.66 1.25 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.61 0.719 . . . . 74.14 110.881 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 123.44 10.12 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.673 2.249 . . . . 61.04 112.389 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.5 t80 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.445 . . . . 74.14 110.92 -179.904 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.883 0.373 . . . . 74.31 110.867 . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 65.48 60.38 6.71 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.773 -0.727 . . . . 42.14 112.475 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.68 28.94 0.61 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.749 0.309 . . . . 64.21 110.939 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.33 149.72 24.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 71.15 110.917 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -114.05 160.6 31.77 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.599 0.714 . . . . 75.24 110.95 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 141.89 46.45 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.692 2.261 . . . . 74.43 112.351 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 52.46 73.68 0.91 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.572 0.701 . . . . 75.01 111.066 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 167.76 23.49 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.68 2.254 . . . . 72.42 112.38 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 135.83 31.51 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.691 2.261 . . . . 71.02 112.346 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -107.67 175.15 5.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 73.1 110.892 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -124.73 160.62 52.89 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.553 0.692 . . . . 74.14 110.92 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.82 91.17 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.699 2.266 . . . . 70.54 112.307 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.454 . . . . 70.44 110.925 -179.922 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.872 0.368 . . . . 74.11 110.926 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 93.26 46.72 3.22 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.767 -0.73 . . . . 64.1 112.489 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -102.23 31.3 4.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.78 0.324 . . . . 75.4 110.959 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.438 ' NE2' ' H ' ' A' ' 5' ' ' GLN . 0.0 OUTLIER -56.71 168.91 0.54 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 72.21 110.922 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . 0.438 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 1.4 mp0 -105.62 160.56 25.65 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.562 0.696 . . . . 70.1 110.932 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 153.78 68.79 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.688 2.259 . . . . 75.21 112.39 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 51.94 68.8 2.88 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.548 0.689 . . . . 62.23 111.067 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 167.72 23.71 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.698 2.265 . . . . 73.24 112.348 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 91.51 0.51 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.663 2.242 . . . . 63.54 112.377 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.37 162.92 26.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 75.44 110.902 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -71.86 160.54 82.36 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.564 0.697 . . . . 75.45 110.928 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.75 148.26 64.75 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.669 2.246 . . . . 60.34 112.354 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 22.7 t80 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.226 -0.443 . . . . 72.24 110.922 -179.916 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 4.3 pp . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.86 0.362 . . . . 74.13 110.873 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -163.03 -114.22 0.31 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.76 -0.734 . . . . 70.4 112.496 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 53.32 62.31 2.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.743 0.306 . . . . 74.32 110.924 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.29 104.53 4.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.248 -0.433 . . . . 75.24 110.961 -179.947 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -87.5 160.57 47.61 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.593 0.711 . . . . 74.24 110.931 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 164.69 33.62 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.663 2.242 . . . . 73.11 112.343 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 53.48 68.25 3.05 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.599 0.714 . . . . 74.24 111.132 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 167.66 23.76 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.723 2.282 . . . . 74.53 112.352 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.74 177.15 5.86 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.684 2.256 . . . . 74.12 112.336 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -66.81 171.65 5.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 74.31 110.874 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -134.73 160.56 67.98 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.625 0.726 . . . . 72.33 110.924 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 -175.34 1.13 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.694 2.263 . . . . 74.54 112.328 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.8 t80 . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 72.23 110.942 -179.927 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.044 0 CA-C-O 120.844 0.354 . . . . 64.1 110.921 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -151.76 -85.74 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.741 -0.742 . . . . 74.42 112.496 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 61.1 mt-30 56.5 87.54 0.06 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.774 0.321 . . . . 72.45 110.942 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -75.96 135.24 40.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 72.13 110.898 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -76.8 160.54 76.51 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.617 0.722 . . . . 75.32 110.909 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.7 90.42 0.51 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.696 2.264 . . . . 74.0 112.371 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.78 73.33 16.92 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.606 0.717 . . . . 65.32 111.148 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 167.71 23.62 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.718 2.279 . . . . 70.25 112.306 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 140.56 43.14 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.712 2.275 . . . . 73.31 112.32 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.75 165.07 13.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 72.45 110.94 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -142.3 160.56 54.23 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.594 0.712 . . . . 73.12 110.934 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 -177.08 1.71 Allowed 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.677 2.252 . . . . 73.25 112.333 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 74.42 110.903 -179.891 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.846 0.355 . . . . 74.54 110.937 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 69.1 25.92 75.06 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.75 -0.738 . . . . 54.1 112.479 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.2 mm100 -124.65 68.67 1.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.758 0.313 . . . . 73.33 110.941 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -75.87 137.94 40.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 74.24 110.9 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -119.68 160.58 41.69 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.612 0.72 . . . . 75.35 110.909 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 146.84 61.26 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.652 2.235 . . . . 71.55 112.329 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -149.56 68.8 9.29 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.603 0.716 . . . . 63.12 111.057 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 167.73 23.59 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.661 2.241 . . . . 74.44 112.338 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 133.22 25.1 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.68 2.253 . . . . 72.41 112.368 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -106.94 98.26 7.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 72.41 110.896 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -179.26 73.5 0.2 Allowed Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.568 0.699 . . . . 75.14 110.918 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.8 136.12 32.07 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.697 2.265 . . . . 71.34 112.324 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 72.31 110.943 -179.942 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.2 pp . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.887 0.375 . . . . 71.32 110.924 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -171.42 -125.68 0.83 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.75 -0.738 . . . . 74.03 112.475 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -129.86 31.34 4.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.742 0.306 . . . . 73.41 110.958 -179.899 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -153.58 88.25 1.27 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 71.45 110.877 -179.874 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -71.59 160.56 82.23 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.556 0.694 . . . . 71.14 110.921 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 156.75 62.57 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.666 2.244 . . . . 74.11 112.323 179.996 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 63.73 160.4 0.12 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.637 0.732 . . . . 54.22 111.038 179.823 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 167.7 23.66 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.692 2.262 . . . . 75.33 112.304 -179.989 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 145.75 58.4 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.662 2.242 . . . . 75.14 112.385 179.926 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -63.12 159.41 17.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 73.22 110.895 179.998 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 53.14 70.78 1.65 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.599 0.714 . . . . 74.13 110.956 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -179.09 2.65 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.713 2.275 . . . . 74.15 112.322 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.215 -0.448 . . . . 72.44 110.942 -179.916 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.23 0.048 0 CA-C-O 120.836 0.351 . . . . 75.11 110.916 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 160.94 -26.63 0.28 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.753 -0.737 . . . . 74.12 112.483 179.859 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.78 26.12 3.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.719 0.295 . . . . 72.05 110.9 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -95.83 133.9 39.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 73.21 110.935 -179.939 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -98.72 160.58 27.55 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.599 0.714 . . . . 75.24 110.884 -179.945 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 146.54 60.64 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.684 2.256 . . . . 72.25 112.357 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -148.69 160.45 35.85 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.622 0.725 . . . . 75.52 111.082 179.857 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 167.68 23.69 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.715 2.277 . . . . 75.41 112.357 -179.98 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 115.16 3.96 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.688 2.259 . . . . 75.34 112.396 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -137.14 129.02 29.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 62.22 110.926 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -134.54 68.54 72.5 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.595 0.712 . . . . 75.31 110.895 -179.945 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.85 157.21 60.96 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.689 2.259 . . . . 73.31 112.344 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.204 -0.453 . . . . 74.3 110.926 -179.888 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.809 0.338 . . . . 73.43 110.932 . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -64.69 -66.4 2.5 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.759 -0.734 . . . . 61.44 112.456 179.915 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 59.89 86.96 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.766 0.317 . . . . 74.33 110.915 -179.854 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -148.46 95.4 2.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 71.33 110.929 -179.956 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -96.48 160.56 29.3 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.627 0.727 . . . . 74.45 110.868 -179.915 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 155.36 66.42 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.718 2.279 . . . . 75.32 112.34 179.977 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -112.37 160.39 30.47 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.607 0.718 . . . . 74.42 111.117 179.843 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.75 167.71 23.64 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.72 2.28 . . . . 72.24 112.35 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 109.58 2.34 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.737 2.291 . . . . 75.22 112.328 179.973 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.51 123.68 50.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 73.3 110.909 -179.974 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -124.74 71.68 60.21 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.616 0.722 . . . . 74.22 110.949 -179.956 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 143.37 50.64 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.694 2.263 . . . . 72.24 112.324 -179.992 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.7 p90 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.227 -0.442 . . . . 73.23 110.93 -179.928 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.895 0.379 . . . . 75.55 110.911 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.18 134.24 1.26 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.711 -0.757 . . . . 63.4 112.445 179.878 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -105.38 29.03 6.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.726 0.298 . . . . 74.44 110.896 -179.9 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -155.92 115.05 3.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.23 -0.441 . . . . 65.3 110.883 -179.929 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -76.19 160.58 77.71 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.629 0.728 . . . . 75.21 110.887 -179.953 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 144.29 53.47 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.698 2.265 . . . . 72.21 112.354 -179.98 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -88.07 160.45 46.12 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.615 0.721 . . . . 74.23 111.065 179.937 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 167.76 23.54 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.668 2.245 . . . . 64.54 112.343 -179.957 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 107.2 1.8 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.704 2.269 . . . . 73.14 112.359 179.936 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -57.67 150.8 18.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 72.11 110.907 -179.988 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -125.75 73.31 69.61 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.578 0.704 . . . . 70.41 110.929 -179.972 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 152.06 69.41 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.675 2.25 . . . . 74.52 112.383 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.24 -0.436 . . . . 73.24 110.924 -179.918 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.2 tt . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.836 0.351 . . . . 74.11 110.896 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 66.31 29.07 74.22 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.74 -0.743 . . . . 61.45 112.518 179.919 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.06 64.74 3.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.763 0.316 . . . . 72.43 110.878 -179.85 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -162.69 101.34 1.03 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.191 -0.459 . . . . 74.51 110.904 -179.97 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -87.43 160.61 47.73 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.58 0.705 . . . . 73.12 110.923 -179.936 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 88.92 0.53 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.673 2.248 . . . . 71.23 112.36 179.979 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.96 160.41 29.92 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.571 0.701 . . . . 73.43 111.104 179.884 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.69 167.75 23.45 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.691 2.261 . . . . 75.34 112.349 179.991 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.83 179.79 3.48 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.662 2.242 . . . . 73.33 112.341 179.936 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -79.14 139.85 37.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.455 . . . . 73.41 110.879 -179.937 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -156.8 73.27 4.7 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.588 0.709 . . . . 75.24 110.915 179.997 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 126.76 13.69 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.683 2.255 . . . . 74.53 112.374 179.933 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 75.5 110.914 -179.907 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.814 0.34 . . . . 70.13 110.951 . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -160.0 73.85 0.21 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.726 -0.749 . . . . 32.04 112.455 179.922 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 58.73 40.68 22.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.706 0.289 . . . . 75.0 110.929 -179.878 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -91.85 51.98 1.93 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 72.53 110.909 -179.942 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 51.97 70.59 1.84 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.61 0.719 . . . . 73.24 110.922 -179.901 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 92.52 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.684 2.256 . . . . 73.51 112.328 -179.993 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -173.14 160.41 3.52 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.598 0.713 . . . . 74.45 111.108 179.878 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.74 167.76 23.5 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.667 2.245 . . . . 73.53 112.359 179.991 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 118.19 5.53 Favored 'Trans proline' 0 N--CA 1.466 -0.138 0 C-N-CA 122.696 2.264 . . . . 65.44 112.359 179.944 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -121.17 28.48 7.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.442 . . . . 72.22 110.931 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 63.3 160.62 0.12 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.646 0.736 . . . . 74.4 110.886 -179.936 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 177.56 5.5 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.67 2.247 . . . . 52.12 112.307 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 74.43 110.912 -179.896 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.879 0.371 . . . . 74.0 110.873 . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -155.79 33.42 0.62 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.723 -0.751 . . . . 52.24 112.48 179.886 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -129.42 28.27 5.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.701 0.286 . . . . 72.33 110.892 -179.913 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -53.28 153.31 3.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.25 -0.432 . . . . 74.55 110.899 -179.958 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -108.55 160.55 26.76 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.61 0.719 . . . . 75.31 110.929 -179.943 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 153.78 68.64 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.706 2.271 . . . . 62.23 112.364 179.981 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -167.85 160.42 9.75 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.596 0.713 . . . . 71.05 111.115 179.874 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 167.7 23.61 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.702 2.268 . . . . 74.55 112.341 179.96 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 133.44 25.57 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.683 2.256 . . . . 64.24 112.313 179.912 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.15 126.29 26.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 74.2 110.895 179.993 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -152.69 160.56 30.96 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.601 0.715 . . . . 74.12 110.936 -179.958 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 157.82 59.15 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.683 2.255 . . . . 73.35 112.357 -179.983 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.441 . . . . 73.32 110.912 -179.904 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.04 0 CA-C-O 120.854 0.359 . . . . 75.41 110.904 . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 111.95 40.1 1.22 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.678 -0.772 . . . . 73.44 112.451 179.918 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -122.05 55.43 1.13 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.724 0.297 . . . . 73.55 110.896 -179.877 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -139.42 149.36 43.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 74.05 110.92 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -61.52 160.54 24.74 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.642 0.734 . . . . 74.13 110.897 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.7 169.16 19.49 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.697 2.265 . . . . 72.21 112.384 179.958 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -102.41 160.42 26.38 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.597 0.713 . . . . 72.01 111.089 179.867 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 167.74 23.63 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.678 2.252 . . . . 54.24 112.353 179.991 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 160.82 48.29 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.728 2.285 . . . . 73.35 112.343 179.973 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -76.47 174.22 10.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 73.34 110.877 -179.95 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -125.7 160.55 55.59 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.575 0.702 . . . . 75.43 110.928 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 148.55 65.71 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.713 2.275 . . . . 72.25 112.337 -180.0 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 116.259 -0.428 . . . . 71.34 110.89 -179.92 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.84 0.352 . . . . 73.53 110.871 . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 109.31 28.17 4.46 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.72 -0.752 . . . . 62.43 112.5 179.877 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -149.43 86.69 1.48 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.724 0.297 . . . . 74.21 110.951 -179.887 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -143.03 146.63 34.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 70.04 110.895 -179.933 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.6 160.57 32.58 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.656 0.741 . . . . 75.2 110.882 -179.937 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 104.4 1.31 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.732 2.288 . . . . 73.34 112.322 179.99 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -57.87 160.39 8.41 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.59 0.709 . . . . 74.03 111.104 179.86 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 167.7 23.65 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.694 2.263 . . . . 64.11 112.392 179.96 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 120.08 6.92 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.696 2.264 . . . . 75.34 112.339 179.976 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -101.0 151.66 21.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.234 -0.439 . . . . 73.42 110.915 -179.969 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -119.25 160.54 40.95 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.56 0.695 . . . . 75.34 110.929 -179.951 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 -176.35 1.44 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.666 2.244 . . . . 75.02 112.396 179.918 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 55.4 t80 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 73.24 110.959 -179.927 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.5 tp . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.823 0.344 . . . . 71.22 110.933 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 159.4 -88.83 0.11 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.719 -0.753 . . . . 62.42 112.447 179.883 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -112.55 56.53 0.67 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.707 0.289 . . . . 64.24 110.882 -179.842 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.23 97.97 3.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 72.33 110.925 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -113.02 160.57 30.46 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.621 0.724 . . . . 74.33 110.905 -179.932 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 97.78 0.65 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.7 2.266 . . . . 55.32 112.378 179.972 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -165.02 160.44 14.81 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.602 0.715 . . . . 63.42 111.077 179.919 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.84 167.72 23.73 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.652 2.235 . . . . 75.25 112.345 -179.996 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 122.73 9.41 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.651 2.234 . . . . 62.25 112.362 179.963 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.73 122.48 10.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 74.04 110.876 -179.95 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -92.58 160.54 34.35 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.588 0.708 . . . . 64.41 110.94 -179.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 -177.36 1.83 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.719 2.279 . . . . 72.23 112.384 179.951 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 52.5 t80 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 74.22 110.928 -179.877 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.876 0.37 . . . . 75.3 110.965 . . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -179.12 40.12 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.69 -0.767 . . . . 75.33 112.452 179.924 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -145.16 43.35 1.31 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.768 0.318 . . . . 73.31 110.89 -179.878 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -82.62 107.25 15.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 74.5 110.906 -179.954 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.54 160.51 25.83 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.612 0.72 . . . . 75.34 110.95 -179.965 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 122.28 8.96 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.685 2.256 . . . . 73.2 112.349 179.972 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -111.16 160.43 29.08 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.566 0.698 . . . . 74.5 111.113 179.859 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 167.74 23.56 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.681 2.254 . . . . 73.12 112.382 179.966 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 168.99 20.01 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.669 2.246 . . . . 73.15 112.299 -179.992 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.22 170.33 7.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 72.11 110.925 -179.992 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -132.81 160.6 67.84 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.61 0.719 . . . . 74.21 110.92 -179.97 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 120.69 7.44 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.731 2.287 . . . . 75.13 112.303 -179.971 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 72.34 110.958 -179.942 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.868 0.366 . . . . 65.21 110.91 . . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 99.05 104.39 2.51 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.74 -0.743 . . . . 75.31 112.52 179.936 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -132.39 79.28 1.85 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.74 0.305 . . . . 73.53 110.925 -179.915 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.96 146.7 29.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 74.41 110.896 -179.918 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -165.2 70.05 1.35 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.558 0.694 . . . . 53.22 110.884 -179.929 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -175.6 1.2 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.664 2.242 . . . . 73.24 112.345 179.954 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -81.36 160.45 65.01 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.619 0.723 . . . . 75.04 111.099 179.891 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 167.72 23.7 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.68 2.254 . . . . 74.04 112.346 -179.983 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 149.59 67.49 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.728 2.285 . . . . 63.25 112.346 179.924 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.55 155.01 31.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.204 -0.453 . . . . 72.24 110.922 -179.996 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.2 tp60 -165.87 68.64 1.17 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.583 0.706 . . . . 63.01 110.902 -179.931 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -177.63 1.98 Allowed 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.667 2.245 . . . . 63.31 112.312 -179.984 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.4 p90 . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 74.31 110.936 -179.928 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.23 0.044 0 CA-C-O 120.87 0.367 . . . . 73.21 110.894 . . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 171.77 107.8 0.2 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.754 -0.736 . . . . 72.31 112.524 179.898 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -110.9 54.92 0.66 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.74 0.305 . . . . 74.05 110.872 -179.864 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 54.83 84.55 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 71.14 110.882 179.998 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.85 160.57 73.88 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.597 0.713 . . . . 75.3 110.935 -179.98 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 120.93 7.64 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.645 2.23 . . . . 72.31 112.369 179.977 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -167.38 73.25 1.0 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.636 0.732 . . . . 72.51 111.116 179.861 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 167.71 23.76 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.714 2.276 . . . . 74.54 112.317 -179.939 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.72 102.11 0.98 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.65 2.234 . . . . 74.54 112.316 179.99 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.08 129.98 52.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.44 . . . . 72.31 110.899 179.99 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -143.05 157.57 60.47 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.657 0.741 . . . . 70.11 110.878 -179.956 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 134.0 26.84 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.694 2.263 . . . . 71.31 112.332 179.992 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 75.44 110.897 -179.855 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.057 0 CA-C-O 120.854 0.359 . . . . 74.41 110.959 . . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -146.39 -102.96 0.34 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.743 -0.741 . . . . 71.13 112.49 179.929 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 52.6 31.82 10.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.762 0.315 . . . . 73.41 110.902 -179.903 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 52.45 57.8 6.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.465 . . . . 71.42 110.89 -179.949 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -138.01 160.61 63.74 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.569 0.699 . . . . 64.22 110.944 179.998 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 85.62 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.14 0 C-N-CA 122.685 2.257 . . . . 63.41 112.335 -179.988 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -144.89 68.72 14.36 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.566 0.698 . . . . 75.45 111.073 179.888 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 167.72 23.65 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.668 2.245 . . . . 65.02 112.309 179.985 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 141.75 46.1 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.676 2.251 . . . . 75.01 112.341 179.945 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -118.2 123.72 46.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.17 -0.468 . . . . 74.11 110.922 179.99 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -127.85 157.58 73.17 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.607 0.718 . . . . 73.32 110.9 -179.941 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -179.01 2.64 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.677 2.251 . . . . 64.05 112.339 179.978 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.27 -0.423 . . . . 75.3 110.95 -179.939 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.826 0.346 . . . . 74.23 110.957 . . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 109.03 117.84 4.07 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.777 -0.725 . . . . 64.01 112.473 179.876 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -149.74 58.14 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.805 0.336 . . . . 74.12 110.894 -179.889 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.65 97.6 8.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 64.41 110.921 -179.993 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.79 160.42 0.12 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.662 0.744 . . . . 73.34 110.878 -179.975 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 118.15 5.51 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.656 2.238 . . . . 72.33 112.351 179.976 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -127.68 69.93 76.44 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.536 0.684 . . . . 71.42 111.087 179.88 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 167.72 23.62 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.703 2.268 . . . . 71.32 112.333 179.982 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 128.77 16.49 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.676 2.251 . . . . 75.44 112.321 179.966 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.8 131.61 45.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 70.53 110.929 179.98 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -140.9 70.47 29.43 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.618 0.723 . . . . 75.41 110.913 -179.957 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.81 112.27 3.04 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.637 2.225 . . . . 75.34 112.343 -179.959 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.175 -0.466 . . . . 64.42 110.882 -179.861 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.817 0.342 . . . . 74.41 110.934 . . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 141.82 97.68 0.29 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.747 -0.74 . . . . 74.42 112.488 179.903 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.76 -19.13 25.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.755 0.312 . . . . 72.42 110.927 -179.894 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -173.37 55.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 72.41 110.876 -179.907 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -153.27 157.53 32.88 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.59 0.709 . . . . 73.25 110.939 -179.952 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 113.41 3.37 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.713 2.275 . . . . 73.34 112.293 -179.98 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.81 160.41 50.31 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.577 0.703 . . . . 73.25 111.076 179.874 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 167.73 23.59 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.703 2.268 . . . . 75.44 112.335 -179.983 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 161.71 44.87 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.717 2.278 . . . . 73.54 112.331 179.941 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -71.76 136.84 47.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 75.32 110.892 -179.996 . . . . . . . . 2 2 . 1 . 036 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -161.91 73.3 2.37 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.617 0.722 . . . . 75.42 110.952 -179.982 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 125.46 12.16 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.695 2.263 . . . . 72.13 112.285 -179.942 . . . . . . . . 1 1 . 1 . 036 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 15.8 t80 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 75.4 110.92 -179.955 . . . . . . . . 0 0 . 1 . 037 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.833 0.349 . . . . 74.34 110.903 . . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -167.62 -64.62 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.728 -0.749 . . . . 73.51 112.485 179.87 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -100.59 52.81 0.87 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.833 0.349 . . . . 75.44 110.951 -179.932 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -166.95 132.97 2.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.464 . . . . 74.32 110.92 -179.973 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -143.51 160.56 50.73 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.629 0.728 . . . . 75.01 110.916 -179.994 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.67 113.22 3.29 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.694 2.263 . . . . 74.51 112.344 179.989 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -104.72 160.43 26.03 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.58 0.705 . . . . 74.03 111.088 179.861 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.8 167.76 23.57 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.676 2.251 . . . . 75.11 112.365 -179.986 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 175.28 8.3 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.674 2.25 . . . . 75.51 112.352 179.96 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.77 151.92 10.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 63.25 110.949 179.995 . . . . . . . . 2 2 . 1 . 037 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -151.11 157.54 35.18 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.615 0.721 . . . . 70.1 110.904 -179.945 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.69 118.14 5.5 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.71 2.273 . . . . 73.2 112.322 179.986 . . . . . . . . 1 1 . 1 . 037 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.3 t80 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 72.21 110.932 -179.964 . . . . . . . . 0 0 . 1 . 038 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.038 0 CA-C-O 120.858 0.361 . . . . 71.41 110.916 . . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -97.97 -108.07 2.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.745 -0.74 . . . . 73.1 112.531 179.853 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -140.63 46.51 1.79 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.75 0.309 . . . . 74.4 110.942 -179.912 . . . . . . . . 2 2 . 1 . 038 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -96.84 160.79 14.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 71.43 110.935 -179.958 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -174.98 157.56 2.13 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 121.606 0.717 . . . . 74.03 110.875 -179.953 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 111.45 2.81 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.65 2.234 . . . . 75.0 112.362 179.987 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -117.71 160.44 38.38 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.582 0.706 . . . . 71.12 111.081 179.893 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 167.74 23.61 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.701 2.268 . . . . 63.33 112.361 -179.994 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 113.24 3.31 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.699 2.266 . . . . 73.22 112.33 179.997 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -61.19 166.03 4.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 73.44 110.897 -179.966 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -54.97 160.56 2.92 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.568 0.699 . . . . 75.5 110.929 -179.936 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.67 -178.63 2.4 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.694 2.262 . . . . 73.32 112.359 -179.999 . . . . . . . . 1 1 . 1 . 038 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 19.0 t80 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 75.15 110.928 -179.957 . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.3 pp . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.896 0.379 . . . . 75.44 110.869 . . . . . . . . . 0 0 . 1 . 039 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -88.05 -95.86 0.97 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.721 -0.752 . . . . 64.41 112.523 179.885 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -107.34 74.02 0.95 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.74 0.305 . . . . 73.41 110.894 -179.887 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 58.65 70.94 0.61 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 73.22 110.906 -179.949 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 62.77 160.46 0.12 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.561 0.696 . . . . 72.31 110.917 -179.974 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.8 175.09 8.6 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.684 2.256 . . . . 75.51 112.292 -179.947 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 63.64 160.45 0.12 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.579 0.704 . . . . 73.0 111.094 179.894 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 167.77 23.47 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.631 2.221 . . . . 71.41 112.356 -179.994 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.83 171.31 14.78 Favored 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.668 2.245 . . . . 73.01 112.329 179.955 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -124.4 135.48 53.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 70.31 110.94 -179.953 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -146.77 70.71 12.46 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.629 0.728 . . . . 75.4 110.902 -179.915 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.82 -178.23 2.26 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.632 2.221 . . . . 73.11 112.278 -179.968 . . . . . . . . 1 1 . 1 . 039 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 22.2 t80 . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.191 -0.459 . . . . 64.42 110.876 -179.947 . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.9 pp . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.794 0.331 . . . . 74.41 110.929 . . . . . . . . . 0 0 . 1 . 040 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 110.64 -63.71 0.27 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.732 -0.747 . . . . 54.0 112.465 179.909 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 62.72 98.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.739 0.304 . . . . 75.12 110.897 -179.876 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -148.86 135.32 19.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 74.14 110.9 -179.962 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -79.91 160.56 68.63 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.556 0.693 . . . . 72.41 110.942 179.997 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.8 116.44 4.56 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.616 2.211 . . . . 74.31 112.353 179.979 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -166.37 160.43 12.25 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.585 0.707 . . . . 64.15 111.104 179.884 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 167.76 23.56 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.651 2.234 . . . . 73.34 112.352 179.983 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 90.66 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.712 2.274 . . . . 75.32 112.297 179.987 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 53.2 tp60 -106.39 148.65 27.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 65.44 110.956 179.964 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -112.08 78.05 2.26 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.587 0.708 . . . . 74.2 110.896 -179.911 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 88.34 0.54 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.688 2.259 . . . . 75.32 112.365 179.963 . . . . . . . . 1 1 . 1 . 040 nuclear orig full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 75.54 110.895 -179.864 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.836 0.35 . . . . 72.31 110.925 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 105.62 -90.81 0.71 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.733 -0.746 . . . . 54.23 112.51 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -133.53 29.82 3.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.758 0.313 . . . . 70.32 110.925 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -99.68 147.94 24.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 72.01 110.938 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.2 pm0 -145.46 157.57 52.15 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.6 0.714 . . . . 74.24 110.939 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 84.19 0.67 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.682 2.255 . . . . 73.53 112.34 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.585 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -62.09 160.42 30.66 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.609 0.719 . . . . 75.11 111.102 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.585 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.2 Cg_endo -69.77 167.74 23.58 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.696 2.264 . . . . 61.34 112.301 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 142.19 47.4 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.679 2.253 . . . . 64.33 112.36 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -108.97 110.52 21.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 74.32 110.901 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -140.24 72.55 32.47 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.622 0.725 . . . . 72.31 110.928 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 134.47 28.13 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.722 2.282 . . . . 71.31 112.325 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 75.12 110.914 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.23 0.042 0 CA-C-O 120.872 0.368 . . . . 75.31 110.931 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 175.25 133.33 1.72 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.703 -0.761 . . . . 44.45 112.495 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -105.69 39.54 1.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.76 0.314 . . . . 74.22 110.915 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -87.36 57.45 4.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 62.33 110.909 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -132.82 70.02 79.05 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.585 0.707 . . . . 74.22 110.938 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.74 165.14 31.97 Favored 'Trans proline' 0 C--N 1.34 0.127 0 C-N-CA 122.697 2.264 . . . . 45.3 112.354 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -125.09 70.93 62.05 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.575 0.703 . . . . 75.4 111.054 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 167.8 23.43 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.607 2.205 . . . . 64.51 112.368 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 141.1 44.23 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 122.729 2.286 . . . . 75.22 112.375 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.48 153.37 27.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 72.2 110.912 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 54.48 69.18 2.22 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.611 0.719 . . . . 74.33 110.916 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.78 87.32 0.56 Allowed 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.66 2.24 . . . . 45.43 112.36 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.8 t80 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.225 -0.443 . . . . 65.43 110.91 -179.907 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.812 0.339 . . . . 75.14 110.918 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 72.88 88.49 0.16 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.746 -0.74 . . . . 53.45 112.507 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -160.25 90.17 0.88 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.744 0.307 . . . . 74.01 110.854 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -160.68 122.5 3.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 73.42 110.918 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -157.38 73.38 4.37 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.583 0.706 . . . . 73.53 110.914 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 103.24 1.14 Allowed 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.661 2.241 . . . . 54.32 112.33 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -173.7 71.22 0.36 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.557 0.694 . . . . 73.54 111.07 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 167.75 23.53 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.741 2.294 . . . . 71.23 112.329 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 112.29 3.05 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.683 2.255 . . . . 72.03 112.328 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -70.58 88.46 0.69 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 74.12 110.909 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -164.97 71.47 1.45 Allowed Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.568 0.699 . . . . 74.35 110.903 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 88.17 0.54 Allowed 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.66 2.24 . . . . 70.42 112.328 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 58.3 t80 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 74.54 110.928 -179.923 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.059 0 CA-C-O 120.877 0.37 . . . . 73.13 110.913 . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 100.87 116.2 3.98 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.759 -0.734 . . . . 32.41 112.458 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 62.32 49.47 4.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.708 0.289 . . . . 73.14 110.889 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -157.87 80.0 0.86 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 61.01 110.89 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -133.54 68.76 76.66 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.565 0.698 . . . . 64.21 110.974 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 -175.9 1.31 Allowed 'Trans proline' 0 C--N 1.341 0.132 0 C-N-CA 122.671 2.247 . . . . 71.45 112.339 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.64 72.38 49.8 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.573 0.702 . . . . 63.11 111.103 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 167.73 23.64 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.68 2.253 . . . . 73.11 112.327 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 -176.98 1.65 Allowed 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.725 2.283 . . . . 53.42 112.352 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -127.31 82.65 2.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 72.43 110.918 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 60.22 69.74 1.14 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.612 0.72 . . . . 74.13 110.884 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.72 -179.28 2.78 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.648 2.232 . . . . 75.42 112.342 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 71.15 110.948 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.832 0.349 . . . . 63.0 110.922 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -143.56 -93.67 0.18 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.727 -0.749 . . . . 52.32 112.481 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.16 27.1 2.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.762 0.315 . . . . 74.24 110.862 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.47 155.77 24.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 72.4 110.923 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.44 72.5 14.25 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.536 0.684 . . . . 74.12 110.879 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 132.57 23.57 Favored 'Trans proline' 0 C--O 1.231 0.148 0 C-N-CA 122.68 2.253 . . . . 72.43 112.31 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -123.23 68.51 37.77 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.593 0.711 . . . . 71.33 111.063 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 167.73 23.58 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.73 2.287 . . . . 74.53 112.331 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 88.69 0.54 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.673 2.249 . . . . 72.3 112.349 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.49 103.1 2.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 55.2 110.971 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.4 tp60 -144.9 73.3 14.91 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.596 0.713 . . . . 71.13 110.878 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 125.53 12.28 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.685 2.257 . . . . 54.43 112.378 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 59.9 t80 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.448 . . . . 75.11 110.905 -179.904 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.9 pp . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.873 0.368 . . . . 70.14 110.883 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 90.96 116.25 1.92 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.754 -0.736 . . . . 75.03 112.472 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -102.54 54.98 0.78 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.754 0.311 . . . . 75.4 110.952 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -90.43 102.18 14.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 73.22 110.904 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 52.03 69.47 2.43 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.569 0.7 . . . . 70.11 110.92 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 87.19 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.633 2.222 . . . . 71.14 112.324 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -150.19 71.75 9.3 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.584 0.707 . . . . 65.2 111.122 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 167.73 23.6 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.727 2.284 . . . . 61.33 112.335 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 79.53 0.95 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.687 2.258 . . . . 71.34 112.316 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -79.32 151.85 30.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.219 -0.446 . . . . 73.12 110.876 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 55.82 68.69 2.23 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.595 0.712 . . . . 75.51 110.892 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -174.94 0.99 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.655 2.237 . . . . 74.44 112.332 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 70.35 110.941 -179.928 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.871 0.367 . . . . 73.54 110.895 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -162.96 115.59 0.66 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.689 -0.767 . . . . 72.44 112.478 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -140.81 68.2 1.35 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.785 0.326 . . . . 55.02 110.941 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -167.06 47.48 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 73.13 110.919 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 51.99 69.21 2.58 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.583 0.706 . . . . 71.11 110.892 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 179.79 3.43 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.723 2.282 . . . . 52.02 112.348 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -140.5 72.93 30.55 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.583 0.706 . . . . 71.23 111.073 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 167.72 23.65 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.709 2.273 . . . . 72.34 112.331 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 127.07 14.04 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.641 2.227 . . . . 63.34 112.356 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -68.51 131.83 45.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 74.11 110.947 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -112.15 160.57 29.56 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.593 0.711 . . . . 53.41 110.925 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 147.21 62.37 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.706 2.27 . . . . 74.54 112.342 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.228 -0.442 . . . . 74.43 110.895 -179.881 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.7 pp . . . . . 0 C--O 1.23 0.038 0 CA-C-O 120.882 0.372 . . . . 73.5 110.905 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 88.07 56.63 2.03 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.736 -0.745 . . . . 61.34 112.506 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.3 85.93 0.8 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.767 0.318 . . . . 74.11 110.919 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 56.67 88.96 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 50.13 110.932 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -130.35 160.58 65.11 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.595 0.712 . . . . 71.23 110.927 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 120.57 7.34 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.742 2.295 . . . . 62.14 112.36 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 53.73 72.82 1.03 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.581 0.705 . . . . 54.51 111.079 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 167.72 23.67 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.69 2.26 . . . . 65.22 112.361 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 174.87 8.88 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.725 2.283 . . . . 64.11 112.356 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -108.71 140.91 41.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.248 -0.433 . . . . 72.53 110.894 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -143.89 69.58 16.64 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.574 0.702 . . . . 70.55 110.921 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -172.8 0.61 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.702 2.268 . . . . 74.22 112.324 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 14.0 t80 . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 54.44 110.938 -179.928 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.23 0.047 0 CA-C-O 120.855 0.36 . . . . 75.33 110.908 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -173.02 69.3 0.1 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.753 -0.737 . . . . 61.25 112.478 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -101.37 60.71 0.91 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.741 0.305 . . . . 73.31 110.879 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -153.47 117.14 4.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 62.44 110.912 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 54.34 73.1 0.95 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.57 0.7 . . . . 65.51 110.912 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 118.05 5.45 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.714 2.276 . . . . 65.14 112.373 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -164.42 68.29 1.46 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.609 0.719 . . . . 61.43 111.134 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.82 167.76 23.58 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.681 2.254 . . . . 55.14 112.304 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 116.28 4.49 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.708 2.272 . . . . 52.41 112.303 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -78.86 102.99 8.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 73.21 110.921 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -160.58 160.56 25.7 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.602 0.715 . . . . 74.42 110.928 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 169.59 18.5 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.703 2.269 . . . . 74.35 112.295 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 72.52 110.944 -179.978 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.229 0.022 0 CA-C-O 120.88 0.371 . . . . 62.31 110.919 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -175.74 -67.9 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.761 -0.733 . . . . 64.22 112.469 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -148.01 47.08 1.08 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.723 0.297 . . . . 73.24 110.93 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -149.1 28.03 0.84 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.456 . . . . 70.13 110.958 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -153.05 70.38 7.01 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.585 0.707 . . . . 75.03 110.888 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 128.57 16.23 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.681 2.254 . . . . 72.12 112.329 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 59.25 72.04 0.86 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.554 0.693 . . . . 61.33 111.104 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 167.73 23.58 Favored 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.685 2.257 . . . . 73.52 112.406 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.82 178.53 4.51 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.676 2.251 . . . . 74.43 112.315 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -123.81 176.83 6.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.449 . . . . 74.11 110.933 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -144.36 160.6 47.92 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.579 0.704 . . . . 71.01 110.936 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 138.06 37.03 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.682 2.255 . . . . 34.32 112.329 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 73.23 110.95 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.856 0.36 . . . . 74.54 110.922 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -157.53 74.73 0.22 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.729 -0.748 . . . . 74.23 112.488 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 58.97 55.29 4.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.701 0.286 . . . . 71.21 110.876 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -81.9 140.49 34.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 65.45 110.879 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.4 160.57 78.61 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.571 0.701 . . . . 72.33 110.888 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 156.11 64.09 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.674 2.25 . . . . 75.2 112.336 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 58.16 68.84 1.68 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.587 0.708 . . . . 74.33 111.136 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.72 167.75 23.48 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.655 2.236 . . . . 64.31 112.318 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 155.79 64.97 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.682 2.255 . . . . 63.33 112.35 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.45 141.82 47.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 71.5 110.929 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 54.67 73.04 0.95 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.602 0.715 . . . . 72.4 110.924 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 88.51 0.54 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.667 2.245 . . . . 74.42 112.327 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 64.31 110.941 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 9.0 tp . . . . . 0 C--O 1.23 0.027 0 CA-C-O 120.892 0.377 . . . . 63.42 110.914 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -131.18 -117.8 1.93 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.703 -0.761 . . . . 23.52 112.496 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -139.99 88.59 2.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.76 0.314 . . . . 74.12 110.901 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -144.8 94.96 2.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 63.51 110.918 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.1 160.56 11.34 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.621 0.724 . . . . 73.44 110.92 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 86.23 0.59 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.692 2.261 . . . . 51.31 112.341 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.82 73.34 4.15 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.545 0.688 . . . . 73.35 111.068 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 167.77 23.5 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.667 2.245 . . . . 73.24 112.367 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 172.23 13.04 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.685 2.257 . . . . 74.4 112.279 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -123.1 125.0 44.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.164 -0.471 . . . . 74.03 110.911 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 53.82 68.34 2.9 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.592 0.71 . . . . 72.24 110.943 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.69 157.39 60.67 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.653 2.235 . . . . 72.33 112.359 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.3 t80 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 75.12 110.93 -179.919 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.808 0.337 . . . . 75.04 110.961 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -63.35 -50.93 58.69 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.718 -0.753 . . . . 55.32 112.474 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 52.77 30.83 9.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.691 0.281 . . . . 65.25 110.844 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -55.54 137.66 48.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 72.32 110.907 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 61.26 69.86 0.99 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.601 0.715 . . . . 74.25 110.858 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -177.03 1.69 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.7 2.266 . . . . 54.21 112.332 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.577 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . 63.65 160.42 0.12 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.617 0.723 . . . . 70.44 111.142 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.577 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.7 Cg_endo -69.73 167.76 23.48 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.685 2.257 . . . . 64.24 112.351 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 171.16 14.98 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.703 2.269 . . . . 71.53 112.342 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -107.78 83.67 1.83 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 74.0 110.94 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -141.6 68.99 25.61 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.589 0.709 . . . . 71.23 110.896 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 83.94 0.68 Allowed 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.699 2.266 . . . . 55.23 112.352 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.253 -0.431 . . . . 72.35 110.893 -179.887 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.82 0.343 . . . . 73.5 110.951 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 168.43 115.62 0.33 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.756 -0.735 . . . . 71.34 112.508 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -166.35 45.1 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.76 0.314 . . . . 32.02 110.951 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -146.99 119.52 8.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 72.23 110.881 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 61.21 70.8 0.87 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.59 0.71 . . . . 73.12 110.879 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 89.05 0.53 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.703 2.269 . . . . 74.45 112.352 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.592 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -105.88 160.37 26.36 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.617 0.722 . . . . 61.45 111.061 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.592 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.2 Cg_endo -69.75 167.76 23.51 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.666 2.244 . . . . 74.22 112.332 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 142.08 46.96 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.723 2.282 . . . . 74.31 112.327 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.9 27.54 8.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.247 -0.433 . . . . 73.34 110.885 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 58.62 72.16 0.89 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.599 0.714 . . . . 55.52 110.921 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 93.82 0.52 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.696 2.264 . . . . 62.14 112.32 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 56.4 t80 . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 71.31 110.929 -179.931 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.2 pp . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.869 0.366 . . . . 73.42 110.87 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 109.1 46.03 0.97 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.693 -0.765 . . . . 54.14 112.53 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -152.06 31.83 0.54 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.736 0.303 . . . . 63.32 110.927 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -136.87 147.29 46.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 53.3 110.937 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -136.24 73.28 57.8 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.569 0.7 . . . . 55.43 110.939 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 173.57 10.77 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.631 2.221 . . . . 75.24 112.32 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.577 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -82.64 160.42 61.58 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.581 0.705 . . . . 75.44 111.106 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.577 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.6 Cg_endo -69.74 167.77 23.47 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.634 2.223 . . . . 74.42 112.318 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.81 119.99 6.84 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.66 2.24 . . . . 64.41 112.293 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -108.04 27.34 9.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 72.04 110.908 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 59.5 69.66 1.25 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.61 0.719 . . . . 74.14 110.881 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 123.44 10.12 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.673 2.249 . . . . 61.04 112.389 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.5 t80 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.445 . . . . 64.34 110.92 -179.904 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.883 0.373 . . . . 61.55 110.867 . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 65.48 60.38 6.71 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.773 -0.727 . . . . 40.13 112.475 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.68 28.94 0.61 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.749 0.309 . . . . 42.32 110.939 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.33 149.72 24.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 71.15 110.917 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -114.05 160.6 31.77 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.599 0.714 . . . . 75.24 110.95 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 141.89 46.45 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.692 2.261 . . . . 74.13 112.351 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 52.46 73.68 0.91 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.572 0.701 . . . . 70.43 111.066 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 167.76 23.49 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.68 2.254 . . . . 72.42 112.38 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 135.83 31.51 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.691 2.261 . . . . 50.11 112.346 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -107.67 175.15 5.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 61.41 110.892 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -124.73 160.62 52.89 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.553 0.692 . . . . 74.14 110.92 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.82 91.17 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.699 2.266 . . . . 70.54 112.307 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.454 . . . . 70.44 110.925 -179.922 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.872 0.368 . . . . 74.11 110.926 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 93.26 46.72 3.22 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.767 -0.73 . . . . 61.25 112.489 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -102.23 31.3 4.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.78 0.324 . . . . 72.42 110.959 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.475 ' NE2' ' H ' ' A' ' 5' ' ' GLN . 0.0 OUTLIER -56.71 168.91 0.54 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 70.35 110.922 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLN . . . . . 0.475 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 1.4 mp0 -105.62 160.56 25.65 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.562 0.696 . . . . 70.1 110.932 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 153.78 68.79 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.688 2.259 . . . . 74.33 112.39 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 51.94 68.8 2.88 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.548 0.689 . . . . 53.21 111.067 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 167.72 23.71 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.698 2.265 . . . . 73.24 112.348 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 91.51 0.51 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.663 2.242 . . . . 35.31 112.377 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.37 162.92 26.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 54.43 110.902 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -71.86 160.54 82.36 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.564 0.697 . . . . 74.13 110.928 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.75 148.26 64.75 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.669 2.246 . . . . 60.34 112.354 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 22.7 t80 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.226 -0.443 . . . . 72.24 110.922 -179.916 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 4.3 pp . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.86 0.362 . . . . 73.42 110.873 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -163.03 -114.22 0.31 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.76 -0.734 . . . . 54.03 112.496 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 53.32 62.31 2.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.743 0.306 . . . . 74.32 110.924 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.29 104.53 4.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.248 -0.433 . . . . 75.24 110.961 -179.947 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -87.5 160.57 47.61 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.593 0.711 . . . . 53.12 110.931 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 164.69 33.62 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.663 2.242 . . . . 73.11 112.343 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 53.48 68.25 3.05 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.599 0.714 . . . . 63.42 111.132 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 167.66 23.76 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.723 2.282 . . . . 74.53 112.352 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.74 177.15 5.86 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.684 2.256 . . . . 74.12 112.336 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -66.81 171.65 5.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 73.44 110.874 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -134.73 160.56 67.98 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.625 0.726 . . . . 72.33 110.924 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 -175.34 1.13 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.694 2.263 . . . . 74.54 112.328 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.8 t80 . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 72.23 110.942 -179.927 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.044 0 CA-C-O 120.844 0.354 . . . . 61.34 110.921 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -151.76 -85.74 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.741 -0.742 . . . . 33.3 112.496 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 61.1 mt-30 56.5 87.54 0.06 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.774 0.321 . . . . 72.45 110.942 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -75.96 135.24 40.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 64.55 110.898 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -76.8 160.54 76.51 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.617 0.722 . . . . 75.32 110.909 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.7 90.42 0.51 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.696 2.264 . . . . 74.0 112.371 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.78 73.33 16.92 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.606 0.717 . . . . 65.32 111.148 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 167.71 23.62 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.718 2.279 . . . . 60.33 112.306 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 140.56 43.14 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.712 2.275 . . . . 73.31 112.32 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.75 165.07 13.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 72.45 110.94 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -142.3 160.56 54.23 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.594 0.712 . . . . 73.12 110.934 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 -177.08 1.71 Allowed 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.677 2.252 . . . . 73.25 112.333 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 74.42 110.903 -179.891 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.846 0.355 . . . . 74.42 110.937 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 69.1 25.92 75.06 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.75 -0.738 . . . . 41.24 112.479 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.2 mm100 -124.65 68.67 1.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.758 0.313 . . . . 54.22 110.941 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -75.87 137.94 40.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 53.25 110.9 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -119.68 160.58 41.69 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.612 0.72 . . . . 75.35 110.909 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 146.84 61.26 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.652 2.235 . . . . 71.42 112.329 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -149.56 68.8 9.29 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.603 0.716 . . . . 35.41 111.057 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 167.73 23.59 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.661 2.241 . . . . 71.43 112.338 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 133.22 25.1 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.68 2.253 . . . . 55.2 112.368 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -106.94 98.26 7.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 72.41 110.896 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -179.26 73.5 0.2 Allowed Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.568 0.699 . . . . 75.14 110.918 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.8 136.12 32.07 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.697 2.265 . . . . 64.14 112.324 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 53.41 110.943 -179.942 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.2 pp . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.887 0.375 . . . . 42.21 110.924 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -171.42 -125.68 0.83 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.75 -0.738 . . . . 74.03 112.475 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -129.86 31.34 4.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.742 0.306 . . . . 70.33 110.958 -179.899 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -153.58 88.25 1.27 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 71.45 110.877 -179.874 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -71.59 160.56 82.23 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.556 0.694 . . . . 70.13 110.921 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 156.75 62.57 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.666 2.244 . . . . 71.23 112.323 179.996 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.587 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . 63.73 160.4 0.12 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.637 0.732 . . . . 54.22 111.038 179.823 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.587 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.6 Cg_endo -69.74 167.7 23.66 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.692 2.262 . . . . 75.33 112.304 -179.989 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 145.75 58.4 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.662 2.242 . . . . 70.34 112.385 179.926 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -63.12 159.41 17.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 64.52 110.895 179.998 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 53.14 70.78 1.65 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.599 0.714 . . . . 74.13 110.956 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -179.09 2.65 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.713 2.275 . . . . 54.21 112.322 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.215 -0.448 . . . . 72.44 110.942 -179.916 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.23 0.048 0 CA-C-O 120.836 0.351 . . . . 51.21 110.916 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 160.94 -26.63 0.28 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.753 -0.737 . . . . 63.55 112.483 179.859 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.78 26.12 3.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.719 0.295 . . . . 71.2 110.9 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -95.83 133.9 39.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 73.21 110.935 -179.939 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -98.72 160.58 27.55 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.599 0.714 . . . . 75.24 110.884 -179.945 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 146.54 60.64 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.684 2.256 . . . . 62.3 112.357 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.568 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -148.69 160.45 35.85 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.622 0.725 . . . . 75.52 111.082 179.857 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.568 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 54.1 Cg_endo -69.73 167.68 23.69 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.715 2.277 . . . . 75.41 112.357 -179.98 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 115.16 3.96 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.688 2.259 . . . . 75.34 112.396 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -137.14 129.02 29.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 52.45 110.926 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -134.54 68.54 72.5 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.595 0.712 . . . . 75.31 110.895 -179.945 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.85 157.21 60.96 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.689 2.259 . . . . 72.33 112.344 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.204 -0.453 . . . . 72.32 110.926 -179.888 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.809 0.338 . . . . 73.13 110.932 . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -64.69 -66.4 2.5 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.759 -0.734 . . . . 53.12 112.456 179.915 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 59.89 86.96 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.766 0.317 . . . . 74.33 110.915 -179.854 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -148.46 95.4 2.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 71.33 110.929 -179.956 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -96.48 160.56 29.3 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.627 0.727 . . . . 74.45 110.868 -179.915 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 155.36 66.42 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.718 2.279 . . . . 73.54 112.34 179.977 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.59 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -112.37 160.39 30.47 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.607 0.718 . . . . 74.42 111.117 179.843 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.59 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.8 Cg_endo -69.75 167.71 23.64 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.72 2.28 . . . . 64.45 112.35 -179.996 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 109.58 2.34 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.737 2.291 . . . . 63.24 112.328 179.973 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.51 123.68 50.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 72.44 110.909 -179.974 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -124.74 71.68 60.21 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.616 0.722 . . . . 74.22 110.949 -179.956 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 143.37 50.64 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.694 2.263 . . . . 72.24 112.324 -179.992 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.7 p90 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.227 -0.442 . . . . 73.23 110.93 -179.928 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.895 0.379 . . . . 72.0 110.911 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.18 134.24 1.26 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.711 -0.757 . . . . 63.4 112.445 179.878 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -105.38 29.03 6.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.726 0.298 . . . . 74.44 110.896 -179.9 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -155.92 115.05 3.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.23 -0.441 . . . . 63.54 110.883 -179.929 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -76.19 160.58 77.71 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.629 0.728 . . . . 75.21 110.887 -179.953 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 144.29 53.47 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.698 2.265 . . . . 72.21 112.354 -179.98 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.586 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -88.07 160.45 46.12 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.615 0.721 . . . . 74.23 111.065 179.937 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.586 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.2 Cg_endo -69.78 167.76 23.54 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.668 2.245 . . . . 61.11 112.343 -179.957 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 107.2 1.8 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.704 2.269 . . . . 64.02 112.359 179.936 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -57.67 150.8 18.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 70.14 110.907 -179.988 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -125.75 73.31 69.61 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.578 0.704 . . . . 70.41 110.929 -179.972 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 152.06 69.41 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.675 2.25 . . . . 74.52 112.383 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.24 -0.436 . . . . 73.24 110.924 -179.918 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.2 tt . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.836 0.351 . . . . 74.11 110.896 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 66.31 29.07 74.22 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.74 -0.743 . . . . 43.51 112.518 179.919 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.06 64.74 3.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.763 0.316 . . . . 72.43 110.878 -179.85 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -162.69 101.34 1.03 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.191 -0.459 . . . . 71.53 110.904 -179.97 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -87.43 160.61 47.73 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.58 0.705 . . . . 73.12 110.923 -179.936 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 88.92 0.53 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.673 2.248 . . . . 71.23 112.36 179.979 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.571 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -157.96 160.41 29.92 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.571 0.701 . . . . 73.12 111.104 179.884 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.571 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 54.1 Cg_endo -69.69 167.75 23.45 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.691 2.261 . . . . 72.43 112.349 179.991 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.83 179.79 3.48 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.662 2.242 . . . . 64.41 112.341 179.936 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -79.14 139.85 37.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.455 . . . . 73.41 110.879 -179.937 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -156.8 73.27 4.7 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.588 0.709 . . . . 75.24 110.915 179.997 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 126.76 13.69 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.683 2.255 . . . . 74.53 112.374 179.933 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 73.22 110.914 -179.907 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.814 0.34 . . . . 54.14 110.951 . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -160.0 73.85 0.21 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.726 -0.749 . . . . 22.24 112.455 179.922 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 58.73 40.68 22.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.706 0.289 . . . . 60.13 110.929 -179.878 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -91.85 51.98 1.93 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 72.53 110.909 -179.942 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 51.97 70.59 1.84 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.61 0.719 . . . . 73.21 110.922 -179.901 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 92.52 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.684 2.256 . . . . 73.51 112.328 -179.993 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.573 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -173.14 160.41 3.52 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.598 0.713 . . . . 71.02 111.108 179.878 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.573 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 54.4 Cg_endo -69.74 167.76 23.5 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.667 2.245 . . . . 61.33 112.359 179.991 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 118.19 5.53 Favored 'Trans proline' 0 N--CA 1.466 -0.138 0 C-N-CA 122.696 2.264 . . . . 63.11 112.359 179.944 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -121.17 28.48 7.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.442 . . . . 53.5 110.931 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 63.3 160.62 0.12 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.646 0.736 . . . . 74.4 110.886 -179.936 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 177.56 5.5 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.67 2.247 . . . . 52.12 112.307 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 73.4 110.912 -179.896 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.879 0.371 . . . . 53.3 110.873 . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -155.79 33.42 0.62 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.723 -0.751 . . . . 52.24 112.48 179.886 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -129.42 28.27 5.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.701 0.286 . . . . 43.35 110.892 -179.913 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -53.28 153.31 3.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.25 -0.432 . . . . 73.43 110.899 -179.958 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -108.55 160.55 26.76 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.61 0.719 . . . . 75.31 110.929 -179.943 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 153.78 68.64 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.706 2.271 . . . . 62.23 112.364 179.981 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.571 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -167.85 160.42 9.75 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.596 0.713 . . . . 71.05 111.115 179.874 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.571 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 54.1 Cg_endo -69.7 167.7 23.61 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.702 2.268 . . . . 74.55 112.341 179.96 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 133.44 25.57 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.683 2.256 . . . . 52.0 112.313 179.912 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.15 126.29 26.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 74.2 110.895 179.993 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -152.69 160.56 30.96 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.601 0.715 . . . . 74.12 110.936 -179.958 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 157.82 59.15 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.683 2.255 . . . . 73.13 112.357 -179.983 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.441 . . . . 73.32 110.912 -179.904 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.04 0 CA-C-O 120.854 0.359 . . . . 75.41 110.904 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 111.95 40.1 1.22 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.678 -0.772 . . . . 34.35 112.451 179.918 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -122.05 55.43 1.13 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.724 0.297 . . . . 73.55 110.896 -179.877 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -139.42 149.36 43.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 74.05 110.92 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -61.52 160.54 24.74 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.642 0.734 . . . . 72.0 110.897 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.7 169.16 19.49 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.697 2.265 . . . . 71.12 112.384 179.958 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.583 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -102.41 160.42 26.38 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.597 0.713 . . . . 72.01 111.089 179.867 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.583 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.8 Cg_endo -69.81 167.74 23.63 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.678 2.252 . . . . 52.52 112.353 179.991 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 160.82 48.29 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.728 2.285 . . . . 73.35 112.343 179.973 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -76.47 174.22 10.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 65.44 110.877 -179.95 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -125.7 160.55 55.59 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.575 0.702 . . . . 75.43 110.928 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 148.55 65.71 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.713 2.275 . . . . 72.25 112.337 -180.0 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 116.259 -0.428 . . . . 71.34 110.89 -179.92 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.84 0.352 . . . . 73.53 110.871 . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 109.31 28.17 4.46 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.72 -0.752 . . . . 53.3 112.5 179.877 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -149.43 86.69 1.48 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.724 0.297 . . . . 74.21 110.951 -179.887 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -143.03 146.63 34.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 60.05 110.895 -179.933 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.6 160.57 32.58 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.656 0.741 . . . . 71.2 110.882 -179.937 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 104.4 1.31 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.732 2.288 . . . . 73.34 112.322 179.99 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.582 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -57.87 160.39 8.41 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.59 0.709 . . . . 51.11 111.104 179.86 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.582 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 54.0 Cg_endo -69.74 167.7 23.65 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.694 2.263 . . . . 64.11 112.392 179.96 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 120.08 6.92 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.696 2.264 . . . . 40.23 112.339 179.976 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -101.0 151.66 21.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.234 -0.439 . . . . 72.33 110.915 -179.969 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -119.25 160.54 40.95 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.56 0.695 . . . . 75.34 110.929 -179.951 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 -176.35 1.44 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.666 2.244 . . . . 75.02 112.396 179.918 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 55.4 t80 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 63.51 110.959 -179.927 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.5 tp . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.823 0.344 . . . . 71.22 110.933 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 159.4 -88.83 0.11 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.719 -0.753 . . . . 62.42 112.447 179.883 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -112.55 56.53 0.67 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.707 0.289 . . . . 64.24 110.882 -179.842 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.23 97.97 3.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 64.23 110.925 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -113.02 160.57 30.46 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.621 0.724 . . . . 74.31 110.905 -179.932 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 97.78 0.65 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.7 2.266 . . . . 51.32 112.378 179.972 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.574 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -165.02 160.44 14.81 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.602 0.715 . . . . 53.54 111.077 179.919 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.574 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.4 Cg_endo -69.84 167.72 23.73 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.652 2.235 . . . . 75.25 112.345 -179.996 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 122.73 9.41 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.651 2.234 . . . . 62.25 112.362 179.963 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.73 122.48 10.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 74.04 110.876 -179.95 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -92.58 160.54 34.35 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.588 0.708 . . . . 42.43 110.94 -179.976 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 -177.36 1.83 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.719 2.279 . . . . 64.24 112.384 179.951 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 52.5 t80 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 74.22 110.928 -179.877 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.876 0.37 . . . . 75.15 110.965 . . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -179.12 40.12 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.69 -0.767 . . . . 75.33 112.452 179.924 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -145.16 43.35 1.31 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.768 0.318 . . . . 73.31 110.89 -179.878 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -82.62 107.25 15.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 74.5 110.906 -179.954 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.54 160.51 25.83 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.612 0.72 . . . . 75.34 110.95 -179.965 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 122.28 8.96 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.685 2.256 . . . . 73.2 112.349 179.972 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.569 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -111.16 160.43 29.08 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.566 0.698 . . . . 74.34 111.113 179.859 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.569 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.8 Cg_endo -69.74 167.74 23.56 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.681 2.254 . . . . 62.42 112.382 179.966 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 168.99 20.01 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.669 2.246 . . . . 64.41 112.299 -179.992 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.22 170.33 7.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 71.51 110.925 -179.992 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -132.81 160.6 67.84 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.61 0.719 . . . . 55.34 110.92 -179.97 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 120.69 7.44 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.731 2.287 . . . . 75.13 112.303 -179.971 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 63.35 110.958 -179.942 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 1' ' ' LEU . . . . . 0.406 HD13 ' H ' ' A' ' 2' ' ' GLY . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.868 0.366 . . . . 53.42 110.91 . . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.406 ' H ' HD13 ' A' ' 1' ' ' LEU . . . 99.05 104.39 2.51 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.74 -0.743 . . . . 72.31 112.52 179.936 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -132.39 79.28 1.85 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.74 0.305 . . . . 65.33 110.925 -179.915 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.96 146.7 29.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 62.24 110.896 -179.918 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -165.2 70.05 1.35 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.558 0.694 . . . . 53.22 110.884 -179.929 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -175.6 1.2 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.664 2.242 . . . . 73.24 112.345 179.954 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.563 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -81.36 160.45 65.01 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.619 0.723 . . . . 63.11 111.099 179.891 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.563 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.5 Cg_endo -69.81 167.72 23.7 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.68 2.254 . . . . 74.04 112.346 -179.983 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 149.59 67.49 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.728 2.285 . . . . 61.34 112.346 179.924 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.55 155.01 31.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.204 -0.453 . . . . 72.14 110.922 -179.996 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.2 tp60 -165.87 68.64 1.17 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.583 0.706 . . . . 63.01 110.902 -179.931 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -177.63 1.98 Allowed 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.667 2.245 . . . . 63.31 112.312 -179.984 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.4 p90 . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 74.31 110.936 -179.928 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.23 0.044 0 CA-C-O 120.87 0.367 . . . . 63.14 110.894 . . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 171.77 107.8 0.2 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.754 -0.736 . . . . 64.15 112.524 179.898 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -110.9 54.92 0.66 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.74 0.305 . . . . 73.35 110.872 -179.864 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 54.83 84.55 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 71.14 110.882 179.998 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.85 160.57 73.88 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.597 0.713 . . . . 62.35 110.935 -179.98 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 120.93 7.64 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.645 2.23 . . . . 63.21 112.369 179.977 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -167.38 73.25 1.0 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.636 0.732 . . . . 72.51 111.116 179.861 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 167.71 23.76 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.714 2.276 . . . . 74.54 112.317 -179.939 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.72 102.11 0.98 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.65 2.234 . . . . 64.34 112.316 179.99 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.08 129.98 52.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.44 . . . . 72.31 110.899 179.99 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -143.05 157.57 60.47 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.657 0.741 . . . . 64.24 110.878 -179.956 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 134.0 26.84 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.694 2.263 . . . . 63.12 112.332 179.992 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 75.44 110.897 -179.855 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.057 0 CA-C-O 120.854 0.359 . . . . 74.41 110.959 . . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -146.39 -102.96 0.34 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.743 -0.741 . . . . 71.13 112.49 179.929 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 52.6 31.82 10.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.762 0.315 . . . . 73.41 110.902 -179.903 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 52.45 57.8 6.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.465 . . . . 70.43 110.89 -179.949 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -138.01 160.61 63.74 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.569 0.699 . . . . 61.41 110.944 179.998 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 85.62 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.14 0 C-N-CA 122.685 2.257 . . . . 55.41 112.335 -179.988 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -144.89 68.72 14.36 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.566 0.698 . . . . 75.45 111.073 179.888 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 167.72 23.65 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.668 2.245 . . . . 65.02 112.309 179.985 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 141.75 46.1 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.676 2.251 . . . . 75.01 112.341 179.945 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -118.2 123.72 46.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.17 -0.468 . . . . 51.23 110.922 179.99 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -127.85 157.58 73.17 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.607 0.718 . . . . 73.32 110.9 -179.941 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -179.01 2.64 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.677 2.251 . . . . 64.05 112.339 179.978 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.27 -0.423 . . . . 75.3 110.95 -179.939 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.826 0.346 . . . . 72.43 110.957 . . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 109.03 117.84 4.07 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.777 -0.725 . . . . 34.31 112.473 179.876 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -149.74 58.14 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.805 0.336 . . . . 74.12 110.894 -179.889 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.65 97.6 8.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 64.41 110.921 -179.993 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.79 160.42 0.12 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.662 0.744 . . . . 71.41 110.878 -179.975 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 118.15 5.51 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.656 2.238 . . . . 65.01 112.351 179.976 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -127.68 69.93 76.44 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.536 0.684 . . . . 71.42 111.087 179.88 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 167.72 23.62 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.703 2.268 . . . . 43.43 112.333 179.982 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 128.77 16.49 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.676 2.251 . . . . 54.04 112.321 179.966 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.8 131.61 45.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 70.53 110.929 179.98 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -140.9 70.47 29.43 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.618 0.723 . . . . 73.34 110.913 -179.957 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.81 112.27 3.04 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.637 2.225 . . . . 74.14 112.343 -179.959 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.175 -0.466 . . . . 64.42 110.882 -179.861 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.817 0.342 . . . . 62.12 110.934 . . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 141.82 97.68 0.29 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.747 -0.74 . . . . 74.42 112.488 179.903 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.76 -19.13 25.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.755 0.312 . . . . 72.42 110.927 -179.894 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -173.37 55.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 72.41 110.876 -179.907 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -153.27 157.53 32.88 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.59 0.709 . . . . 73.25 110.939 -179.952 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 113.41 3.37 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.713 2.275 . . . . 62.45 112.293 -179.98 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.572 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -143.81 160.41 50.31 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.577 0.703 . . . . 73.25 111.076 179.874 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.572 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.5 Cg_endo -69.76 167.73 23.59 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.703 2.268 . . . . 75.44 112.335 -179.983 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 161.71 44.87 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.717 2.278 . . . . 73.54 112.331 179.941 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -71.76 136.84 47.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 75.32 110.892 -179.996 . . . . . . . . 2 2 . 1 . 036 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -161.91 73.3 2.37 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.617 0.722 . . . . 75.42 110.952 -179.982 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 125.46 12.16 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.695 2.263 . . . . 72.13 112.285 -179.942 . . . . . . . . 1 1 . 1 . 036 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 15.8 t80 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 72.41 110.92 -179.955 . . . . . . . . 0 0 . 1 . 037 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.833 0.349 . . . . 74.32 110.903 . . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -167.62 -64.62 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.728 -0.749 . . . . 73.51 112.485 179.87 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -100.59 52.81 0.87 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.833 0.349 . . . . 75.44 110.951 -179.932 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -166.95 132.97 2.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.464 . . . . 74.32 110.92 -179.973 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -143.51 160.56 50.73 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.629 0.728 . . . . 74.42 110.916 -179.994 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.67 113.22 3.29 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.694 2.263 . . . . 62.12 112.344 179.989 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.587 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -104.72 160.43 26.03 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.58 0.705 . . . . 74.03 111.088 179.861 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.587 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 54.0 Cg_endo -69.8 167.76 23.57 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.676 2.251 . . . . 75.11 112.365 -179.986 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 175.28 8.3 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.674 2.25 . . . . 75.51 112.352 179.96 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.77 151.92 10.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 63.25 110.949 179.995 . . . . . . . . 2 2 . 1 . 037 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -151.11 157.54 35.18 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.615 0.721 . . . . 62.13 110.904 -179.945 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.69 118.14 5.5 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.71 2.273 . . . . 73.2 112.322 179.986 . . . . . . . . 1 1 . 1 . 037 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.3 t80 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 53.43 110.932 -179.964 . . . . . . . . 0 0 . 1 . 038 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.038 0 CA-C-O 120.858 0.361 . . . . 63.31 110.916 . . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -97.97 -108.07 2.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.745 -0.74 . . . . 73.1 112.531 179.853 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -140.63 46.51 1.79 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.75 0.309 . . . . 72.21 110.942 -179.912 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -96.84 160.79 14.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 71.43 110.935 -179.958 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -174.98 157.56 2.13 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 121.606 0.717 . . . . 74.03 110.875 -179.953 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 111.45 2.81 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.65 2.234 . . . . 75.0 112.362 179.987 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.566 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -117.71 160.44 38.38 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.582 0.706 . . . . 64.34 111.081 179.893 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.566 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.5 Cg_endo -69.79 167.74 23.61 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.701 2.268 . . . . 63.33 112.361 -179.994 . . . . . . . . 2 2 . 1 . 038 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 113.24 3.31 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.699 2.266 . . . . 70.31 112.33 179.997 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -61.19 166.03 4.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 73.44 110.897 -179.966 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -54.97 160.56 2.92 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.568 0.699 . . . . 75.5 110.929 -179.936 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.67 -178.63 2.4 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.694 2.262 . . . . 73.32 112.359 -179.999 . . . . . . . . 1 1 . 1 . 038 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 19.0 t80 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 73.45 110.928 -179.957 . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.3 pp . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.896 0.379 . . . . 70.44 110.869 . . . . . . . . . 0 0 . 1 . 039 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -88.05 -95.86 0.97 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.721 -0.752 . . . . 64.41 112.523 179.885 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -107.34 74.02 0.95 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.74 0.305 . . . . 73.41 110.894 -179.887 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 58.65 70.94 0.61 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 73.22 110.906 -179.949 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 62.77 160.46 0.12 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.561 0.696 . . . . 72.31 110.917 -179.974 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.8 175.09 8.6 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.684 2.256 . . . . 75.51 112.292 -179.947 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.583 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . 63.64 160.45 0.12 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.579 0.704 . . . . 73.0 111.094 179.894 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.583 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 54.0 Cg_endo -69.75 167.77 23.47 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.631 2.221 . . . . 71.02 112.356 -179.994 . . . . . . . . 2 2 . 1 . 039 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.83 171.31 14.78 Favored 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.668 2.245 . . . . 63.52 112.329 179.955 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -124.4 135.48 53.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 65.12 110.94 -179.953 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -146.77 70.71 12.46 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.629 0.728 . . . . 75.4 110.902 -179.915 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.82 -178.23 2.26 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.632 2.221 . . . . 73.11 112.278 -179.968 . . . . . . . . 1 1 . 1 . 039 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 22.2 t80 . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.191 -0.459 . . . . 61.24 110.876 -179.947 . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.9 pp . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.794 0.331 . . . . 74.41 110.929 . . . . . . . . . 0 0 . 1 . 040 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 110.64 -63.71 0.27 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.732 -0.747 . . . . 44.31 112.465 179.909 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 62.72 98.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.739 0.304 . . . . 75.12 110.897 -179.876 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -148.86 135.32 19.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 71.53 110.9 -179.962 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -79.91 160.56 68.63 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.556 0.693 . . . . 72.41 110.942 179.997 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.8 116.44 4.56 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.616 2.211 . . . . 72.11 112.353 179.979 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 7' ' ' ALA . . . . . 0.585 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -166.37 160.43 12.25 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.585 0.707 . . . . 64.15 111.104 179.884 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.585 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.5 Cg_endo -69.79 167.76 23.56 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.651 2.234 . . . . 64.34 112.352 179.983 . . . . . . . . 2 2 . 1 . 040 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 90.66 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.712 2.274 . . . . 75.32 112.297 179.987 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 53.2 tp60 -106.39 148.65 27.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 65.44 110.956 179.964 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -112.08 78.05 2.26 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.587 0.708 . . . . 70.44 110.896 -179.911 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 88.34 0.54 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.688 2.259 . . . . 74.05 112.365 179.963 . . . . . . . . 1 1 . 1 . 040 nuclear build full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 75.54 110.895 -179.864 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.23 0.074 0 CA-C-O 120.836 0.35 . . . . 72.310000000000002 110.925 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 105.62 -90.81 0.71 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.733 -0.746 . . . . 54.229999999999997 112.51 179.906 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -133.53 29.82 3.87 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-O 120.758 0.313 . . . . 70.319999999999993 110.925 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 -99.68 147.94 24.88 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.193 -0.458 . . . . 72.010000000000005 110.938 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.2 pm0 -145.46 157.57 52.15 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.6 0.714 . . . . 74.239999999999995 110.939 -179.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.81 84.19 0.67 Allowed 'Trans proline' 0 C--N 1.342 0.185 0 C-N-CA 122.682 2.255 . . . . 73.530000000000001 112.34 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.585 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -62.09 160.42 30.66 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.609 0.719 . . . . 75.109999999999999 111.102 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.585 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.2 Cg_endo -69.77 167.74 23.58 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.696 2.264 . . . . 61.340000000000003 112.301 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.73 142.19 47.4 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.679 2.253 . . . . 64.329999999999998 112.36 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -108.97 110.52 21.83 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.247 -0.433 . . . . 74.319999999999993 110.901 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -140.24 72.55 32.47 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.622 0.725 . . . . 72.310000000000002 110.928 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 134.47 28.13 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.722 2.282 . . . . 71.310000000000002 112.325 179.961 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.324 0 CA-C-N 116.221 -0.445 . . . . 75.120000000000005 110.914 -179.94 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.23 0.042 0 CA-C-O 120.872 0.368 . . . . 75.310000000000002 110.931 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 175.25 133.33 1.72 Allowed Glycine 0 N--CA 1.452 -0.29 0 C-N-CA 120.703 -0.761 . . . . 44.450000000000003 112.495 179.858 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 8.8 mt-30 -105.69 39.54 1.74 Allowed 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 120.76 0.314 . . . . 74.219999999999999 110.915 -179.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.7 pt20 -87.36 57.45 4.45 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.195 -0.457 . . . . 62.329999999999998 110.909 -179.932 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.0 tp60 -132.82 70.02 79.05 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.585 0.707 . . . . 74.219999999999999 110.938 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.74 165.14 31.97 Favored 'Trans proline' 0 C--N 1.34 0.127 0 C-N-CA 122.697 2.264 . . . . 45.299999999999997 112.354 179.997 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -125.09 70.93 62.05 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.575 0.703 . . . . 75.400000000000006 111.054 179.905 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 167.8 23.43 Favored 'Trans proline' 0 C--O 1.232 0.19 0 C-N-CA 122.607 2.205 . . . . 64.510000000000005 112.368 179.994 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 141.1 44.23 Favored 'Trans proline' 0 N--CA 1.465 -0.17 0 C-N-CA 122.729 2.286 . . . . 75.219999999999999 112.375 179.957 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.48 153.37 27.47 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.228 -0.442 . . . . 72.200000000000003 110.912 -179.948 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.5 mt-30 54.48 69.18 2.22 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.611 0.719 . . . . 74.329999999999998 110.916 -179.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.78 87.32 0.56 Allowed 'Trans proline' 0 C--N 1.342 0.221 0 C-N-CA 122.66 2.24 . . . . 45.43 112.36 179.972 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 2.8 t80 . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.225 -0.443 . . . . 65.430000000000007 110.91 -179.907 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.23 0.073 0 CA-C-O 120.812 0.339 . . . . 75.140000000000001 110.918 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 72.88 88.49 0.16 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.746 -0.74 . . . . 53.450000000000003 112.507 179.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.5 tt0 -160.25 90.17 0.88 Allowed 'General case' 0 C--N 1.329 -0.307 0 CA-C-O 120.744 0.307 . . . . 74.010000000000005 110.854 -179.862 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -160.68 122.5 3.1 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.217 -0.447 . . . . 73.420000000000002 110.918 -179.949 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.9 pm0 -157.38 73.38 4.37 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.583 0.706 . . . . 73.530000000000001 110.914 -179.97 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.8 103.24 1.14 Allowed 'Trans proline' 0 C--N 1.341 0.15 0 C-N-CA 122.661 2.241 . . . . 54.32 112.33 179.974 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -173.7 71.22 0.36 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.557 0.694 . . . . 73.540000000000006 111.07 179.893 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 167.75 23.53 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.741 2.294 . . . . 71.230000000000004 112.329 179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.82 112.29 3.05 Favored 'Trans proline' 0 C--N 1.341 0.166 0 C-N-CA 122.683 2.255 . . . . 72.030000000000001 112.328 179.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -70.58 88.46 0.69 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.213 -0.449 . . . . 74.120000000000005 110.909 -179.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -164.97 71.47 1.45 Allowed Pre-proline 0 C--N 1.33 -0.264 0 CA-C-O 121.568 0.699 . . . . 74.349999999999994 110.903 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 88.17 0.54 Allowed 'Trans proline' 0 C--O 1.231 0.161 0 C-N-CA 122.66 2.24 . . . . 70.420000000000002 112.328 179.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 58.3 t80 . . . . . 0 C--N 1.329 -0.322 0 CA-C-N 116.194 -0.457 . . . . 74.540000000000006 110.928 -179.923 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.23 0.059 0 CA-C-O 120.877 0.37 . . . . 73.129999999999995 110.913 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 100.87 116.2 3.98 Favored Glycine 0 N--CA 1.451 -0.307 0 C-N-CA 120.759 -0.734 . . . . 32.409999999999997 112.458 179.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.3 tp-100 62.32 49.47 4.22 Favored 'General case' 0 C--N 1.328 -0.331 0 CA-C-O 120.708 0.289 . . . . 73.140000000000001 110.889 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.3 tp-100 -157.87 80.0 0.86 Allowed 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.192 -0.458 . . . . 61.009999999999998 110.89 -179.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 18.8 tp60 -133.54 68.76 76.66 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.565 0.698 . . . . 64.209999999999994 110.974 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.74 -175.9 1.31 Allowed 'Trans proline' 0 C--N 1.341 0.132 0 C-N-CA 122.671 2.247 . . . . 71.450000000000003 112.339 179.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.64 72.38 49.8 Favored Pre-proline 0 C--N 1.329 -0.309 0 CA-C-O 121.573 0.702 . . . . 63.109999999999999 111.103 179.922 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 167.73 23.64 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.68 2.253 . . . . 73.109999999999999 112.327 -179.969 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.71 -176.98 1.65 Allowed 'Trans proline' 0 C--N 1.341 0.145 0 C-N-CA 122.725 2.283 . . . . 53.420000000000002 112.352 179.94 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -127.31 82.65 2.1 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.242 -0.435 . . . . 72.430000000000007 110.918 179.981 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER 60.22 69.74 1.14 Allowed Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.612 0.72 . . . . 74.129999999999995 110.884 -179.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.72 -179.28 2.78 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.648 2.232 . . . . 75.420000000000002 112.342 179.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.332 0 CA-C-N 116.21 -0.45 . . . . 71.150000000000006 110.948 -179.935 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.832 0.349 . . . . 63.0 110.922 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -143.56 -93.67 0.18 Allowed Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.727 -0.749 . . . . 52.32 112.481 179.885 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.16 27.1 2.91 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 120.762 0.315 . . . . 74.239999999999995 110.862 -179.878 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -62.47 155.77 24.63 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.225 -0.443 . . . . 72.400000000000006 110.923 -179.942 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -145.44 72.5 14.25 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.536 0.684 . . . . 74.120000000000005 110.879 -179.93 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.79 132.57 23.57 Favored 'Trans proline' 0 C--O 1.231 0.148 0 C-N-CA 122.68 2.253 . . . . 72.430000000000007 112.31 -179.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -123.23 68.51 37.77 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.593 0.711 . . . . 71.329999999999998 111.063 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 167.73 23.58 Favored 'Trans proline' 0 C--O 1.232 0.194 0 C-N-CA 122.73 2.287 . . . . 74.530000000000001 112.331 -179.974 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 88.69 0.54 Allowed 'Trans proline' 0 C--N 1.342 0.197 0 C-N-CA 122.673 2.249 . . . . 72.299999999999997 112.349 179.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -70.49 103.1 2.37 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.199 -0.455 . . . . 55.200000000000003 110.971 179.972 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 37.4 tp60 -144.9 73.3 14.91 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.596 0.713 . . . . 71.129999999999995 110.878 -179.918 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 125.53 12.28 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.685 2.257 . . . . 54.43 112.378 179.913 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 59.9 t80 . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.213 -0.448 . . . . 75.109999999999999 110.905 -179.904 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.9 pp . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.873 0.368 . . . . 70.140000000000001 110.883 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 90.96 116.25 1.92 Allowed Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.754 -0.736 . . . . 75.030000000000001 112.472 179.861 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.3 mt-30 -102.54 54.98 0.78 Allowed 'General case' 0 C--N 1.33 -0.272 0 CA-C-O 120.754 0.311 . . . . 75.400000000000006 110.952 -179.918 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -90.43 102.18 14.91 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.214 -0.448 . . . . 73.219999999999999 110.904 -179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.4 mt-30 52.03 69.47 2.43 Favored Pre-proline 0 C--N 1.329 -0.287 0 CA-C-O 121.569 0.7 . . . . 70.109999999999999 110.92 -179.943 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.83 87.19 0.57 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.633 2.222 . . . . 71.140000000000001 112.324 -179.996 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -150.19 71.75 9.3 Favored Pre-proline 0 C--N 1.329 -0.299 0 CA-C-O 121.584 0.707 . . . . 65.200000000000003 111.122 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 167.73 23.6 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.727 2.284 . . . . 61.329999999999998 112.335 -179.975 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 79.53 0.95 Allowed 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.687 2.258 . . . . 71.340000000000003 112.316 179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -79.32 151.85 30.82 Favored 'General case' 0 C--N 1.329 -0.286 0 CA-C-N 116.219 -0.446 . . . . 73.120000000000005 110.876 -179.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.6 mt-30 55.82 68.69 2.23 Favored Pre-proline 0 C--N 1.33 -0.272 0 CA-C-O 121.595 0.712 . . . . 75.510000000000005 110.892 -179.945 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 -174.94 0.99 Allowed 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.655 2.237 . . . . 74.439999999999998 112.332 179.957 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 11.4 m-85 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.168 -0.469 . . . . 70.349999999999994 110.941 -179.928 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 C--O 1.231 0.079 0 CA-C-O 120.871 0.367 . . . . 73.540000000000006 110.895 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -162.96 115.59 0.66 Allowed Glycine 0 N--CA 1.451 -0.334 0 C-N-CA 120.689 -0.767 . . . . 72.439999999999998 112.478 179.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -140.81 68.2 1.35 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.785 0.326 . . . . 55.020000000000003 110.941 -179.89 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.7 tt0 -167.06 47.48 0.06 Allowed 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.179 -0.464 . . . . 73.129999999999995 110.919 -179.921 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 51.99 69.21 2.58 Favored Pre-proline 0 C--N 1.329 -0.323 0 CA-C-O 121.583 0.706 . . . . 71.109999999999999 110.892 -179.953 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.72 179.79 3.43 Favored 'Trans proline' 0 C--N 1.341 0.184 0 C-N-CA 122.723 2.282 . . . . 52.020000000000003 112.348 179.952 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -140.5 72.93 30.55 Favored Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.583 0.706 . . . . 71.230000000000004 111.073 179.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.77 167.72 23.65 Favored 'Trans proline' 0 C--N 1.341 0.158 0 C-N-CA 122.709 2.273 . . . . 72.340000000000003 112.331 -179.997 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 127.07 14.04 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.641 2.227 . . . . 63.340000000000003 112.356 179.987 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -68.51 131.83 45.94 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.226 -0.443 . . . . 74.109999999999999 110.947 -179.977 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.1 mt-30 -112.15 160.57 29.56 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.593 0.711 . . . . 53.409999999999997 110.925 -179.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 147.21 62.37 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.706 2.27 . . . . 74.540000000000006 112.342 -179.959 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.6 m-85 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.228 -0.442 . . . . 74.430000000000007 110.895 -179.881 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.7 pp . . . . . 0 C--O 1.23 0.038 0 CA-C-O 120.882 0.372 . . . . 73.5 110.905 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 88.07 56.63 2.03 Favored Glycine 0 N--CA 1.451 -0.319 0 C-N-CA 120.736 -0.745 . . . . 61.340000000000003 112.506 179.898 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -159.3 85.93 0.8 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.767 0.318 . . . . 74.109999999999999 110.919 -179.913 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER 56.67 88.96 0.05 OUTLIER 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.204 -0.453 . . . . 50.130000000000003 110.932 -179.926 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -130.35 160.58 65.11 Favored Pre-proline 0 C--N 1.33 -0.273 0 CA-C-O 121.595 0.712 . . . . 71.230000000000004 110.927 -179.963 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.72 120.57 7.34 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.742 2.295 . . . . 62.140000000000001 112.36 179.985 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 53.73 72.82 1.03 Allowed Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.581 0.705 . . . . 54.509999999999998 111.079 179.872 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.8 167.72 23.67 Favored 'Trans proline' 0 C--O 1.232 0.175 0 C-N-CA 122.69 2.26 . . . . 65.219999999999999 112.361 -179.983 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 174.87 8.88 Favored 'Trans proline' 0 C--O 1.231 0.153 0 C-N-CA 122.725 2.283 . . . . 64.109999999999999 112.356 179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -108.71 140.91 41.46 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.248 -0.433 . . . . 72.530000000000001 110.894 179.998 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.2 tt0 -143.89 69.58 16.64 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.574 0.702 . . . . 70.549999999999997 110.921 -179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 -172.8 0.61 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.702 2.268 . . . . 74.219999999999999 112.324 -179.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 14.0 t80 . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.204 -0.453 . . . . 54.439999999999998 110.938 -179.928 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.23 0.047 0 CA-C-O 120.855 0.36 . . . . 75.329999999999998 110.908 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -173.02 69.3 0.1 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.753 -0.737 . . . . 61.25 112.478 179.862 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 46.6 mt-30 -101.37 60.71 0.91 Allowed 'General case' 0 C--N 1.329 -0.285 0 CA-C-O 120.741 0.305 . . . . 73.310000000000002 110.879 -179.886 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -153.47 117.14 4.7 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.234 -0.439 . . . . 62.439999999999998 110.912 -179.981 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 9.4 tt0 54.34 73.1 0.95 Allowed Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.57 0.7 . . . . 65.510000000000005 110.912 -179.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.74 118.05 5.45 Favored 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.714 2.276 . . . . 65.140000000000001 112.373 179.98 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -164.42 68.29 1.46 Allowed Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.609 0.719 . . . . 61.43 111.134 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.82 167.76 23.58 Favored 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.681 2.254 . . . . 55.140000000000001 112.304 -179.94 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 116.28 4.49 Favored 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.708 2.272 . . . . 52.409999999999997 112.303 179.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 10.2 mt-30 -78.86 102.99 8.5 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.228 -0.442 . . . . 73.209999999999994 110.921 179.975 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -160.58 160.56 25.7 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.602 0.715 . . . . 74.420000000000002 110.928 -179.958 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 169.59 18.5 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.703 2.269 . . . . 74.349999999999994 112.295 -179.964 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.7 m-85 . . . . . 0 C--N 1.329 -0.317 0 CA-C-N 116.182 -0.463 . . . . 72.519999999999996 110.944 -179.978 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.229 0.022 0 CA-C-O 120.88 0.371 . . . . 62.310000000000002 110.919 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -175.74 -67.9 0.06 OUTLIER Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.761 -0.733 . . . . 64.219999999999999 112.469 179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.2 pt20 -148.01 47.08 1.08 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.723 0.297 . . . . 73.239999999999995 110.93 -179.831 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 5.0 tt0 -149.1 28.03 0.84 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.198 -0.456 . . . . 70.129999999999995 110.958 -179.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.5 tp60 -153.05 70.38 7.01 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.585 0.707 . . . . 75.030000000000001 110.888 -179.921 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.75 128.57 16.23 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.681 2.254 . . . . 72.120000000000005 112.329 179.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 59.25 72.04 0.86 Allowed Pre-proline 0 C--N 1.329 -0.297 0 CA-C-O 121.554 0.693 . . . . 61.329999999999998 111.104 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.74 167.73 23.58 Favored 'Trans proline' 0 C--O 1.231 0.175 0 C-N-CA 122.685 2.257 . . . . 73.519999999999996 112.406 179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.82 178.53 4.51 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.676 2.251 . . . . 74.430000000000007 112.315 -180.0 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -123.81 176.83 6.04 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.213 -0.449 . . . . 74.109999999999999 110.933 -179.96 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.0 mt-30 -144.36 160.6 47.92 Favored Pre-proline 0 C--N 1.33 -0.278 0 CA-C-O 121.579 0.704 . . . . 71.010000000000005 110.936 179.999 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.73 138.06 37.03 Favored 'Trans proline' 0 C--O 1.232 0.2 0 C-N-CA 122.682 2.255 . . . . 34.32 112.329 -179.968 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.254 -0.43 . . . . 73.230000000000004 110.95 -179.911 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.856 0.36 . . . . 74.540000000000006 110.922 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -157.53 74.73 0.22 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.729 -0.748 . . . . 74.230000000000004 112.488 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 9.5 tt0 58.97 55.29 4.56 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.701 0.286 . . . . 71.209999999999994 110.876 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.3 pt20 -81.9 140.49 34.05 Favored 'General case' 0 C--N 1.329 -0.322 0 CA-C-N 116.245 -0.434 . . . . 65.450000000000003 110.879 -179.943 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -69.4 160.57 78.61 Favored Pre-proline 0 C--N 1.328 -0.343 0 CA-C-O 121.571 0.701 . . . . 72.329999999999998 110.888 -179.93 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.8 156.11 64.09 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.674 2.25 . . . . 75.200000000000003 112.336 179.985 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 58.16 68.84 1.68 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.587 0.708 . . . . 74.329999999999998 111.136 179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.72 167.75 23.48 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.655 2.236 . . . . 64.310000000000002 112.318 -179.979 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.78 155.79 64.97 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.682 2.255 . . . . 63.329999999999998 112.35 179.917 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -116.45 141.82 47.68 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.215 -0.448 . . . . 71.5 110.929 -179.995 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.4 mt-30 54.67 73.04 0.95 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.602 0.715 . . . . 72.400000000000006 110.924 -179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 88.51 0.54 Allowed 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.667 2.245 . . . . 74.420000000000002 112.327 -179.98 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--N 1.328 -0.334 0 CA-C-N 116.197 -0.456 . . . . 64.310000000000002 110.941 -179.95 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 9.0 tp . . . . . 0 C--O 1.23 0.027 0 CA-C-O 120.892 0.377 . . . . 63.420000000000002 110.914 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -131.18 -117.8 1.93 Allowed Glycine 0 N--CA 1.451 -0.322 0 C-N-CA 120.703 -0.761 . . . . 23.52 112.496 179.899 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.5 mt-30 -139.99 88.59 2.24 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-O 120.76 0.314 . . . . 74.120000000000005 110.901 -179.908 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.5 tt0 -144.8 94.96 2.62 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.17 -0.468 . . . . 63.509999999999998 110.918 -179.938 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -59.1 160.56 11.34 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.621 0.724 . . . . 73.439999999999998 110.92 -179.956 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.78 86.23 0.59 Allowed 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.692 2.261 . . . . 51.310000000000002 112.341 179.981 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.82 73.34 4.15 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.545 0.688 . . . . 73.349999999999994 111.068 179.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 167.77 23.5 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.667 2.245 . . . . 73.239999999999995 112.367 179.982 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 172.23 13.04 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.685 2.257 . . . . 74.400000000000006 112.279 179.999 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 -123.1 125.0 44.35 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.164 -0.471 . . . . 74.030000000000001 110.911 -179.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER 53.82 68.34 2.9 Favored Pre-proline 0 C--N 1.329 -0.284 0 CA-C-O 121.592 0.71 . . . . 72.239999999999995 110.943 -179.917 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.69 157.39 60.67 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.653 2.235 . . . . 72.329999999999998 112.359 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 12.3 t80 . . . . . 0 C--N 1.329 -0.316 0 CA-C-N 116.21 -0.45 . . . . 75.120000000000005 110.93 -179.919 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.23 0.056 0 CA-C-O 120.808 0.337 . . . . 75.040000000000006 110.961 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -63.35 -50.93 58.69 Favored Glycine 0 N--CA 1.452 -0.287 0 C-N-CA 120.718 -0.753 . . . . 55.32 112.474 179.921 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 7.4 tt0 52.77 30.83 9.5 Favored 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.691 0.281 . . . . 65.25 110.844 -179.867 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 -55.54 137.66 48.27 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.212 -0.449 . . . . 72.319999999999993 110.907 -179.981 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.1 tt0 61.26 69.86 0.99 Allowed Pre-proline 0 C--N 1.329 -0.283 0 CA-C-O 121.601 0.715 . . . . 74.25 110.858 -179.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.8 -177.03 1.69 Allowed 'Trans proline' 0 C--N 1.341 0.16 0 C-N-CA 122.7 2.266 . . . . 54.210000000000001 112.332 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.577 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . 63.65 160.42 0.12 Allowed Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.617 0.723 . . . . 70.439999999999998 111.142 179.916 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.577 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.7 Cg_endo -69.73 167.76 23.48 Favored 'Trans proline' 0 C--N 1.342 0.218 0 C-N-CA 122.685 2.257 . . . . 64.239999999999995 112.351 -179.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 171.16 14.98 Favored 'Trans proline' 0 C--O 1.231 0.154 0 C-N-CA 122.703 2.269 . . . . 71.530000000000001 112.342 179.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 9.2 mt-30 -107.78 83.67 1.83 Allowed 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.24 -0.436 . . . . 74.0 110.94 -179.991 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 11.7 mm-40 -141.6 68.99 25.61 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.589 0.709 . . . . 71.230000000000004 110.896 -179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.78 83.94 0.68 Allowed 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.699 2.266 . . . . 55.229999999999997 112.352 179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.1 m-85 . . . . . 0 C--N 1.328 -0.356 0 CA-C-N 116.253 -0.431 . . . . 72.349999999999994 110.893 -179.887 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.098 0 CA-C-O 120.82 0.343 . . . . 73.5 110.951 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 168.43 115.62 0.33 Allowed Glycine 0 N--CA 1.451 -0.308 0 C-N-CA 120.756 -0.735 . . . . 71.340000000000003 112.508 179.917 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -166.35 45.1 0.07 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.76 0.314 . . . . 32.020000000000003 110.951 -179.884 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.1 tm0? -146.99 119.52 8.49 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.201 -0.454 . . . . 72.230000000000004 110.881 -179.896 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 tt0 61.21 70.8 0.87 Allowed Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.59 0.71 . . . . 73.120000000000005 110.879 -179.961 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 89.05 0.53 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.703 2.269 . . . . 74.450000000000003 112.352 179.984 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.592 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -105.88 160.37 26.36 Favored Pre-proline 0 C--N 1.329 -0.311 0 CA-C-O 121.617 0.722 . . . . 61.450000000000003 111.061 179.91 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.592 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.2 Cg_endo -69.75 167.76 23.51 Favored 'Trans proline' 0 C--N 1.342 0.203 0 C-N-CA 122.666 2.244 . . . . 74.219999999999999 112.332 -179.986 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 142.08 46.96 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.723 2.282 . . . . 74.310000000000002 112.327 179.992 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -106.9 27.54 8.86 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.247 -0.433 . . . . 73.340000000000003 110.885 -179.968 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 58.62 72.16 0.89 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.599 0.714 . . . . 55.520000000000003 110.921 -179.93 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 93.82 0.52 Allowed 'Trans proline' 0 C--O 1.231 0.164 0 C-N-CA 122.696 2.264 . . . . 62.140000000000001 112.32 179.974 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 56.4 t80 . . . . . 0 C--N 1.328 -0.343 0 CA-C-N 116.174 -0.466 . . . . 71.310000000000002 110.929 -179.931 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.2 pp . . . . . 0 C--O 1.23 0.054 0 CA-C-O 120.869 0.366 . . . . 73.420000000000002 110.87 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 109.1 46.03 0.97 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.693 -0.765 . . . . 54.140000000000001 112.53 179.93 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 11.2 tt0 -152.06 31.83 0.54 Allowed 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.736 0.303 . . . . 63.32 110.927 -179.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 2.9 pt20 -136.87 147.29 46.41 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.204 -0.453 . . . . 53.299999999999997 110.937 -179.959 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.9 mm100 -136.24 73.28 57.8 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.569 0.7 . . . . 55.43 110.939 -179.958 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.75 173.57 10.77 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.631 2.221 . . . . 75.239999999999995 112.32 -179.98 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.577 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -82.64 160.42 61.58 Favored Pre-proline 0 C--N 1.33 -0.268 0 CA-C-O 121.581 0.705 . . . . 75.439999999999998 111.106 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.577 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.6 Cg_endo -69.74 167.77 23.47 Favored 'Trans proline' 0 C--N 1.342 0.211 0 C-N-CA 122.634 2.223 . . . . 74.420000000000002 112.318 -179.967 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.81 119.99 6.84 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.66 2.24 . . . . 64.409999999999997 112.293 179.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.7 tt0 -108.04 27.34 9.36 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.23 -0.441 . . . . 72.040000000000006 110.908 179.997 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 10.6 tt0 59.5 69.66 1.25 Allowed Pre-proline 0 C--N 1.328 -0.329 0 CA-C-O 121.61 0.719 . . . . 74.140000000000001 110.881 -179.987 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.69 123.44 10.12 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.673 2.249 . . . . 61.039999999999999 112.389 179.96 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 37.5 t80 . . . . . 0 C--N 1.328 -0.337 0 CA-C-N 116.222 -0.445 . . . . 64.340000000000003 110.92 -179.904 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--O 1.23 0.076 0 CA-C-O 120.883 0.373 . . . . 61.549999999999997 110.867 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 65.48 60.38 6.71 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.773 -0.727 . . . . 40.130000000000003 112.475 179.897 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -151.68 28.94 0.61 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.749 0.309 . . . . 42.32 110.939 -179.928 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -87.33 149.72 24.33 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.21 -0.45 . . . . 71.150000000000006 110.917 -179.946 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -114.05 160.6 31.77 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.599 0.714 . . . . 75.239999999999995 110.95 -179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 141.89 46.45 Favored 'Trans proline' 0 C--N 1.341 0.163 0 C-N-CA 122.692 2.261 . . . . 74.129999999999995 112.351 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 52.46 73.68 0.91 Allowed Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.572 0.701 . . . . 70.430000000000007 111.066 179.845 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 167.76 23.49 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.68 2.254 . . . . 72.420000000000002 112.38 179.978 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.74 135.83 31.51 Favored 'Trans proline' 0 C--O 1.231 0.167 0 C-N-CA 122.691 2.261 . . . . 50.109999999999999 112.346 179.964 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -107.67 175.15 5.59 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.248 -0.433 . . . . 61.409999999999997 110.892 179.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -124.73 160.62 52.89 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.553 0.692 . . . . 74.140000000000001 110.92 -179.941 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.82 91.17 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.699 2.266 . . . . 70.540000000000006 112.307 -179.962 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 1.8 m-85 . . . . . 0 C--N 1.329 -0.305 0 CA-C-N 116.2 -0.454 . . . . 70.439999999999998 110.925 -179.922 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.08 0 CA-C-O 120.872 0.368 . . . . 74.109999999999999 110.926 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 93.26 46.72 3.22 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.767 -0.73 . . . . 61.25 112.489 179.914 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 36.4 mt-30 -102.23 31.3 4.05 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-O 120.78 0.324 . . . . 72.420000000000002 110.959 -179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.475 ' NE2' ' H ' ' A' ' 5' ' ' GLN . 0.0 OUTLIER -56.71 168.91 0.54 Allowed 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.186 -0.461 . . . . 70.349999999999994 110.922 -179.931 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . 0.475 ' H ' ' NE2' ' A' ' 4' ' ' GLN . 1.4 mp0 -105.62 160.56 25.65 Favored Pre-proline 0 C--N 1.328 -0.326 0 CA-C-O 121.562 0.696 . . . . 70.099999999999994 110.932 -179.936 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.7 153.78 68.79 Favored 'Trans proline' 0 C--N 1.341 0.153 0 C-N-CA 122.688 2.259 . . . . 74.329999999999998 112.39 179.939 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 51.94 68.8 2.88 Favored Pre-proline 0 C--N 1.328 -0.339 0 CA-C-O 121.548 0.689 . . . . 53.210000000000001 111.067 179.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 167.72 23.71 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.698 2.265 . . . . 73.239999999999995 112.348 -179.983 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 91.51 0.51 Allowed 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.663 2.242 . . . . 35.310000000000002 112.377 179.959 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -77.37 162.92 26.89 Favored 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.219 -0.446 . . . . 54.43 110.902 -179.94 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.6 mp0 -71.86 160.54 82.36 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.564 0.697 . . . . 74.129999999999995 110.928 -179.945 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.75 148.26 64.75 Favored 'Trans proline' 0 C--O 1.232 0.185 0 C-N-CA 122.669 2.246 . . . . 60.340000000000003 112.354 179.971 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 22.7 t80 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.226 -0.443 . . . . 72.239999999999995 110.922 -179.916 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 4.3 pp . . . . . 0 C--O 1.23 0.061 0 CA-C-O 120.86 0.362 . . . . 73.420000000000002 110.873 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -163.03 -114.22 0.31 Allowed Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.76 -0.734 . . . . 54.030000000000001 112.496 179.894 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 35.6 tt0 53.32 62.31 2.72 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.743 0.306 . . . . 74.319999999999993 110.924 -179.899 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -143.29 104.53 4.27 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.248 -0.433 . . . . 75.239999999999995 110.961 -179.947 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.1 mp0 -87.5 160.57 47.61 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.593 0.711 . . . . 53.119999999999997 110.931 -179.941 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 164.69 33.62 Favored 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.663 2.242 . . . . 73.109999999999999 112.343 179.996 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . 53.48 68.25 3.05 Favored Pre-proline 0 C--N 1.329 -0.302 0 CA-C-O 121.599 0.714 . . . . 63.420000000000002 111.132 179.902 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.73 167.66 23.76 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.723 2.282 . . . . 74.530000000000001 112.352 -179.997 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.74 177.15 5.86 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.684 2.256 . . . . 74.120000000000005 112.336 179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -66.81 171.65 5.09 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.219 -0.446 . . . . 73.439999999999998 110.874 -179.962 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.8 mt-30 -134.73 160.56 67.98 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.625 0.726 . . . . 72.329999999999998 110.924 -179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.78 -175.34 1.13 Allowed 'Trans proline' 0 C--O 1.232 0.188 0 C-N-CA 122.694 2.263 . . . . 74.540000000000006 112.328 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.8 t80 . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.241 -0.436 . . . . 72.230000000000004 110.942 -179.927 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.044 0 CA-C-O 120.844 0.354 . . . . 61.340000000000003 110.921 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -151.76 -85.74 0.05 OUTLIER Glycine 0 N--CA 1.45 -0.374 0 C-N-CA 120.741 -0.742 . . . . 33.299999999999997 112.496 179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 61.1 mt-30 56.5 87.54 0.06 Allowed 'General case' 0 C--N 1.329 -0.323 0 CA-C-O 120.774 0.321 . . . . 72.450000000000003 110.942 -179.878 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -75.96 135.24 40.05 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.151 -0.477 . . . . 64.549999999999997 110.898 -179.93 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 4.1 mt-30 -76.8 160.54 76.51 Favored Pre-proline 0 C--N 1.329 -0.293 0 CA-C-O 121.617 0.722 . . . . 75.319999999999993 110.909 -179.96 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.7 90.42 0.51 Allowed 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.696 2.264 . . . . 74.0 112.371 179.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -143.78 73.33 16.92 Favored Pre-proline 0 C--N 1.328 -0.33 0 CA-C-O 121.606 0.717 . . . . 65.319999999999993 111.148 179.877 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.73 167.71 23.62 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.718 2.279 . . . . 60.329999999999998 112.306 -179.966 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.71 140.56 43.14 Favored 'Trans proline' 0 C--N 1.341 0.183 0 C-N-CA 122.712 2.275 . . . . 73.310000000000002 112.32 179.903 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -91.75 165.07 13.47 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-N 116.188 -0.46 . . . . 72.450000000000003 110.94 179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.5 mt-30 -142.3 160.56 54.23 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.594 0.712 . . . . 73.120000000000005 110.934 -179.955 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 -177.08 1.71 Allowed 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.677 2.252 . . . . 73.25 112.333 -180.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 5.8 m-85 . . . . . 0 C--N 1.329 -0.302 0 CA-C-N 116.205 -0.452 . . . . 74.420000000000002 110.903 -179.891 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.23 0.07 0 CA-C-O 120.846 0.355 . . . . 74.420000000000002 110.937 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 69.1 25.92 75.06 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.75 -0.738 . . . . 41.240000000000002 112.479 179.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.2 mm100 -124.65 68.67 1.09 Allowed 'General case' 0 C--N 1.328 -0.332 0 CA-C-O 120.758 0.313 . . . . 54.219999999999999 110.941 -179.863 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.4 pt20 -75.87 137.94 40.75 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.201 -0.454 . . . . 53.25 110.9 -179.908 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 26.4 mt-30 -119.68 160.58 41.69 Favored Pre-proline 0 C--N 1.328 -0.334 0 CA-C-O 121.612 0.72 . . . . 75.349999999999994 110.909 -179.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.78 146.84 61.26 Favored 'Trans proline' 0 C--N 1.342 0.214 0 C-N-CA 122.652 2.235 . . . . 71.420000000000002 112.329 179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -149.56 68.8 9.29 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.603 0.716 . . . . 35.409999999999997 111.057 179.905 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 167.73 23.59 Favored 'Trans proline' 0 C--N 1.342 0.212 0 C-N-CA 122.661 2.241 . . . . 71.430000000000007 112.338 179.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.72 133.22 25.1 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.68 2.253 . . . . 55.200000000000003 112.368 179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.1 tp60 -106.94 98.26 7.94 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.221 -0.445 . . . . 72.409999999999997 110.896 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.3 pt20 -179.26 73.5 0.2 Allowed Pre-proline 0 C--N 1.328 -0.331 0 CA-C-O 121.568 0.699 . . . . 75.140000000000001 110.918 -179.979 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -69.8 136.12 32.07 Favored 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.697 2.265 . . . . 64.140000000000001 112.324 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 24.6 m-85 . . . . . 0 C--N 1.329 -0.32 0 CA-C-N 116.224 -0.444 . . . . 53.409999999999997 110.943 -179.942 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.2 pp . . . . . 0 C--O 1.231 0.091 0 CA-C-O 120.887 0.375 . . . . 42.210000000000001 110.924 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -171.42 -125.68 0.83 Allowed Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.75 -0.738 . . . . 74.030000000000001 112.475 179.941 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 7.8 tt0 -129.86 31.34 4.73 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-O 120.742 0.306 . . . . 70.329999999999998 110.958 -179.899 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 24.2 tt0 -153.58 88.25 1.27 Allowed 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.175 -0.466 . . . . 71.450000000000003 110.877 -179.874 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 11.4 mt-30 -71.59 160.56 82.23 Favored Pre-proline 0 C--N 1.329 -0.29 0 CA-C-O 121.556 0.694 . . . . 70.129999999999995 110.921 -179.947 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 156.75 62.57 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.666 2.244 . . . . 71.230000000000004 112.323 179.996 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.587 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . 63.73 160.4 0.12 Allowed Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.637 0.732 . . . . 54.219999999999999 111.038 179.823 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.587 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.6 Cg_endo -69.74 167.7 23.66 Favored 'Trans proline' 0 C--N 1.341 0.173 0 C-N-CA 122.692 2.262 . . . . 75.329999999999998 112.304 -179.989 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.71 145.75 58.4 Favored 'Trans proline' 0 C--N 1.342 0.22 0 C-N-CA 122.662 2.242 . . . . 70.340000000000003 112.385 179.926 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -63.12 159.41 17.49 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.207 -0.451 . . . . 64.519999999999996 110.895 179.998 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 12.7 mt-30 53.14 70.78 1.65 Allowed Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.599 0.714 . . . . 74.129999999999995 110.956 -179.952 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.72 -179.09 2.65 Favored 'Trans proline' 0 C--O 1.231 0.171 0 C-N-CA 122.713 2.275 . . . . 54.210000000000001 112.322 -179.976 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--N 1.329 -0.29 0 CA-C-N 116.215 -0.448 . . . . 72.439999999999998 110.942 -179.916 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.23 0.048 0 CA-C-O 120.836 0.351 . . . . 51.210000000000001 110.916 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 160.94 -26.63 0.28 Allowed Glycine 0 N--CA 1.452 -0.294 0 C-N-CA 120.753 -0.737 . . . . 63.549999999999997 112.483 179.859 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -135.78 26.12 3.35 Favored 'General case' 0 C--N 1.329 -0.295 0 CA-C-O 120.719 0.295 . . . . 71.200000000000003 110.9 -179.838 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -95.83 133.9 39.43 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.204 -0.453 . . . . 73.209999999999994 110.935 -179.939 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.4 mt-30 -98.72 160.58 27.55 Favored Pre-proline 0 C--N 1.329 -0.3 0 CA-C-O 121.599 0.714 . . . . 75.239999999999995 110.884 -179.945 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.74 146.54 60.64 Favored 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.684 2.256 . . . . 62.299999999999997 112.357 -179.999 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.568 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -148.69 160.45 35.85 Favored Pre-proline 0 C--N 1.329 -0.298 0 CA-C-O 121.622 0.725 . . . . 75.519999999999996 111.082 179.857 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.568 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 54.1 Cg_endo -69.73 167.68 23.69 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.715 2.277 . . . . 75.409999999999997 112.357 -179.98 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.71 115.16 3.96 Favored 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.688 2.259 . . . . 75.340000000000003 112.396 179.909 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -137.14 129.02 29.06 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.248 -0.433 . . . . 52.450000000000003 110.926 -179.995 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -134.54 68.54 72.5 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.595 0.712 . . . . 75.310000000000002 110.895 -179.945 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.85 157.21 60.96 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.689 2.259 . . . . 72.329999999999998 112.344 179.977 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.328 -0.349 0 CA-C-N 116.204 -0.453 . . . . 72.319999999999993 110.926 -179.888 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.077 0 CA-C-O 120.809 0.338 . . . . 73.129999999999995 110.932 . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -64.69 -66.4 2.5 Favored Glycine 0 N--CA 1.451 -0.341 0 C-N-CA 120.759 -0.734 . . . . 53.119999999999997 112.456 179.915 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.5 mm-40 59.89 86.96 0.09 Allowed 'General case' 0 C--N 1.329 -0.312 0 CA-C-O 120.766 0.317 . . . . 74.329999999999998 110.915 -179.854 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -148.46 95.4 2.44 Favored 'General case' 0 C--N 1.329 -0.315 0 CA-C-N 116.213 -0.449 . . . . 71.329999999999998 110.929 -179.956 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -96.48 160.56 29.3 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.627 0.727 . . . . 74.450000000000003 110.868 -179.915 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.68 155.36 66.42 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.718 2.279 . . . . 73.540000000000006 112.34 179.977 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.59 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -112.37 160.39 30.47 Favored Pre-proline 0 C--N 1.329 -0.317 0 CA-C-O 121.607 0.718 . . . . 74.420000000000002 111.117 179.843 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.59 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.8 Cg_endo -69.75 167.71 23.64 Favored 'Trans proline' 0 C--O 1.231 0.174 0 C-N-CA 122.72 2.28 . . . . 64.450000000000003 112.35 -179.996 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.73 109.58 2.34 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.737 2.291 . . . . 63.240000000000002 112.328 179.973 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -114.51 123.68 50.0 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.222 -0.445 . . . . 72.439999999999998 110.909 -179.974 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -124.74 71.68 60.21 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.616 0.722 . . . . 74.219999999999999 110.949 -179.956 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.76 143.37 50.64 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.694 2.263 . . . . 72.239999999999995 112.324 -179.992 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 4.7 p90 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.227 -0.442 . . . . 73.230000000000004 110.93 -179.928 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.895 0.379 . . . . 72.0 110.911 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.18 134.24 1.26 Allowed Glycine 0 N--CA 1.451 -0.311 0 C-N-CA 120.711 -0.757 . . . . 63.399999999999999 112.445 179.878 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.3 mm-40 -105.38 29.03 6.8 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.726 0.298 . . . . 74.439999999999998 110.896 -179.9 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 10.5 tp60 -155.92 115.05 3.52 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.23 -0.441 . . . . 63.539999999999999 110.883 -179.929 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -76.19 160.58 77.71 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.629 0.728 . . . . 75.209999999999994 110.887 -179.953 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 144.29 53.47 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.698 2.265 . . . . 72.209999999999994 112.354 -179.98 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.586 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -88.07 160.45 46.12 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.615 0.721 . . . . 74.230000000000004 111.065 179.937 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.586 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.2 Cg_endo -69.78 167.76 23.54 Favored 'Trans proline' 0 C--N 1.342 0.201 0 C-N-CA 122.668 2.245 . . . . 61.109999999999999 112.343 -179.957 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 107.2 1.8 Allowed 'Trans proline' 0 C--N 1.341 0.18 0 C-N-CA 122.704 2.269 . . . . 64.019999999999996 112.359 179.936 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 12.9 mt-30 -57.67 150.8 18.67 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.245 -0.434 . . . . 70.140000000000001 110.907 -179.988 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -125.75 73.31 69.61 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.578 0.704 . . . . 70.409999999999997 110.929 -179.972 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.72 152.06 69.41 Favored 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.675 2.25 . . . . 74.519999999999996 112.383 179.966 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.24 -0.436 . . . . 73.239999999999995 110.924 -179.918 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 2.2 tt . . . . . 0 C--O 1.23 0.062 0 CA-C-O 120.836 0.351 . . . . 74.109999999999999 110.896 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 66.31 29.07 74.22 Favored Glycine 0 N--CA 1.451 -0.333 0 C-N-CA 120.74 -0.743 . . . . 43.509999999999998 112.518 179.919 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -94.06 64.74 3.36 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-O 120.763 0.316 . . . . 72.430000000000007 110.878 -179.85 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -162.69 101.34 1.03 Allowed 'General case' 0 C--N 1.33 -0.264 0 CA-C-N 116.191 -0.459 . . . . 71.530000000000001 110.904 -179.97 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -87.43 160.61 47.73 Favored Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.58 0.705 . . . . 73.120000000000005 110.923 -179.936 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.79 88.92 0.53 Allowed 'Trans proline' 0 C--N 1.341 0.171 0 C-N-CA 122.673 2.248 . . . . 71.230000000000004 112.36 179.979 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.571 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -157.96 160.41 29.92 Favored Pre-proline 0 C--N 1.329 -0.314 0 CA-C-O 121.571 0.701 . . . . 73.120000000000005 111.104 179.884 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.571 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 54.1 Cg_endo -69.69 167.75 23.45 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.691 2.261 . . . . 72.430000000000007 112.349 179.991 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.83 179.79 3.48 Favored 'Trans proline' 0 C--N 1.342 0.224 0 C-N-CA 122.662 2.242 . . . . 64.409999999999997 112.341 179.936 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.5 OUTLIER -79.14 139.85 37.93 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.2 -0.455 . . . . 73.409999999999997 110.879 -179.937 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -156.8 73.27 4.7 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-O 121.588 0.709 . . . . 75.239999999999995 110.915 179.997 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 126.76 13.69 Favored 'Trans proline' 0 C--N 1.341 0.161 0 C-N-CA 122.683 2.255 . . . . 74.530000000000001 112.374 179.933 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.318 0 CA-C-N 116.204 -0.453 . . . . 73.219999999999999 110.914 -179.907 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.231 0.09 0 CA-C-O 120.814 0.34 . . . . 54.140000000000001 110.951 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -160.0 73.85 0.21 Allowed Glycine 0 N--CA 1.451 -0.324 0 C-N-CA 120.726 -0.749 . . . . 22.239999999999998 112.455 179.922 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 32.1 mt-30 58.73 40.68 22.91 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.706 0.289 . . . . 60.130000000000003 110.929 -179.878 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.6 tt0 -91.85 51.98 1.93 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.203 -0.453 . . . . 72.530000000000001 110.909 -179.942 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 40.6 mt-30 51.97 70.59 1.84 Allowed Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.61 0.719 . . . . 73.209999999999994 110.922 -179.901 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 92.52 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.174 0 C-N-CA 122.684 2.256 . . . . 73.510000000000005 112.328 -179.993 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.573 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -173.14 160.41 3.52 Favored Pre-proline 0 C--N 1.329 -0.306 0 CA-C-O 121.598 0.713 . . . . 71.019999999999996 111.108 179.878 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.573 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 54.4 Cg_endo -69.74 167.76 23.5 Favored 'Trans proline' 0 C--N 1.342 0.192 0 C-N-CA 122.667 2.245 . . . . 61.329999999999998 112.359 179.991 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.79 118.19 5.53 Favored 'Trans proline' 0 N--CA 1.466 -0.138 0 C-N-CA 122.696 2.264 . . . . 63.109999999999999 112.359 179.944 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 1.4 pt20 -121.17 28.48 7.82 Favored 'General case' 0 C--N 1.329 -0.313 0 CA-C-N 116.229 -0.442 . . . . 53.5 110.931 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 63.3 160.62 0.12 Allowed Pre-proline 0 C--N 1.33 -0.28 0 CA-C-O 121.646 0.736 . . . . 74.400000000000006 110.886 -179.936 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 177.56 5.5 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.67 2.247 . . . . 52.119999999999997 112.307 -179.974 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.329 -0.313 0 CA-C-N 116.206 -0.452 . . . . 73.400000000000006 110.912 -179.896 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.23 0.064 0 CA-C-O 120.879 0.371 . . . . 53.299999999999997 110.873 . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -155.79 33.42 0.62 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.723 -0.751 . . . . 52.240000000000002 112.48 179.886 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.7 mm-40 -129.42 28.27 5.22 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-O 120.701 0.286 . . . . 43.350000000000001 110.892 -179.913 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -53.28 153.31 3.92 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.25 -0.432 . . . . 73.430000000000007 110.899 -179.958 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.4 mp0 -108.55 160.55 26.76 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.61 0.719 . . . . 75.310000000000002 110.929 -179.943 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 153.78 68.64 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.706 2.271 . . . . 62.229999999999997 112.364 179.981 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.571 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -167.85 160.42 9.75 Favored Pre-proline 0 C--N 1.329 -0.295 0 CA-C-O 121.596 0.713 . . . . 71.049999999999997 111.115 179.874 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.571 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 54.1 Cg_endo -69.7 167.7 23.61 Favored 'Trans proline' 0 C--O 1.231 0.17 0 C-N-CA 122.702 2.268 . . . . 74.549999999999997 112.341 179.96 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 133.44 25.57 Favored 'Trans proline' 0 C--N 1.342 0.186 0 C-N-CA 122.683 2.256 . . . . 52.0 112.313 179.912 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.6 OUTLIER -61.15 126.29 26.81 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.205 -0.452 . . . . 74.200000000000003 110.895 179.993 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.9 mt-30 -152.69 160.56 30.96 Favored Pre-proline 0 C--N 1.33 -0.282 0 CA-C-O 121.601 0.715 . . . . 74.120000000000005 110.936 -179.958 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.72 157.82 59.15 Favored 'Trans proline' 0 C--N 1.341 0.177 0 C-N-CA 122.683 2.255 . . . . 73.129999999999995 112.357 -179.983 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.229 -0.441 . . . . 73.319999999999993 110.912 -179.904 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.04 0 CA-C-O 120.854 0.359 . . . . 75.409999999999997 110.904 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 111.95 40.1 1.22 Allowed Glycine 0 N--CA 1.451 -0.32 0 C-N-CA 120.678 -0.772 . . . . 34.350000000000001 112.451 179.918 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -122.05 55.43 1.13 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-O 120.724 0.297 . . . . 73.549999999999997 110.896 -179.877 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -139.42 149.36 43.98 Favored 'General case' 0 C--N 1.328 -0.333 0 CA-C-N 116.192 -0.458 . . . . 74.049999999999997 110.92 -179.923 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 24.9 mt-30 -61.52 160.54 24.74 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.642 0.734 . . . . 72.0 110.897 -179.971 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.7 169.16 19.49 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.697 2.265 . . . . 71.120000000000005 112.384 179.958 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.583 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -102.41 160.42 26.38 Favored Pre-proline 0 C--N 1.329 -0.313 0 CA-C-O 121.597 0.713 . . . . 72.010000000000005 111.089 179.867 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.583 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.8 Cg_endo -69.81 167.74 23.63 Favored 'Trans proline' 0 C--N 1.342 0.202 0 C-N-CA 122.678 2.252 . . . . 52.520000000000003 112.353 179.991 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.78 160.82 48.29 Favored 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.728 2.285 . . . . 73.349999999999994 112.343 179.973 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -76.47 174.22 10.55 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.22 -0.445 . . . . 65.439999999999998 110.877 -179.95 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 13.9 mt-30 -125.7 160.55 55.59 Favored Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.575 0.702 . . . . 75.430000000000007 110.928 -179.926 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -69.7 148.55 65.71 Favored 'Trans proline' 0 C--O 1.231 0.165 0 C-N-CA 122.713 2.275 . . . . 72.25 112.337 -180.0 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 44.7 m-85 . . . . . 0 C--N 1.328 -0.361 0 CA-C-N 116.259 -0.428 . . . . 71.340000000000003 110.89 -179.92 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.081 0 CA-C-O 120.84 0.352 . . . . 73.530000000000001 110.871 . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 109.31 28.17 4.46 Favored Glycine 0 N--CA 1.451 -0.327 0 C-N-CA 120.72 -0.752 . . . . 53.299999999999997 112.5 179.877 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 21.3 tt0 -149.43 86.69 1.48 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-O 120.724 0.297 . . . . 74.209999999999994 110.951 -179.887 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 1.4 tt0 -143.03 146.63 34.03 Favored 'General case' 0 C--N 1.329 -0.321 0 CA-C-N 116.236 -0.438 . . . . 60.049999999999997 110.895 -179.933 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -93.6 160.57 32.58 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.656 0.741 . . . . 71.200000000000003 110.882 -179.937 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.76 104.4 1.31 Allowed 'Trans proline' 0 C--N 1.342 0.187 0 C-N-CA 122.732 2.288 . . . . 73.340000000000003 112.322 179.99 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.582 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -57.87 160.39 8.41 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.59 0.709 . . . . 51.109999999999999 111.104 179.86 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.582 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 54.0 Cg_endo -69.74 167.7 23.65 Favored 'Trans proline' 0 C--O 1.232 0.18 0 C-N-CA 122.694 2.263 . . . . 64.109999999999999 112.392 179.96 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.77 120.08 6.92 Favored 'Trans proline' 0 C--N 1.341 0.154 0 C-N-CA 122.696 2.264 . . . . 40.229999999999997 112.339 179.976 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -101.0 151.66 21.52 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.234 -0.439 . . . . 72.329999999999998 110.915 -179.969 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 5.9 mt-30 -119.25 160.54 40.95 Favored Pre-proline 0 C--N 1.329 -0.296 0 CA-C-O 121.56 0.695 . . . . 75.340000000000003 110.929 -179.951 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.4 Cg_endo -69.7 -176.35 1.44 Allowed 'Trans proline' 0 C--O 1.232 0.192 0 C-N-CA 122.666 2.244 . . . . 75.019999999999996 112.396 179.918 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 55.4 t80 . . . . . 0 C--N 1.328 -0.329 0 CA-C-N 116.247 -0.433 . . . . 63.509999999999998 110.959 -179.927 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 5.5 tp . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.823 0.344 . . . . 71.219999999999999 110.933 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 159.4 -88.83 0.11 Allowed Glycine 0 N--CA 1.452 -0.255 0 C-N-CA 120.719 -0.753 . . . . 62.420000000000002 112.447 179.883 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 34.2 mt-30 -112.55 56.53 0.67 Allowed 'General case' 0 C--N 1.33 -0.254 0 CA-C-O 120.707 0.289 . . . . 64.239999999999995 110.882 -179.842 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -144.23 97.97 3.13 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-N 116.198 -0.455 . . . . 64.230000000000004 110.925 -179.951 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -113.02 160.57 30.46 Favored Pre-proline 0 C--N 1.33 -0.265 0 CA-C-O 121.621 0.724 . . . . 74.310000000000002 110.905 -179.932 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.72 97.78 0.65 Allowed 'Trans proline' 0 C--N 1.342 0.207 0 C-N-CA 122.7 2.266 . . . . 51.32 112.378 179.972 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.574 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -165.02 160.44 14.81 Favored Pre-proline 0 C--N 1.33 -0.266 0 CA-C-O 121.602 0.715 . . . . 53.539999999999999 111.077 179.919 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.574 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.4 Cg_endo -69.84 167.72 23.73 Favored 'Trans proline' 0 C--N 1.342 0.206 0 C-N-CA 122.652 2.235 . . . . 75.25 112.345 -179.996 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.73 122.73 9.41 Favored 'Trans proline' 0 C--N 1.342 0.188 0 C-N-CA 122.651 2.234 . . . . 62.25 112.362 179.963 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -53.73 122.48 10.0 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.222 -0.445 . . . . 74.040000000000006 110.876 -179.95 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 2.3 mt-30 -92.58 160.54 34.35 Favored Pre-proline 0 C--N 1.328 -0.333 0 CA-C-O 121.588 0.708 . . . . 42.43 110.94 -179.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 -177.36 1.83 Allowed 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.719 2.279 . . . . 64.239999999999995 112.384 179.951 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 52.5 t80 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.232 -0.44 . . . . 74.219999999999999 110.928 -179.877 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 C--O 1.23 0.051 0 CA-C-O 120.876 0.37 . . . . 75.150000000000006 110.965 . . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -179.12 40.12 0.08 OUTLIER Glycine 0 N--CA 1.452 -0.293 0 C-N-CA 120.69 -0.767 . . . . 75.329999999999998 112.452 179.924 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.3 pt20 -145.16 43.35 1.31 Allowed 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.768 0.318 . . . . 73.310000000000002 110.89 -179.878 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 48.7 tt0 -82.62 107.25 15.12 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.205 -0.452 . . . . 74.5 110.906 -179.954 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -105.54 160.51 25.83 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.612 0.72 . . . . 75.340000000000003 110.95 -179.965 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.75 122.28 8.96 Favored 'Trans proline' 0 C--N 1.342 0.195 0 C-N-CA 122.685 2.256 . . . . 73.200000000000003 112.349 179.972 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.569 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -111.16 160.43 29.08 Favored Pre-proline 0 C--N 1.33 -0.274 0 CA-C-O 121.566 0.698 . . . . 74.340000000000003 111.113 179.859 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.569 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.8 Cg_endo -69.74 167.74 23.56 Favored 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.681 2.254 . . . . 62.420000000000002 112.382 179.966 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.79 168.99 20.01 Favored 'Trans proline' 0 C--N 1.342 0.184 0 C-N-CA 122.669 2.246 . . . . 64.409999999999997 112.299 -179.992 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -105.22 170.33 7.93 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.239 -0.437 . . . . 71.510000000000005 110.925 -179.992 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.5 mt-30 -132.81 160.6 67.84 Favored Pre-proline 0 C--N 1.329 -0.316 0 CA-C-O 121.61 0.719 . . . . 55.340000000000003 110.92 -179.97 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.76 120.69 7.44 Favored 'Trans proline' 0 C--O 1.231 0.146 0 C-N-CA 122.731 2.287 . . . . 75.129999999999995 112.303 -179.971 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--N 1.329 -0.314 0 CA-C-N 116.205 -0.452 . . . . 63.350000000000001 110.958 -179.942 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . 0.406 HD13 ' H ' ' A' ' 2' ' ' GLY . 0.3 OUTLIER . . . . . 0 C--O 1.231 0.097 0 CA-C-O 120.868 0.366 . . . . 53.420000000000002 110.91 . . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.406 ' H ' HD13 ' A' ' 1' ' ' LEU . . . 99.05 104.39 2.51 Favored Glycine 0 N--CA 1.451 -0.352 0 C-N-CA 120.74 -0.743 . . . . 72.310000000000002 112.52 179.936 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.0 tp60 -132.39 79.28 1.85 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-O 120.74 0.305 . . . . 65.329999999999998 110.925 -179.915 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.96 146.7 29.62 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.184 -0.462 . . . . 62.240000000000002 110.896 -179.918 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 2.0 tm0? -165.2 70.05 1.35 Allowed Pre-proline 0 C--N 1.329 -0.288 0 CA-C-O 121.558 0.694 . . . . 53.219999999999999 110.884 -179.929 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.73 -175.6 1.2 Allowed 'Trans proline' 0 C--N 1.341 0.176 0 C-N-CA 122.664 2.242 . . . . 73.239999999999995 112.345 179.954 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.563 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -81.36 160.45 65.01 Favored Pre-proline 0 C--N 1.329 -0.304 0 CA-C-O 121.619 0.723 . . . . 63.109999999999999 111.099 179.891 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.563 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.5 Cg_endo -69.81 167.72 23.7 Favored 'Trans proline' 0 C--N 1.342 0.193 0 C-N-CA 122.68 2.254 . . . . 74.040000000000006 112.346 -179.983 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.7 149.59 67.49 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.728 2.285 . . . . 61.340000000000003 112.346 179.924 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -77.55 155.01 31.84 Favored 'General case' 0 C--N 1.33 -0.266 0 CA-C-N 116.204 -0.453 . . . . 72.140000000000001 110.922 -179.996 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 34.2 tp60 -165.87 68.64 1.17 Allowed Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 121.583 0.706 . . . . 63.009999999999998 110.902 -179.931 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -177.63 1.98 Allowed 'Trans proline' 0 C--N 1.341 0.144 0 C-N-CA 122.667 2.245 . . . . 63.310000000000002 112.312 -179.984 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 30.4 p90 . . . . . 0 C--N 1.329 -0.315 0 CA-C-N 116.171 -0.468 . . . . 74.310000000000002 110.936 -179.928 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 C--O 1.23 0.044 0 CA-C-O 120.87 0.367 . . . . 63.140000000000001 110.894 . . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 171.77 107.8 0.2 Allowed Glycine 0 N--CA 1.452 -0.296 0 C-N-CA 120.754 -0.736 . . . . 64.150000000000006 112.524 179.898 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.7 tt0 -110.9 54.92 0.66 Allowed 'General case' 0 C--N 1.33 -0.278 0 CA-C-O 120.74 0.305 . . . . 73.349999999999994 110.872 -179.864 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 54.83 84.55 0.07 Allowed 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.203 -0.453 . . . . 71.140000000000001 110.882 179.998 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -77.85 160.57 73.88 Favored Pre-proline 0 C--N 1.329 -0.301 0 CA-C-O 121.597 0.713 . . . . 62.350000000000001 110.935 -179.98 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 120.93 7.64 Favored 'Trans proline' 0 C--N 1.342 0.204 0 C-N-CA 122.645 2.23 . . . . 63.210000000000001 112.369 179.977 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -167.38 73.25 1.0 Allowed Pre-proline 0 C--N 1.33 -0.281 0 CA-C-O 121.636 0.732 . . . . 72.510000000000005 111.116 179.861 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.83 167.71 23.76 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.714 2.276 . . . . 74.540000000000006 112.317 -179.939 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.72 102.11 0.98 Allowed 'Trans proline' 0 C--N 1.341 0.175 0 C-N-CA 122.65 2.234 . . . . 64.340000000000003 112.316 179.99 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -123.08 129.98 52.18 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.233 -0.44 . . . . 72.310000000000002 110.899 179.99 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.7 pt20 -143.05 157.57 60.47 Favored Pre-proline 0 C--N 1.329 -0.31 0 CA-C-O 121.657 0.741 . . . . 64.239999999999995 110.878 -179.956 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.81 134.0 26.84 Favored 'Trans proline' 0 C--N 1.341 0.182 0 C-N-CA 122.694 2.263 . . . . 63.119999999999997 112.332 179.992 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 21.9 m-85 . . . . . 0 C--N 1.328 -0.328 0 CA-C-N 116.174 -0.466 . . . . 75.439999999999998 110.897 -179.855 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.057 0 CA-C-O 120.854 0.359 . . . . 74.409999999999997 110.959 . . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -146.39 -102.96 0.34 Allowed Glycine 0 N--CA 1.451 -0.306 0 C-N-CA 120.743 -0.741 . . . . 71.129999999999995 112.49 179.929 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 4.9 tt0 52.6 31.82 10.72 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.762 0.315 . . . . 73.409999999999997 110.902 -179.903 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER 52.45 57.8 6.05 Favored 'General case' 0 C--N 1.33 -0.279 0 CA-C-N 116.176 -0.465 . . . . 70.430000000000007 110.89 -179.949 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.1 mt-30 -138.01 160.61 63.74 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.569 0.699 . . . . 61.409999999999997 110.944 179.998 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.77 85.62 0.61 Allowed 'Trans proline' 0 C--N 1.341 0.14 0 C-N-CA 122.685 2.257 . . . . 55.409999999999997 112.335 -179.988 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -144.89 68.72 14.36 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-O 121.566 0.698 . . . . 75.450000000000003 111.073 179.888 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.79 167.72 23.65 Favored 'Trans proline' 0 C--O 1.231 0.168 0 C-N-CA 122.668 2.245 . . . . 65.019999999999996 112.309 179.985 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.76 141.75 46.1 Favored 'Trans proline' 0 C--N 1.342 0.213 0 C-N-CA 122.676 2.251 . . . . 75.010000000000005 112.341 179.945 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 -118.2 123.72 46.17 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.17 -0.468 . . . . 51.229999999999997 110.922 179.99 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 pt20 -127.85 157.58 73.17 Favored Pre-proline 0 C--N 1.33 -0.277 0 CA-C-O 121.607 0.718 . . . . 73.319999999999993 110.9 -179.941 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.5 Cg_endo -69.81 -179.01 2.64 Favored 'Trans proline' 0 C--O 1.231 0.166 0 C-N-CA 122.677 2.251 . . . . 64.049999999999997 112.339 179.978 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 26.2 m-85 . . . . . 0 C--N 1.328 -0.342 0 CA-C-N 116.27 -0.423 . . . . 75.299999999999997 110.95 -179.939 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 C--O 1.231 0.102 0 CA-C-O 120.826 0.346 . . . . 72.430000000000007 110.957 . . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 109.03 117.84 4.07 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.777 -0.725 . . . . 34.310000000000002 112.473 179.876 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.2 tt0 -149.74 58.14 0.99 Allowed 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.805 0.336 . . . . 74.120000000000005 110.894 -179.889 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -98.65 97.6 8.84 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.166 -0.47 . . . . 64.409999999999997 110.921 -179.993 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 62.79 160.42 0.12 Allowed Pre-proline 0 C--N 1.329 -0.308 0 CA-C-O 121.662 0.744 . . . . 71.409999999999997 110.878 -179.975 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.75 118.15 5.51 Favored 'Trans proline' 0 C--N 1.342 0.196 0 C-N-CA 122.656 2.238 . . . . 65.010000000000005 112.351 179.976 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . . . . . . . . . . . -127.68 69.93 76.44 Favored Pre-proline 0 C--N 1.329 -0.318 0 CA-C-O 121.536 0.684 . . . . 71.420000000000002 111.087 179.88 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 167.72 23.62 Favored 'Trans proline' 0 C--O 1.231 0.173 0 C-N-CA 122.703 2.268 . . . . 43.43 112.333 179.982 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.77 128.77 16.49 Favored 'Trans proline' 0 C--N 1.342 0.198 0 C-N-CA 122.676 2.251 . . . . 54.039999999999999 112.321 179.966 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -99.8 131.61 45.67 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.212 -0.449 . . . . 70.530000000000001 110.929 179.98 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.3 tt0 -140.9 70.47 29.43 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.618 0.723 . . . . 73.340000000000003 110.913 -179.957 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_endo -69.81 112.27 3.04 Favored 'Trans proline' 0 C--N 1.342 0.189 0 C-N-CA 122.637 2.225 . . . . 74.140000000000001 112.343 -179.959 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 C--N 1.328 -0.355 0 CA-C-N 116.175 -0.466 . . . . 64.420000000000002 110.882 -179.861 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.231 0.092 0 CA-C-O 120.817 0.342 . . . . 62.119999999999997 110.934 . . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 141.82 97.68 0.29 Allowed Glycine 0 N--CA 1.451 -0.349 0 C-N-CA 120.747 -0.74 . . . . 74.420000000000002 112.488 179.903 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -89.76 -19.13 25.1 Favored 'General case' 0 C--N 1.329 -0.288 0 CA-C-O 120.755 0.312 . . . . 72.420000000000002 110.927 -179.894 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -173.37 55.44 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.186 -0.461 . . . . 72.409999999999997 110.876 -179.907 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.2 pt20 -153.27 157.53 32.88 Favored Pre-proline 0 C--N 1.328 -0.327 0 CA-C-O 121.59 0.709 . . . . 73.25 110.939 -179.952 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.82 113.41 3.37 Favored 'Trans proline' 0 C--N 1.341 0.141 0 C-N-CA 122.713 2.275 . . . . 62.450000000000003 112.293 -179.98 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.572 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -143.81 160.41 50.31 Favored Pre-proline 0 C--N 1.33 -0.27 0 CA-C-O 121.577 0.703 . . . . 73.25 111.076 179.874 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.572 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.5 Cg_endo -69.76 167.73 23.59 Favored 'Trans proline' 0 C--O 1.231 0.157 0 C-N-CA 122.703 2.268 . . . . 75.439999999999998 112.335 -179.983 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.73 161.71 44.87 Favored 'Trans proline' 0 C--N 1.341 0.172 0 C-N-CA 122.717 2.278 . . . . 73.540000000000006 112.331 179.941 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -71.76 136.84 47.29 Favored 'General case' 0 C--N 1.328 -0.341 0 CA-C-N 116.212 -0.449 . . . . 75.319999999999993 110.892 -179.996 . . . . . . . . 2 2 . 1 . 036 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -161.91 73.3 2.37 Favored Pre-proline 0 C--N 1.329 -0.307 0 CA-C-O 121.617 0.722 . . . . 75.420000000000002 110.952 -179.982 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_endo -69.78 125.46 12.16 Favored 'Trans proline' 0 C--O 1.232 0.177 0 C-N-CA 122.695 2.263 . . . . 72.129999999999995 112.285 -179.942 . . . . . . . . 1 1 . 1 . 036 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 15.8 t80 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.23 -0.441 . . . . 72.409999999999997 110.92 -179.955 . . . . . . . . 0 0 . 1 . 037 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 C--O 1.23 0.055 0 CA-C-O 120.833 0.349 . . . . 74.319999999999993 110.903 . . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -167.62 -64.62 0.03 OUTLIER Glycine 0 N--CA 1.451 -0.351 0 C-N-CA 120.728 -0.749 . . . . 73.510000000000005 112.485 179.87 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -100.59 52.81 0.87 Allowed 'General case' 0 C--N 1.329 -0.318 0 CA-C-O 120.833 0.349 . . . . 75.439999999999998 110.951 -179.932 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 41.8 tt0 -166.95 132.97 2.23 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.178 -0.464 . . . . 74.319999999999993 110.92 -179.973 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -143.51 160.56 50.73 Favored Pre-proline 0 C--N 1.328 -0.338 0 CA-C-O 121.629 0.728 . . . . 74.420000000000002 110.916 -179.994 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.0 Cg_endo -69.67 113.22 3.29 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.694 2.263 . . . . 62.119999999999997 112.344 179.989 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.587 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -104.72 160.43 26.03 Favored Pre-proline 0 C--N 1.329 -0.305 0 CA-C-O 121.58 0.705 . . . . 74.030000000000001 111.088 179.861 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.587 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 54.0 Cg_endo -69.8 167.76 23.57 Favored 'Trans proline' 0 C--N 1.341 0.179 0 C-N-CA 122.676 2.251 . . . . 75.109999999999999 112.365 -179.986 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.75 175.28 8.3 Favored 'Trans proline' 0 C--N 1.341 0.164 0 C-N-CA 122.674 2.25 . . . . 75.510000000000005 112.352 179.96 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 0.7 OUTLIER -55.77 151.92 10.45 Favored 'General case' 0 C--N 1.33 -0.27 0 CA-C-N 116.193 -0.458 . . . . 63.25 110.949 179.995 . . . . . . . . 2 2 . 1 . 037 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 7.4 pt20 -151.11 157.54 35.18 Favored Pre-proline 0 C--N 1.329 -0.315 0 CA-C-O 121.615 0.721 . . . . 62.130000000000003 110.904 -179.945 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -69.69 118.14 5.5 Favored 'Trans proline' 0 C--N 1.341 0.167 0 C-N-CA 122.71 2.273 . . . . 73.200000000000003 112.322 179.986 . . . . . . . . 1 1 . 1 . 037 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 69.3 t80 . . . . . 0 C--N 1.328 -0.327 0 CA-C-N 116.21 -0.45 . . . . 53.43 110.932 -179.964 . . . . . . . . 0 0 . 1 . 038 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.23 0.038 0 CA-C-O 120.858 0.361 . . . . 63.310000000000002 110.916 . . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -97.97 -108.07 2.67 Favored Glycine 0 N--CA 1.451 -0.337 0 C-N-CA 120.745 -0.74 . . . . 73.099999999999994 112.531 179.853 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -140.63 46.51 1.79 Allowed 'General case' 0 C--N 1.328 -0.327 0 CA-C-O 120.75 0.309 . . . . 72.209999999999994 110.942 -179.912 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 3.6 tp-100 -96.84 160.79 14.17 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.228 -0.442 . . . . 71.430000000000007 110.935 -179.958 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 3.5 pt20 -174.98 157.56 2.13 Favored Pre-proline 0 C--N 1.33 -0.261 0 CA-C-O 121.606 0.717 . . . . 74.030000000000001 110.875 -179.953 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.76 111.45 2.81 Favored 'Trans proline' 0 C--N 1.341 0.168 0 C-N-CA 122.65 2.234 . . . . 75.0 112.362 179.987 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.566 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -117.71 160.44 38.38 Favored Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.582 0.706 . . . . 64.340000000000003 111.081 179.893 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.566 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.5 Cg_endo -69.79 167.74 23.61 Favored 'Trans proline' 0 C--O 1.232 0.183 0 C-N-CA 122.701 2.268 . . . . 63.329999999999998 112.361 -179.994 . . . . . . . . 2 2 . 1 . 038 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo -69.77 113.24 3.31 Favored 'Trans proline' 0 C--N 1.341 0.159 0 C-N-CA 122.699 2.266 . . . . 70.310000000000002 112.33 179.997 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 32.3 mt-30 -61.19 166.03 4.01 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.212 -0.449 . . . . 73.439999999999998 110.897 -179.966 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 19.2 mt-30 -54.97 160.56 2.92 Favored Pre-proline 0 C--N 1.329 -0.285 0 CA-C-O 121.568 0.699 . . . . 75.5 110.929 -179.936 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.9 Cg_endo -69.67 -178.63 2.4 Favored 'Trans proline' 0 C--O 1.232 0.176 0 C-N-CA 122.694 2.262 . . . . 73.319999999999993 112.359 -179.999 . . . . . . . . 1 1 . 1 . 038 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 19.0 t80 . . . . . 0 C--N 1.328 -0.335 0 CA-C-N 116.239 -0.437 . . . . 73.450000000000003 110.928 -179.957 . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.3 pp . . . . . 0 C--O 1.231 0.094 0 CA-C-O 120.896 0.379 . . . . 70.439999999999998 110.869 . . . . . . . . . 0 0 . 1 . 039 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -88.05 -95.86 0.97 Allowed Glycine 0 N--CA 1.451 -0.318 0 C-N-CA 120.721 -0.752 . . . . 64.409999999999997 112.523 179.885 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 17.6 mt-30 -107.34 74.02 0.95 Allowed 'General case' 0 C--N 1.33 -0.281 0 CA-C-O 120.74 0.305 . . . . 73.409999999999997 110.894 -179.887 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.8 tp60 58.65 70.94 0.61 Allowed 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.166 -0.47 . . . . 73.219999999999999 110.906 -179.949 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 1.4 mp0 62.77 160.46 0.12 Allowed Pre-proline 0 C--N 1.329 -0.292 0 CA-C-O 121.561 0.696 . . . . 72.310000000000002 110.917 -179.974 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 52.9 Cg_endo -69.8 175.09 8.6 Favored 'Trans proline' 0 C--N 1.341 0.178 0 C-N-CA 122.684 2.256 . . . . 75.510000000000005 112.292 -179.947 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.583 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . 63.64 160.45 0.12 Allowed Pre-proline 0 C--N 1.329 -0.286 0 CA-C-O 121.579 0.704 . . . . 73.0 111.094 179.894 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.583 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 54.0 Cg_endo -69.75 167.77 23.47 Favored 'Trans proline' 0 C--N 1.342 0.19 0 C-N-CA 122.631 2.221 . . . . 71.019999999999996 112.356 -179.994 . . . . . . . . 2 2 . 1 . 039 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.83 171.31 14.78 Favored 'Trans proline' 0 C--N 1.341 0.142 0 C-N-CA 122.668 2.245 . . . . 63.520000000000003 112.329 179.955 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 3.8 mt-30 -124.4 135.48 53.32 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.215 -0.448 . . . . 65.120000000000005 110.94 -179.953 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 15.9 tt0 -146.77 70.71 12.46 Favored Pre-proline 0 C--N 1.329 -0.321 0 CA-C-O 121.629 0.728 . . . . 75.400000000000006 110.902 -179.915 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -69.82 -178.23 2.26 Favored 'Trans proline' 0 C--N 1.341 0.181 0 C-N-CA 122.632 2.221 . . . . 73.109999999999999 112.278 -179.968 . . . . . . . . 1 1 . 1 . 039 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 22.2 t80 . . . . . 0 C--N 1.328 -0.326 0 CA-C-N 116.191 -0.459 . . . . 61.240000000000002 110.876 -179.947 . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 1' ' ' LEU . . . . . . . . . . . . . 3.9 pp . . . . . 0 C--O 1.23 0.066 0 CA-C-O 120.794 0.331 . . . . 74.409999999999997 110.929 . . . . . . . . . 0 0 . 1 . 040 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 110.64 -63.71 0.27 Allowed Glycine 0 N--CA 1.452 -0.289 0 C-N-CA 120.732 -0.747 . . . . 44.310000000000002 112.465 179.909 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 8.3 tp-100 62.72 98.44 0.03 OUTLIER 'General case' 0 C--N 1.329 -0.302 0 CA-C-O 120.739 0.304 . . . . 75.120000000000005 110.897 -179.876 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 11.4 tt0 -148.86 135.32 19.48 Favored 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.204 -0.453 . . . . 71.530000000000001 110.9 -179.962 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 5' ' ' GLN . . . . . . . . . . . . . 42.8 mt-30 -79.91 160.56 68.63 Favored Pre-proline 0 C--N 1.329 -0.303 0 CA-C-O 121.556 0.693 . . . . 72.409999999999997 110.942 179.997 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_endo -69.8 116.44 4.56 Favored 'Trans proline' 0 C--N 1.341 0.169 0 C-N-CA 122.616 2.211 . . . . 72.109999999999999 112.353 179.979 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 7' ' ' ALA . . . . . 0.585 ' HB1' ' HD2' ' A' ' 8' ' ' PRO . . . -166.37 160.43 12.25 Favored Pre-proline 0 C--N 1.329 -0.32 0 CA-C-O 121.585 0.707 . . . . 64.150000000000006 111.104 179.884 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.585 ' HD2' ' HB1' ' A' ' 7' ' ' ALA . 53.5 Cg_endo -69.79 167.76 23.56 Favored 'Trans proline' 0 C--N 1.342 0.21 0 C-N-CA 122.651 2.234 . . . . 64.340000000000003 112.352 179.983 . . . . . . . . 2 2 . 1 . 040 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_endo -69.76 90.66 0.52 Allowed 'Trans proline' 0 C--N 1.341 0.162 0 C-N-CA 122.712 2.274 . . . . 75.319999999999993 112.297 179.987 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 10' ' ' GLN . . . . . . . . . . . . . 53.2 tp60 -106.39 148.65 27.84 Favored 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.191 -0.459 . . . . 65.439999999999998 110.956 179.964 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 50.1 mt-30 -112.08 78.05 2.26 Favored Pre-proline 0 C--N 1.329 -0.312 0 CA-C-O 121.587 0.708 . . . . 70.439999999999998 110.896 -179.911 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 12' ' ' PRO . . . . . . . . . . . . . 54.1 Cg_endo -69.78 88.34 0.54 Allowed 'Trans proline' 0 C--N 1.341 0.165 0 C-N-CA 122.688 2.259 . . . . 74.049999999999997 112.365 179.963 . . . . . . . . 1 1 . 1 . 040 nuclear nobuild full ' A' A ' 13' ' ' TYR . . . . . . . . . . . . . 8.3 m-85 . . . . . 0 C--N 1.329 -0.308 0 CA-C-N 116.225 -0.443 . . . . 75.540000000000006 110.895 -179.864 . . . . . . . . 0 0 . 1 stop_ save_