data_1pfs_residue save_MolProbity _Software.Sf_category software _Software.Sf_framecode MolProbity _Software.Entry_ID ? _Software.ID 1 _Software.Name MolProbity _Software.Version 4.0 _Software.Details . save_ save_CYRANGE _Software.Sf_category software _Software.Sf_framecode CYRANGE _Software.Entry_ID ? _Software.ID 2 _Software.Name CYRANGE _Software.Version 2.0 _Software.Details . save_ save_Structure_validation_residue _Structure_validation_residue.Sf_category structure_validation _Structure_validation_residue.Sf_framecode Structure_validation_residue _Structure_validation_residue.Entry_ID ? _Structure_validation_residue.List_ID 1 _Structure_validation_residue.PDB_accession_code 1pfs _Structure_validation_residue.Date_analyzed 2016-10-06 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' ' ' MET . . . . . . . . . . . . . 57.1 mtm . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 120.936 0.398 . . . . 1.47 110.301 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -144.35 165.54 27.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.999 -0.546 . . . . 1.9399999999999999 110.212 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ILE . . . . . . . . . . . . . 18.1 tt -150.84 145.63 16.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.821 0.343 . . . . 1.1100000000000001 110.426 179.832 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -77.61 126.03 30.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.196 -0.456 . . . . 1.5900000000000001 110.547 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 71.2 mt -130.05 116.88 38.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.07 -0.514 . . . . 1.1299999999999999 110.015 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.432 ' HA ' ' HA ' ' A' ' 52' ' ' SER . 38.7 m -92.16 104.52 16.89 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.368 -0.604 . . . . 1.23 109.368 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -80.26 160.89 25.39 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.27 0.557 . . . . 0.89000000000000001 111.05 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 66.3 p -129.84 -179.34 5.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.382 -0.826 . . . . 1.29 109.72 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.42 23.73 7.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.335 -0.393 . . . . 2.3799999999999999 110.562 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.88 101.17 11.93 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 116.144 -0.48 . . . . 1.1799999999999999 109.782 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.413 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 2.2 t -120.47 119.78 60.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.162 0.506 . . . . 1.27 110.857 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . 0.507 ' N ' ' O ' ' A' ' 24' ' ' PHE . 0.0 OUTLIER -89.28 113.96 25.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.526 -0.761 . . . . 4.1500000000000004 110.215 179.532 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -113.15 145.93 40.11 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.043 -0.526 . . . . 2.3599999999999999 109.94 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.15 -178.41 44.34 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 120.717 -0.754 . . . . 1.52 111.799 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.15 145.6 32.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.925 0.393 . . . . 2.3300000000000001 110.098 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -87.17 172.03 10.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.142 -0.481 . . . . 2.1800000000000002 110.156 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.94 -24.81 59.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 2.8900000000000001 110.37 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.0 mmtp -87.28 8.02 26.06 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.553 -0.294 . . . . 4.5099999999999998 111.097 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.63 2.62 76.25 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 111.799 -0.52 . . . . 2.5 111.799 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -82.54 143.88 48.33 Favored Pre-proline 0 C--N 1.332 -0.164 0 CA-C-N 117.234 0.517 . . . . 2.6600000000000001 110.804 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -83.28 140.65 9.84 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.116 2.544 . . . . 1.9099999999999999 112.091 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 27.3 p90 -136.33 148.08 47.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.051 0.453 . . . . 1.72 110.77 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.0 m -127.82 99.01 5.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.543 -0.753 . . . . 1.3400000000000001 110.05 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' PHE . . . . . 0.507 ' O ' ' N ' ' A' ' 12' ' ' ARG . 29.1 m-85 -98.89 126.62 44.6 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.008 -0.542 . . . . 1.5900000000000001 109.837 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' GLN . . . . . 0.413 ' HA ' ' HA ' ' A' ' 11' ' ' VAL . 54.3 tt0 -114.13 143.89 44.05 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.679 0.276 . . . . 0.89000000000000001 110.283 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -81.83 155.21 25.5 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 121.422 0.629 . . . . 1.26 110.635 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -173.65 145.75 8.43 Favored Glycine 0 CA--C 1.522 0.528 0 CA-C-N 115.032 -0.986 . . . . 0.51000000000000001 111.043 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.412 ' HB2' ' HB ' ' A' ' 6' ' ' THR . 24.4 m-85 -96.7 137.74 35.32 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.02 0.438 . . . . 1.71 110.191 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . 0.446 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . 0.2 OUTLIER -104.28 142.82 33.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.695 -0.684 . . . . 1.5 111.06 -178.817 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 71.9 m-70 -117.24 117.96 30.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.084 -0.507 . . . . 0.82999999999999996 110.19 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.426 ' CD2' ' O ' ' B' ' 59' ' ' ILE . 3.3 mp -113.46 138.91 49.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.035 0.445 . . . . 2.1600000000000001 110.908 -179.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.05 -24.46 67.1 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.763 -0.653 . . . . 3.1899999999999999 111.236 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -98.27 11.14 38.87 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.003 -0.544 . . . . 1.6000000000000001 111.656 -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.1 mmtm -131.36 131.5 23.03 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 110.011 -0.366 . . . . 1.8799999999999999 110.011 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -73.46 -34.98 5.23 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.478 2.118 . . . . 1.4199999999999999 112.07 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -112.1 151.82 43.9 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.263 -0.426 . . . . 2.1800000000000002 110.316 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -78.3 151.55 26.44 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.853 2.369 . . . . 0.95999999999999996 111.602 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 19.8 mt -107.07 138.97 42.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.965 0.412 . . . . 1.8999999999999999 111.316 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 42.1 tt0 -78.08 120.05 22.37 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.096 -0.705 . . . . 2.1200000000000001 109.096 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' CYS . . . . . 0.446 ' SG ' ' HB2' ' A' ' 29' ' ' LEU . 2.6 m -134.67 157.71 45.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.863 0.363 . . . . 1.28 110.626 -178.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -115.09 146.38 41.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.127 -0.488 . . . . 2.6299999999999999 109.706 179.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -124.35 145.57 49.35 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.021 0.439 . . . . 0.56999999999999995 111.765 -178.32 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -90.94 75.8 6.33 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 108.974 -0.75 . . . . 1.2 108.974 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 19.3 m -82.64 161.62 3.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.589 -0.732 . . . . 1.2 111.791 -178.424 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -96.54 -36.3 10.81 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.479 -0.934 . . . . 2.3700000000000001 108.479 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -126.42 146.66 49.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.119 -0.946 . . . . 1.28 109.403 179.271 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 94.8 t -66.94 127.79 29.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.956 0.408 . . . . 1.3700000000000001 110.848 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 89.9 mt -98.27 134.09 22.3 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 115.943 -0.571 . . . . 1.1499999999999999 109.967 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -66.61 131.46 26.13 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.355 2.037 . . . . 0.69999999999999996 112.318 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -49.5 128.39 17.28 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.595 -0.729 . . . . 1.29 110.821 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 162.56 158.5 9.67 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.493 -1.043 . . . . 0.70999999999999996 110.493 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . 0.432 ' HA ' ' HA ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -81.47 129.87 34.82 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.891 0.377 . . . . 1.2 110.647 -179.871 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TYR . . . . . 0.459 ' CD2' ' SD ' ' A' ' 75' ' ' MET . 55.5 m-85 -129.07 155.02 46.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.926 -0.579 . . . . 1.01 111.3 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -107.15 87.75 2.58 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 106.405 -1.702 . . . . 2.1499999999999999 106.405 176.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.2 t -84.07 127.21 67.74 Favored Pre-proline 0 C--N 1.319 -0.721 0 N-CA-C 113.714 1.005 . . . . 1.1499999999999999 113.714 -175.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' PRO . . . . . 0.461 ' HD3' ' HA ' ' A' ' 75' ' ' MET . 41.3 Cg_endo -80.1 112.03 2.76 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.973 2.448 . . . . 0.71999999999999997 110.183 176.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 42.4 p90 -110.87 165.34 11.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.37 0.605 . . . . 0.93000000000000005 111.927 -178.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 12.6 mtt180 -142.27 162.99 34.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.894 -1.048 . . . . 3.2400000000000002 108.653 179.031 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ILE . . . . . 0.439 ' O ' ' CD2' ' B' ' 31' ' ' LEU . 74.1 mt -100.93 102.34 13.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.854 0.359 . . . . 1.27 110.406 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -95.73 156.02 16.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.255 -0.43 . . . . 3.0099999999999998 110.295 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' VAL . . . . . 0.422 HG12 ' SG ' ' B' ' 40' ' ' CYS . 65.2 t -116.18 112.72 40.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.126 -0.488 . . . . 1.28 109.937 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ASN . . . . . 0.438 ' O ' ' ND2' ' A' ' 63' ' ' ASN . 51.8 t30 -113.03 133.67 54.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.726 -0.67 . . . . 2.5899999999999999 110.269 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.438 ' ND2' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER 49.08 24.4 0.91 Allowed 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.066 -0.515 . . . . 1.73 111.456 179.683 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.09 17.15 58.21 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 116.382 -0.372 . . . . 0.68999999999999995 112.822 178.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 7.8 mtp180 -123.8 130.29 24.5 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 117.128 0.464 . . . . 4.2300000000000004 110.001 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.97 120.91 7.14 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.407 2.071 . . . . 0.54000000000000004 111.906 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -134.5 163.6 29.33 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.032 0.444 . . . . 1.8799999999999999 110.865 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LEU . . . . . . . . . . . . . 96.1 mt -88.62 138.49 31.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.856 -0.611 . . . . 1.21 111.481 -179.228 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -122.35 107.4 12.04 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.643 -0.873 . . . . 1.23 108.643 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -88.77 128.29 35.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.242 0.544 . . . . 0.51000000000000001 111.283 -178.438 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ASP . . . . . 0.425 ' OD1' ' N ' ' A' ' 74' ' ' ALA . 7.6 t0 -94.22 89.0 5.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.352 -0.84 . . . . 0.88 110.138 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -69.79 -9.94 56.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.028 -0.533 . . . . 0.77000000000000002 111.341 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LYS . . . . . 0.481 ' N ' ' CD ' ' A' ' 73' ' ' LYS . 1.1 mptp? -80.01 -20.75 44.66 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 120.501 0.191 . . . . 2.9300000000000002 111.011 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' ALA . . . . . 0.425 ' N ' ' OD1' ' A' ' 71' ' ' ASP . . . -120.07 13.98 12.21 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.224 0.453 . . . . 1.3100000000000001 112.224 -178.209 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' MET . . . . . 0.461 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 10.6 ptt? -72.84 143.06 47.96 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.316 -0.554 . . . . 1.1799999999999999 110.09 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 31.6 mttp -110.05 128.26 55.32 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.441 -0.8 . . . . 3.27 110.429 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ARG . . . . . 0.441 ' HG3' ' CE2' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -62.7 128.96 38.39 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 109.446 -0.576 . . . . 4.0800000000000001 109.446 179.179 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.495 -0.764 . . . . 1.5 110.382 -179.514 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 57.0 mtm . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 120.994 0.425 . . . . 1.46 110.32 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -144.39 165.62 27.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.996 -0.547 . . . . 1.9299999999999999 110.198 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' ILE . . . . . 0.402 HD11 HG22 ' B' ' 3' ' ' ILE . 18.1 tt -150.98 145.62 16.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.879 0.371 . . . . 1.1000000000000001 110.374 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -77.54 126.04 30.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.46 . . . . 1.5900000000000001 110.557 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 71.2 mt -130.11 116.92 38.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.079 -0.51 . . . . 1.1299999999999999 110.002 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.423 ' HA ' ' HA ' ' B' ' 52' ' ' SER . 38.3 m -92.21 104.53 16.89 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.381 -0.6 . . . . 1.23 109.381 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -80.33 160.93 25.29 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.277 0.56 . . . . 0.89000000000000001 111.05 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 66.2 p -129.9 -179.38 5.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.382 -0.826 . . . . 1.29 109.741 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.37 23.6 7.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.335 -0.393 . . . . 2.3799999999999999 110.519 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.76 101.13 11.91 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.152 -0.476 . . . . 1.1699999999999999 109.784 179.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' VAL . . . . . 0.404 ' HA ' ' HA ' ' B' ' 25' ' ' GLN . 2.2 t -120.43 119.87 61.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.384 -0.526 . . . . 1.27 110.861 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' ARG . . . . . 0.48 ' N ' ' O ' ' B' ' 24' ' ' PHE . 0.0 OUTLIER -89.25 113.99 25.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.485 -0.78 . . . . 4.1500000000000004 110.226 179.505 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -113.26 145.81 40.41 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.118 -0.492 . . . . 2.3399999999999999 109.924 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.21 -178.38 44.4 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 120.717 -0.754 . . . . 1.51 111.767 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.07 145.66 32.13 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.39 -0.405 . . . . 2.3199999999999998 110.125 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -87.19 172.08 10.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.123 -0.49 . . . . 2.1800000000000002 110.16 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.94 -24.85 59.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.201 -0.454 . . . . 2.8900000000000001 110.417 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 10.0 mmtp -87.25 8.06 25.75 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.63 -0.259 . . . . 4.5199999999999996 111.121 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.6 2.68 76.26 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 111.82 -0.512 . . . . 2.5099999999999998 111.82 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -82.69 143.83 47.68 Favored Pre-proline 0 C--N 1.333 -0.148 0 CA-C-N 117.252 0.526 . . . . 2.6600000000000001 110.763 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -83.26 140.62 9.85 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 123.065 2.51 . . . . 1.9099999999999999 112.072 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' TYR . . . . . . . . . . . . . 27.3 p90 -136.24 148.05 47.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.107 0.48 . . . . 1.74 110.75 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 24.1 m -127.85 98.94 5.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.639 -0.71 . . . . 1.3500000000000001 109.995 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' PHE . . . . . 0.48 ' O ' ' N ' ' B' ' 12' ' ' ARG . 29.1 m-85 -98.86 126.63 44.57 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.961 -0.563 . . . . 1.5900000000000001 109.873 179.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' GLN . . . . . 0.404 ' HA ' ' HA ' ' B' ' 11' ' ' VAL . 54.4 tt0 -114.08 143.87 44.06 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.688 0.28 . . . . 0.89000000000000001 110.311 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -81.9 155.19 25.43 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 121.491 0.663 . . . . 1.28 110.67 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -173.64 145.73 8.41 Favored Glycine 0 CA--C 1.523 0.548 0 CA-C-N 115.029 -0.987 . . . . 0.51000000000000001 111.042 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' PHE . . . . . 0.402 ' HB2' ' HB ' ' B' ' 6' ' ' THR . 24.5 m-85 -96.61 137.77 35.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.042 0.448 . . . . 1.72 110.224 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' LEU . . . . . 0.44 ' HB2' ' SG ' ' B' ' 40' ' ' CYS . 0.2 OUTLIER -104.35 142.78 33.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.685 . . . . 1.5 111.006 -178.775 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' HIS . . . . . . . . . . . . . 71.8 m-70 -117.23 117.99 31.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.074 -0.512 . . . . 0.83999999999999997 110.159 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' LEU . . . . . 0.439 ' CD2' ' O ' ' A' ' 59' ' ' ILE . 3.2 mp -113.51 138.97 49.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.077 0.465 . . . . 2.1600000000000001 110.924 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.01 -24.47 67.06 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.688 -0.687 . . . . 3.1899999999999999 111.275 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' ASP . . . . . . . . . . . . . 12.5 p-10 -98.34 11.28 38.54 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.988 -0.551 . . . . 1.6000000000000001 111.686 -178.969 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 9.2 mmtm -131.48 131.45 22.91 Favored Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 109.923 -0.399 . . . . 1.8999999999999999 109.923 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -73.43 -34.97 5.29 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.44 2.094 . . . . 1.4199999999999999 112.098 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -112.11 151.83 43.91 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.299 -0.409 . . . . 2.1800000000000002 110.35 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -78.34 151.55 26.3 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.86 2.373 . . . . 0.94999999999999996 111.584 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 19.9 mt -107.1 139.03 42.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.002 0.429 . . . . 1.8999999999999999 111.281 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 42.1 tt0 -78.09 120.03 22.34 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.071 -0.714 . . . . 2.1299999999999999 109.071 178.945 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 40' ' ' CYS . . . . . 0.44 ' SG ' ' HB2' ' B' ' 29' ' ' LEU . 2.6 m -134.62 157.63 46.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.823 0.344 . . . . 1.28 110.603 -178.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -115.11 146.3 41.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.122 -0.49 . . . . 2.6200000000000001 109.689 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -124.25 145.6 49.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.221 -0.445 . . . . 0.56999999999999995 111.746 -178.279 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -90.98 75.84 6.29 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.925 -0.768 . . . . 1.1899999999999999 108.925 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 19.1 m -82.65 161.62 3.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.582 -0.736 . . . . 1.2 111.835 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -96.55 -36.36 10.78 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 108.479 -0.934 . . . . 2.3999999999999999 108.479 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -126.42 146.66 49.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.121 -0.945 . . . . 1.26 109.465 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 47' ' ' VAL . . . . . . . . . . . . . 93.0 t -66.84 127.76 28.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.933 0.397 . . . . 1.3700000000000001 110.864 -179.456 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 90.1 mt -98.3 134.11 22.26 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 115.999 -0.546 . . . . 1.1499999999999999 109.924 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -66.65 131.36 25.78 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.322 2.015 . . . . 0.70999999999999996 112.343 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -49.38 128.35 16.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.622 -0.717 . . . . 1.29 110.907 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . 162.57 158.5 9.68 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.56 -1.016 . . . . 0.70999999999999996 110.56 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 52' ' ' SER . . . . . 0.423 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 0.3 OUTLIER -81.42 129.96 34.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.923 0.392 . . . . 1.2 110.59 -179.847 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 53' ' ' TYR . . . . . 0.466 ' CD2' ' SD ' ' B' ' 75' ' ' MET . 55.9 m-85 -129.23 155.15 46.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.96 -0.564 . . . . 1.03 111.283 -179.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -107.22 87.34 2.48 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 106.513 -1.662 . . . . 2.1600000000000001 106.513 176.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 16.4 t -83.81 127.21 68.38 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 113.813 1.042 . . . . 1.1499999999999999 113.813 -175.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 56' ' ' PRO . . . . . 0.466 ' HD3' ' HA ' ' B' ' 75' ' ' MET . 41.1 Cg_endo -80.13 112.03 2.75 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.972 2.448 . . . . 0.72999999999999998 110.18 176.507 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 57' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -110.95 165.34 11.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.39 0.614 . . . . 0.93999999999999995 111.914 -178.587 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -142.36 162.93 34.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.897 -1.047 . . . . 3.2400000000000002 108.606 179.098 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' ILE . . . . . 0.426 ' O ' ' CD2' ' A' ' 31' ' ' LEU . 73.8 mt -100.9 102.41 13.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 120.915 0.388 . . . . 1.26 110.381 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -95.81 156.14 16.46 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.3 -0.409 . . . . 3.02 110.264 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' VAL . . . . . 0.422 HG12 ' SG ' ' A' ' 40' ' ' CYS . 64.8 t -116.28 112.65 40.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.13 -0.486 . . . . 1.28 109.93 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' ASN . . . . . 0.469 ' O ' ' ND2' ' B' ' 63' ' ' ASN . 51.9 t30 -112.93 133.6 54.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.75 -0.659 . . . . 2.5899999999999999 110.289 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' ASN . . . . . 0.469 ' ND2' ' O ' ' B' ' 62' ' ' ASN . 0.0 OUTLIER 49.05 24.42 0.9 Allowed 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.103 -0.499 . . . . 1.74 111.491 179.726 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.07 17.25 58.05 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 116.392 -0.367 . . . . 0.69999999999999996 112.817 178.052 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -123.78 130.37 24.47 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 117.139 0.47 . . . . 4.2300000000000004 109.979 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -72.08 120.81 7.06 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.456 2.104 . . . . 0.54000000000000004 111.875 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -134.48 163.6 29.33 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.05 0.452 . . . . 1.8799999999999999 110.841 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' LEU . . . . . . . . . . . . . 96.1 mt -88.66 138.53 31.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.811 -0.631 . . . . 1.21 111.443 -179.158 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -122.29 107.42 12.09 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.584 -0.895 . . . . 1.22 108.584 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -88.74 128.24 35.62 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.193 0.521 . . . . 0.51000000000000001 111.269 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' ASP . . . . . 0.43 ' OD1' ' N ' ' B' ' 74' ' ' ALA . 7.2 t0 -94.17 88.97 5.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.444 -0.798 . . . . 0.90000000000000002 110.132 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -69.68 -10.05 56.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.044 -0.526 . . . . 0.77000000000000002 111.481 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 73' ' ' LYS . . . . . 0.485 ' N ' ' CD ' ' B' ' 73' ' ' LYS . 1.1 mptp? -80.07 -20.2 45.76 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 120.482 0.182 . . . . 2.9199999999999999 111.095 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 74' ' ' ALA . . . . . 0.43 ' N ' ' OD1' ' B' ' 71' ' ' ASP . . . -121.07 15.1 11.53 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 111.919 0.34 . . . . 1.3100000000000001 111.919 -178.325 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 75' ' ' MET . . . . . 0.466 ' SD ' ' CD2' ' B' ' 53' ' ' TYR . 10.4 ptt? -73.28 144.38 46.65 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 120.164 -0.615 . . . . 1.1799999999999999 109.829 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 30.5 mttp -111.88 127.49 55.85 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.577 -0.738 . . . . 3.2799999999999998 110.544 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 77' ' ' ARG . . . . . 0.423 ' HG3' ' CE2' ' B' ' 53' ' ' TYR . 0.0 OUTLIER -61.76 128.55 36.75 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.247 -0.649 . . . . 4.0800000000000001 109.247 179.435 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.403 -0.808 . . . . 1.49 110.032 -179.655 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.1 mtm . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 120.936 0.398 . . . . 1.0900000000000001 110.301 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -144.35 165.54 27.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.999 -0.546 . . . . 1.6200000000000001 110.212 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ILE . . . . . 0.475 HD11 HD12 ' A' ' 31' ' ' LEU . 18.1 tt -150.84 145.63 16.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.821 0.343 . . . . 0.57999999999999996 110.426 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -77.61 126.03 30.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.196 -0.456 . . . . 1.0700000000000001 110.547 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 71.2 mt -130.05 116.88 38.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.07 -0.514 . . . . 0.46000000000000002 110.015 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.448 ' HB ' ' HB2' ' A' ' 28' ' ' PHE . 38.7 m -92.16 104.52 16.89 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.368 -0.604 . . . . 0.62 109.368 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -80.26 160.89 25.39 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.27 0.557 . . . . 0.75 111.05 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 66.3 p -129.84 -179.34 5.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.382 -0.826 . . . . 0.65000000000000002 109.72 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.42 23.73 7.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.335 -0.393 . . . . 2.3799999999999999 110.562 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.88 101.17 11.93 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 116.144 -0.48 . . . . 0.84999999999999998 109.782 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 2.2 t -120.47 119.78 60.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.162 0.506 . . . . 0.93000000000000005 110.857 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.507 ' N ' ' O ' ' A' ' 24' ' ' PHE . 0.0 OUTLIER -89.28 113.96 25.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.526 -0.761 . . . . 3.5 110.215 179.532 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -113.15 145.93 40.11 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.043 -0.526 . . . . 2.1400000000000001 109.94 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.15 -178.41 44.34 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 120.717 -0.754 . . . . 1.45 111.799 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.15 145.6 32.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.925 0.393 . . . . 1.98 110.098 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -87.17 172.03 10.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.142 -0.481 . . . . 2.1800000000000002 110.156 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.94 -24.81 59.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 2.71 110.37 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.0 mmtp -87.28 8.02 26.06 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.553 -0.294 . . . . 4.1600000000000001 111.097 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.63 2.62 76.25 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 111.799 -0.52 . . . . 2.3799999999999999 111.799 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -82.54 143.88 48.33 Favored Pre-proline 0 C--N 1.332 -0.164 0 CA-C-N 117.234 0.517 . . . . 2.5699999999999998 110.804 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -83.28 140.65 9.84 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.116 2.544 . . . . 1.78 112.091 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 27.3 p90 -136.33 148.08 47.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.051 0.453 . . . . 1.52 110.77 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.0 m -127.82 99.01 5.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.543 -0.753 . . . . 0.95999999999999996 110.05 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' PHE . . . . . 0.507 ' O ' ' N ' ' A' ' 12' ' ' ARG . 29.1 m-85 -98.89 126.62 44.6 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.008 -0.542 . . . . 1.26 109.837 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' GLN . . . . . 0.436 ' HA ' ' HA ' ' A' ' 11' ' ' VAL . 54.3 tt0 -114.13 143.89 44.05 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.679 0.276 . . . . 0.69999999999999996 110.283 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -81.83 155.21 25.5 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 121.422 0.629 . . . . 1.26 110.635 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -173.65 145.75 8.43 Favored Glycine 0 CA--C 1.522 0.528 0 CA-C-N 115.032 -0.986 . . . . 0.51000000000000001 111.043 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.448 ' HB2' ' HB ' ' A' ' 6' ' ' THR . 24.4 m-85 -96.7 137.74 35.32 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.02 0.438 . . . . 1.21 110.191 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . 0.474 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . 0.2 OUTLIER -104.28 142.82 33.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.695 -0.684 . . . . 0.91000000000000003 111.06 -178.817 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 71.9 m-70 -117.24 117.96 30.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.084 -0.507 . . . . 0.72999999999999998 110.19 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.71 HD21 ' O ' ' B' ' 59' ' ' ILE . 3.3 mp -113.46 138.91 49.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.035 0.445 . . . . 1.6299999999999999 110.908 -179.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.05 -24.46 67.1 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.763 -0.653 . . . . 3.1899999999999999 111.236 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -98.27 11.14 38.87 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.003 -0.544 . . . . 1.5900000000000001 111.656 -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.1 mmtm -131.36 131.5 23.03 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 110.011 -0.366 . . . . 1.3799999999999999 110.011 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -73.46 -34.98 5.23 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.478 2.118 . . . . 1.21 112.07 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -112.1 151.82 43.9 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.263 -0.426 . . . . 1.72 110.316 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -78.3 151.55 26.44 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.853 2.369 . . . . 0.92000000000000004 111.602 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 19.8 mt -107.07 138.97 42.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.965 0.412 . . . . 1.3400000000000001 111.316 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 42.1 tt0 -78.08 120.05 22.37 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.096 -0.705 . . . . 1.8899999999999999 109.096 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' CYS . . . . . 0.746 ' SG ' HG21 ' B' ' 61' ' ' VAL . 2.6 m -134.67 157.71 45.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.863 0.363 . . . . 1.1100000000000001 110.626 -178.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -115.09 146.38 41.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.127 -0.488 . . . . 2.0499999999999998 109.706 179.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -124.35 145.57 49.35 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.021 0.439 . . . . 0.56999999999999995 111.765 -178.32 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -90.94 75.8 6.33 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 108.974 -0.75 . . . . 1.1000000000000001 108.974 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 19.3 m -82.64 161.62 3.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.589 -0.732 . . . . 0.84999999999999998 111.791 -178.424 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -96.54 -36.3 10.81 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.479 -0.934 . . . . 2.3700000000000001 108.479 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -126.42 146.66 49.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.119 -0.946 . . . . 0.97999999999999998 109.403 179.271 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 94.8 t -66.94 127.79 29.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.956 0.408 . . . . 0.73999999999999999 110.848 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 89.9 mt -98.27 134.09 22.3 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 115.943 -0.571 . . . . 0.53000000000000003 109.967 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -66.61 131.46 26.13 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.355 2.037 . . . . 0.66000000000000003 112.318 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -49.5 128.39 17.28 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.595 -0.729 . . . . 0.78000000000000003 110.821 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 162.56 158.5 9.67 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.493 -1.043 . . . . 0.67000000000000004 110.493 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -81.47 129.87 34.82 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.891 0.377 . . . . 0.94999999999999996 110.647 -179.871 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TYR . . . . . 0.462 ' CE2' ' HG3' ' A' ' 77' ' ' ARG . 55.5 m-85 -129.07 155.02 46.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.926 -0.579 . . . . 0.70999999999999996 111.3 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -107.15 87.75 2.58 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 106.405 -1.702 . . . . 1.8400000000000001 106.405 176.452 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.2 t -84.07 127.21 67.74 Favored Pre-proline 0 C--N 1.319 -0.721 0 N-CA-C 113.714 1.005 . . . . 0.56000000000000005 113.714 -175.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' PRO . . . . . 0.514 ' HD3' ' HA ' ' A' ' 75' ' ' MET . 41.3 Cg_endo -80.1 112.03 2.76 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.973 2.448 . . . . 0.68000000000000005 110.183 176.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 42.4 p90 -110.87 165.34 11.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.37 0.605 . . . . 0.68000000000000005 111.927 -178.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 12.6 mtt180 -142.27 162.99 34.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.894 -1.048 . . . . 2.6600000000000001 108.653 179.031 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ILE . . . . . 0.7 ' O ' HD21 ' B' ' 31' ' ' LEU . 74.1 mt -100.93 102.34 13.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.854 0.359 . . . . 0.80000000000000004 110.406 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -95.73 156.02 16.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.255 -0.43 . . . . 2.3300000000000001 110.295 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' VAL . . . . . 0.748 HG21 ' SG ' ' B' ' 40' ' ' CYS . 65.2 t -116.18 112.72 40.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.126 -0.488 . . . . 0.78000000000000003 109.937 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ASN . . . . . 0.438 ' O ' ' ND2' ' A' ' 63' ' ' ASN . 51.8 t30 -113.03 133.67 54.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.726 -0.67 . . . . 2.04 110.269 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.438 ' ND2' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER 49.08 24.4 0.91 Allowed 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.066 -0.515 . . . . 1.7 111.456 179.683 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.09 17.15 58.21 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 116.382 -0.372 . . . . 0.68000000000000005 112.822 178.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 7.8 mtp180 -123.8 130.29 24.5 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 117.128 0.464 . . . . 3.52 110.001 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.97 120.91 7.14 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.407 2.071 . . . . 0.54000000000000004 111.906 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -134.5 163.6 29.33 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.032 0.444 . . . . 1.8799999999999999 110.865 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LEU . . . . . 1.075 HD21 HD21 ' B' ' 68' ' ' LEU . 96.1 mt -88.62 138.49 31.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.856 -0.611 . . . . 0.69999999999999996 111.481 -179.228 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -122.35 107.4 12.04 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.643 -0.873 . . . . 0.64000000000000001 108.643 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -88.77 128.29 35.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.242 0.544 . . . . 0.51000000000000001 111.283 -178.438 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ASP . . . . . 0.425 ' OD1' ' N ' ' A' ' 74' ' ' ALA . 7.6 t0 -94.22 89.0 5.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.352 -0.84 . . . . 0.88 110.138 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -69.79 -9.94 56.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.028 -0.533 . . . . 0.66000000000000003 111.341 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LYS . . . . . 0.481 ' N ' ' CD ' ' A' ' 73' ' ' LYS . 1.1 mptp? -80.01 -20.75 44.66 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 120.501 0.191 . . . . 2.5 111.011 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' ALA . . . . . 0.425 ' N ' ' OD1' ' A' ' 71' ' ' ASP . . . -120.07 13.98 12.21 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.224 0.453 . . . . 0.73999999999999999 112.224 -178.209 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' MET . . . . . 0.514 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 10.6 ptt? -72.84 143.06 47.96 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.316 -0.554 . . . . 0.69999999999999996 110.09 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 31.6 mttp -110.05 128.26 55.32 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.441 -0.8 . . . . 2.7799999999999998 110.429 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ARG . . . . . 0.462 ' HG3' ' CE2' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -62.7 128.96 38.39 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 109.446 -0.576 . . . . 3.4100000000000001 109.446 179.179 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.495 -0.764 . . . . 1.5 110.382 -179.514 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 57.0 mtm . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 120.994 0.425 . . . . 1.1000000000000001 110.32 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -144.39 165.62 27.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.996 -0.547 . . . . 1.6299999999999999 110.198 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 3' ' ' ILE . . . . . 0.468 HD11 HD12 ' B' ' 31' ' ' LEU . 18.1 tt -150.98 145.62 16.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.879 0.371 . . . . 0.57999999999999996 110.374 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -77.54 126.04 30.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.46 . . . . 1.0700000000000001 110.557 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 71.2 mt -130.11 116.92 38.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.079 -0.51 . . . . 0.46000000000000002 110.002 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.441 ' HA ' ' HA ' ' B' ' 52' ' ' SER . 38.3 m -92.21 104.53 16.89 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.381 -0.6 . . . . 0.62 109.381 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -80.33 160.93 25.29 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.277 0.56 . . . . 0.75 111.05 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 66.2 p -129.9 -179.38 5.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.382 -0.826 . . . . 0.66000000000000003 109.741 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.37 23.6 7.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.335 -0.393 . . . . 2.3799999999999999 110.519 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.76 101.13 11.91 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.152 -0.476 . . . . 0.84999999999999998 109.784 179.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 11' ' ' VAL . . . . . 0.424 ' HA ' ' HA ' ' B' ' 25' ' ' GLN . 2.2 t -120.43 119.87 61.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.384 -0.526 . . . . 0.93999999999999995 110.861 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 12' ' ' ARG . . . . . 0.507 ' N ' ' O ' ' B' ' 24' ' ' PHE . 0.0 OUTLIER -89.25 113.99 25.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.485 -0.78 . . . . 3.5 110.226 179.505 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -113.26 145.81 40.41 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.118 -0.492 . . . . 2.1299999999999999 109.924 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.21 -178.38 44.4 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 120.717 -0.754 . . . . 1.4399999999999999 111.767 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.07 145.66 32.13 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.39 -0.405 . . . . 1.98 110.125 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -87.19 172.08 10.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.123 -0.49 . . . . 2.1800000000000002 110.16 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.94 -24.85 59.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.201 -0.454 . . . . 2.71 110.417 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 10.0 mmtp -87.25 8.06 25.75 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.63 -0.259 . . . . 4.1600000000000001 111.121 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.6 2.68 76.26 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 111.82 -0.512 . . . . 2.3799999999999999 111.82 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 20' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -82.69 143.83 47.68 Favored Pre-proline 0 C--N 1.333 -0.148 0 CA-C-N 117.252 0.526 . . . . 2.5499999999999998 110.763 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -83.26 140.62 9.85 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 123.065 2.51 . . . . 1.77 112.072 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' TYR . . . . . . . . . . . . . 27.3 p90 -136.24 148.05 47.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.107 0.48 . . . . 1.52 110.75 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 24.1 m -127.85 98.94 5.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.639 -0.71 . . . . 0.96999999999999997 109.995 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' PHE . . . . . 0.507 ' O ' ' N ' ' B' ' 12' ' ' ARG . 29.1 m-85 -98.86 126.63 44.57 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.961 -0.563 . . . . 1.26 109.873 179.381 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 25' ' ' GLN . . . . . 0.424 ' HA ' ' HA ' ' B' ' 11' ' ' VAL . 54.4 tt0 -114.08 143.87 44.06 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.688 0.28 . . . . 0.70999999999999996 110.311 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -81.9 155.19 25.43 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 121.491 0.663 . . . . 1.28 110.67 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -173.64 145.73 8.41 Favored Glycine 0 CA--C 1.523 0.548 0 CA-C-N 115.029 -0.987 . . . . 0.51000000000000001 111.042 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' PHE . . . . . 0.436 ' HB2' ' HB ' ' B' ' 6' ' ' THR . 24.5 m-85 -96.61 137.77 35.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.042 0.448 . . . . 1.21 110.224 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 29' ' ' LEU . . . . . 0.471 ' HB2' ' SG ' ' B' ' 40' ' ' CYS . 0.2 OUTLIER -104.35 142.78 33.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.685 . . . . 0.91000000000000003 111.006 -178.775 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 30' ' ' HIS . . . . . . . . . . . . . 71.8 m-70 -117.23 117.99 31.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.074 -0.512 . . . . 0.72999999999999998 110.159 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' LEU . . . . . 0.7 HD21 ' O ' ' A' ' 59' ' ' ILE . 3.2 mp -113.51 138.97 49.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.077 0.465 . . . . 1.6299999999999999 110.924 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.01 -24.47 67.06 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.688 -0.687 . . . . 3.1899999999999999 111.275 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 33' ' ' ASP . . . . . 0.4 ' OD1' HD23 ' B' ' 31' ' ' LEU . 12.5 p-10 -98.34 11.28 38.54 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.988 -0.551 . . . . 1.5800000000000001 111.686 -178.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 9.2 mmtm -131.48 131.45 22.91 Favored Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 109.923 -0.399 . . . . 1.3999999999999999 109.923 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -73.43 -34.97 5.29 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.44 2.094 . . . . 1.21 112.098 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -112.11 151.83 43.91 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.299 -0.409 . . . . 1.72 110.35 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -78.34 151.55 26.3 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.86 2.373 . . . . 0.93000000000000005 111.584 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 19.9 mt -107.1 139.03 42.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.002 0.429 . . . . 1.3400000000000001 111.281 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 42.1 tt0 -78.09 120.03 22.34 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.071 -0.714 . . . . 1.9199999999999999 109.071 178.945 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 40' ' ' CYS . . . . . 0.748 ' SG ' HG21 ' A' ' 61' ' ' VAL . 2.6 m -134.62 157.63 46.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.823 0.344 . . . . 1.1100000000000001 110.603 -178.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -115.11 146.3 41.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.122 -0.49 . . . . 2.04 109.689 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -124.25 145.6 49.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.221 -0.445 . . . . 0.56999999999999995 111.746 -178.279 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -90.98 75.84 6.29 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.925 -0.768 . . . . 1.0900000000000001 108.925 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 19.1 m -82.65 161.62 3.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.582 -0.736 . . . . 0.84999999999999998 111.835 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -96.55 -36.36 10.78 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 108.479 -0.934 . . . . 2.3999999999999999 108.479 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -126.42 146.66 49.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.121 -0.945 . . . . 1.0 109.465 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 47' ' ' VAL . . . . . . . . . . . . . 93.0 t -66.84 127.76 28.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.933 0.397 . . . . 0.75 110.864 -179.456 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 90.1 mt -98.3 134.11 22.26 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 115.999 -0.546 . . . . 0.53000000000000003 109.924 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -66.65 131.36 25.78 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.322 2.015 . . . . 0.67000000000000004 112.343 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -49.38 128.35 16.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.622 -0.717 . . . . 0.78000000000000003 110.907 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . 162.57 158.5 9.68 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.56 -1.016 . . . . 0.67000000000000004 110.56 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 52' ' ' SER . . . . . 0.441 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 0.3 OUTLIER -81.42 129.96 34.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.923 0.392 . . . . 0.94999999999999996 110.59 -179.847 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 53' ' ' TYR . . . . . 0.466 ' CD2' ' SD ' ' B' ' 75' ' ' MET . 55.9 m-85 -129.23 155.15 46.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.96 -0.564 . . . . 0.70999999999999996 111.283 -179.57 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -107.22 87.34 2.48 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 106.513 -1.662 . . . . 1.8400000000000001 106.513 176.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 16.4 t -83.81 127.21 68.38 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 113.813 1.042 . . . . 0.56999999999999995 113.813 -175.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 56' ' ' PRO . . . . . 0.521 ' HD3' ' HA ' ' B' ' 75' ' ' MET . 41.1 Cg_endo -80.13 112.03 2.75 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.972 2.448 . . . . 0.68000000000000005 110.18 176.507 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 57' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -110.95 165.34 11.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.39 0.614 . . . . 0.68000000000000005 111.914 -178.587 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -142.36 162.93 34.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.897 -1.047 . . . . 2.6699999999999999 108.606 179.098 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' ILE . . . . . 0.71 ' O ' HD21 ' A' ' 31' ' ' LEU . 73.8 mt -100.9 102.41 13.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 120.915 0.388 . . . . 0.80000000000000004 110.381 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -95.81 156.14 16.46 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.3 -0.409 . . . . 2.3399999999999999 110.264 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 61' ' ' VAL . . . . . 0.746 HG21 ' SG ' ' A' ' 40' ' ' CYS . 64.8 t -116.28 112.65 40.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.13 -0.486 . . . . 0.79000000000000004 109.93 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 62' ' ' ASN . . . . . 0.469 ' O ' ' ND2' ' B' ' 63' ' ' ASN . 51.9 t30 -112.93 133.6 54.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.75 -0.659 . . . . 2.04 110.289 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 63' ' ' ASN . . . . . 0.469 ' ND2' ' O ' ' B' ' 62' ' ' ASN . 0.0 OUTLIER 49.05 24.42 0.9 Allowed 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.103 -0.499 . . . . 1.6899999999999999 111.491 179.726 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.07 17.25 58.05 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 116.392 -0.367 . . . . 0.68999999999999995 112.817 178.052 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 65' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -123.78 130.37 24.47 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 117.139 0.47 . . . . 3.52 109.979 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -72.08 120.81 7.06 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.456 2.104 . . . . 0.54000000000000004 111.875 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -134.48 163.6 29.33 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.05 0.452 . . . . 1.8799999999999999 110.841 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 68' ' ' LEU . . . . . 1.075 HD21 HD21 ' A' ' 68' ' ' LEU . 96.1 mt -88.66 138.53 31.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.811 -0.631 . . . . 0.69999999999999996 111.443 -179.158 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -122.29 107.42 12.09 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.584 -0.895 . . . . 0.64000000000000001 108.584 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -88.74 128.24 35.62 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.193 0.521 . . . . 0.51000000000000001 111.269 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' ASP . . . . . 0.43 ' OD1' ' N ' ' B' ' 74' ' ' ALA . 7.2 t0 -94.17 88.97 5.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.444 -0.798 . . . . 0.90000000000000002 110.132 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -69.68 -10.05 56.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.044 -0.526 . . . . 0.66000000000000003 111.481 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 73' ' ' LYS . . . . . 0.485 ' N ' ' CD ' ' B' ' 73' ' ' LYS . 1.1 mptp? -80.07 -20.2 45.76 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 120.482 0.182 . . . . 2.5 111.095 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 74' ' ' ALA . . . . . 0.43 ' N ' ' OD1' ' B' ' 71' ' ' ASP . . . -121.07 15.1 11.53 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 111.919 0.34 . . . . 0.75 111.919 -178.325 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 75' ' ' MET . . . . . 0.521 ' HA ' ' HD3' ' B' ' 56' ' ' PRO . 10.4 ptt? -73.28 144.38 46.65 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 120.164 -0.615 . . . . 0.70999999999999996 109.829 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 30.5 mttp -111.88 127.49 55.85 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.577 -0.738 . . . . 2.7799999999999998 110.544 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 77' ' ' ARG . . . . . 0.446 ' HG3' ' CE2' ' B' ' 53' ' ' TYR . 0.0 OUTLIER -61.76 128.55 36.75 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.247 -0.649 . . . . 3.4100000000000001 109.247 179.435 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.403 -0.808 . . . . 1.49 110.032 -179.655 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.1 mtm . . . . . 0 N--CA 1.493 1.683 0 CA-C-O 120.936 0.398 . . . . 1.09 110.301 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -144.35 165.54 27.62 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.999 -0.546 . . . . 1.62 110.212 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ILE . . . . . 0.475 HD11 HD12 ' A' ' 31' ' ' LEU . 18.1 tt -150.84 145.63 16.63 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.346 0 CA-C-O 120.821 0.343 . . . . 0.58 110.426 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -77.61 126.03 30.26 Favored 'General case' 0 C--N 1.328 -0.35 0 CA-C-N 116.196 -0.456 . . . . 1.07 110.547 -179.833 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 71.2 mt -130.05 116.88 38.8 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.327 0 CA-C-N 116.07 -0.514 . . . . 0.46 110.015 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.448 ' HA ' ' HA ' ' A' ' 52' ' ' SER . 38.7 m -92.16 104.52 16.89 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.368 -0.604 . . . . 0.62 109.368 179.337 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PHE . . . . . . . . . . . . . 40.4 m-85 -80.26 160.89 25.39 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.27 0.557 . . . . 0.75 111.05 -178.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 66.3 p -129.84 -179.34 5.14 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.382 -0.826 . . . . 0.65 109.72 179.333 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.42 23.73 7.3 Favored 'General case' 0 C--N 1.327 -0.4 0 CA-C-N 116.335 -0.393 . . . . 2.38 110.562 -179.691 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.88 101.17 11.93 Favored 'General case' 0 CA--C 1.519 -0.249 0 CA-C-N 116.144 -0.48 . . . . 0.85 109.782 179.543 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.436 ' HA ' ' HA ' ' A' ' 25' ' ' GLN . 2.2 t -120.47 119.78 60.78 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.424 0 CA-C-O 121.162 0.506 . . . . 0.93 110.857 -179.677 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.507 ' N ' ' O ' ' A' ' 24' ' ' PHE . 0.0 OUTLIER -89.28 113.96 25.28 Favored 'General case' 0 C--N 1.328 -0.357 0 CA-C-N 115.526 -0.761 . . . . 3.5 110.215 179.532 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -113.15 145.93 40.11 Favored 'General case' 0 C--N 1.326 -0.428 0 CA-C-N 116.043 -0.526 . . . . 2.14 109.94 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.15 -178.41 44.34 Favored Glycine 0 CA--C 1.523 0.541 0 C-N-CA 120.717 -0.754 . . . . 1.45 111.799 179.871 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.15 145.6 32.34 Favored 'General case' 0 C--N 1.331 -0.236 0 CA-C-O 120.925 0.393 . . . . 1.98 110.098 179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -87.17 172.03 10.22 Favored 'General case' 0 C--N 1.327 -0.411 0 CA-C-N 116.142 -0.481 . . . . 2.18 110.156 179.852 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.94 -24.81 59.55 Favored 'General case' 0 C--N 1.328 -0.364 0 CA-C-N 116.184 -0.462 . . . . 2.71 110.37 179.879 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LYS . . . . . . . . . . . . . 10.0 mmtp -87.28 8.02 26.06 Favored 'General case' 0 N--CA 1.462 0.146 0 CA-C-N 116.553 -0.294 . . . . 4.16 111.097 -179.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.63 2.62 76.25 Favored Glycine 0 CA--C 1.528 0.902 0 N-CA-C 111.799 -0.52 . . . . 2.38 111.799 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -82.54 143.88 48.33 Favored Pre-proline 0 C--N 1.332 -0.164 0 CA-C-N 117.234 0.517 . . . . 2.57 110.804 -179.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PRO . . . . . . . . . . . . . 49.8 Cg_endo -83.28 140.65 9.84 Favored 'Trans proline' 0 C--N 1.344 0.337 0 C-N-CA 123.116 2.544 . . . . 1.78 112.091 179.991 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 27.3 p90 -136.33 148.08 47.74 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-O 121.051 0.453 . . . . 1.52 110.77 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' THR . . . . . . . . . . . . . 24.0 m -127.82 99.01 5.36 Favored 'General case' 0 C--N 1.327 -0.383 0 CA-C-N 115.543 -0.753 . . . . 0.96 110.05 179.872 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' PHE . . . . . 0.507 ' O ' ' N ' ' A' ' 12' ' ' ARG . 29.1 m-85 -98.89 126.62 44.6 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 116.008 -0.542 . . . . 1.26 109.837 179.436 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' GLN . . . . . 0.436 ' HA ' ' HA ' ' A' ' 11' ' ' VAL . 54.3 tt0 -114.13 143.89 44.05 Favored 'General case' 0 C--N 1.323 -0.583 0 CA-C-O 120.679 0.276 . . . . 0.7 110.283 179.974 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 25.6 tt0 -81.83 155.21 25.5 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 121.422 0.629 . . . . 1.26 110.635 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLY . . . . . . . . . . . . . . . -173.65 145.75 8.43 Favored Glycine 0 CA--C 1.522 0.528 0 CA-C-N 115.032 -0.986 . . . . 0.51 111.043 179.649 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.448 ' HB2' ' HB ' ' A' ' 6' ' ' THR . 24.4 m-85 -96.7 137.74 35.32 Favored 'General case' 0 C--N 1.331 -0.235 0 CA-C-O 121.02 0.438 . . . . 1.21 110.191 179.792 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . 0.474 ' HB2' ' SG ' ' A' ' 40' ' ' CYS . 0.2 OUTLIER -104.28 142.82 33.87 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.695 -0.684 . . . . 0.91 111.06 -178.817 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' HIS . . . . . . . . . . . . . 71.9 m-70 -117.24 117.96 30.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.084 -0.507 . . . . 0.73 110.19 179.909 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.71 HD21 ' O ' ' B' ' 59' ' ' ILE . 3.3 mp -113.46 138.91 49.42 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 121.035 0.445 . . . . 1.63 110.908 -179.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.05 -24.46 67.1 Favored 'General case' 0 N--CA 1.465 0.315 0 CA-C-N 115.763 -0.653 . . . . 3.19 111.236 -179.6 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ASP . . . . . . . . . . . . . 12.6 p-10 -98.27 11.14 38.87 Favored 'General case' 0 C--N 1.319 -0.731 0 CA-C-N 116.003 -0.544 . . . . 1.59 111.656 -178.934 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 9.1 mmtm -131.36 131.5 23.03 Favored Pre-proline 0 C--N 1.33 -0.257 0 N-CA-C 110.011 -0.366 . . . . 1.38 110.011 179.671 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' PRO . . . . . . . . . . . . . 46.5 Cg_endo -73.46 -34.98 5.23 Favored 'Trans proline' 0 C--N 1.346 0.397 0 C-N-CA 122.478 2.118 . . . . 1.21 112.07 -179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -112.1 151.82 43.9 Favored Pre-proline 0 C--N 1.329 -0.325 0 CA-C-N 116.263 -0.426 . . . . 1.72 110.316 179.764 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -78.3 151.55 26.44 Favored 'Trans proline' 0 C--N 1.342 0.209 0 C-N-CA 122.853 2.369 . . . . 0.92 111.602 179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' LEU . . . . . . . . . . . . . 19.8 mt -107.07 138.97 42.23 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 120.965 0.412 . . . . 1.34 111.316 -179.177 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 42.1 tt0 -78.08 120.05 22.37 Favored 'General case' 0 C--N 1.33 -0.244 0 N-CA-C 109.096 -0.705 . . . . 1.89 109.096 178.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' CYS . . . . . 0.746 ' SG ' HG21 ' B' ' 61' ' ' VAL . 2.6 m -134.67 157.71 45.95 Favored 'General case' 0 C--N 1.328 -0.349 0 CA-C-O 120.863 0.363 . . . . 1.11 110.626 -178.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -115.09 146.38 41.37 Favored 'General case' 0 C--N 1.33 -0.241 0 CA-C-N 116.127 -0.488 . . . . 2.05 109.706 179.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 53.7 m-85 -124.35 145.57 49.35 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-O 121.021 0.439 . . . . 0.57 111.765 -178.32 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -90.94 75.8 6.33 Favored 'General case' 0 C--N 1.331 -0.197 0 N-CA-C 108.974 -0.75 . . . . 1.1 108.974 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . . . . . . . . . 19.3 m -82.64 161.62 3.46 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.561 0 CA-C-N 115.589 -0.732 . . . . 0.85 111.791 -178.424 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLU . . . . . . . . . . . . . 5.6 mt-10 -96.54 -36.3 10.81 Favored 'General case' 0 C--N 1.33 -0.249 0 N-CA-C 108.479 -0.934 . . . . 2.37 108.479 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -126.42 146.66 49.99 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 115.119 -0.946 . . . . 0.98 109.403 179.271 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' VAL . . . . . . . . . . . . . 94.8 t -66.94 127.79 29.03 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.343 0 CA-C-O 120.956 0.408 . . . . 0.74 110.848 -179.484 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . . . . . . . . . 89.9 mt -98.27 134.09 22.3 Favored Pre-proline 0 C--N 1.332 -0.195 0 CA-C-N 115.943 -0.571 . . . . 0.53 109.967 179.574 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 40.8 Cg_endo -66.61 131.46 26.13 Favored 'Trans proline' 0 C--N 1.344 0.313 0 C-N-CA 122.355 2.037 . . . . 0.66 112.318 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -49.5 128.39 17.28 Favored 'General case' 0 C--N 1.328 -0.363 0 CA-C-N 115.595 -0.729 . . . . 0.78 110.821 -179.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLY . . . . . . . . . . . . . . . 162.56 158.5 9.67 Favored Glycine 0 CA--C 1.526 0.719 0 N-CA-C 110.493 -1.043 . . . . 0.67 110.493 -179.923 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . 0.448 ' HA ' ' HA ' ' A' ' 6' ' ' THR . 0.3 OUTLIER -81.47 129.87 34.82 Favored 'General case' 0 C--N 1.331 -0.211 0 CA-C-O 120.891 0.377 . . . . 0.95 110.647 -179.871 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TYR . . . . . 0.462 ' CE2' ' HG3' ' A' ' 77' ' ' ARG . 55.5 m-85 -129.07 155.02 46.09 Favored 'General case' 0 C--N 1.33 -0.272 0 CA-C-N 115.926 -0.579 . . . . 0.71 111.3 -179.594 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLN . . . . . . . . . . . . . 15.1 mt-30 -107.15 87.75 2.58 Favored 'General case' 0 C--N 1.327 -0.41 0 N-CA-C 106.405 -1.702 . . . . 1.84 106.405 176.452 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' VAL . . . . . . . . . . . . . 16.2 t -84.07 127.21 67.74 Favored Pre-proline 0 C--N 1.319 -0.721 0 N-CA-C 113.714 1.005 . . . . 0.56 113.714 -175.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' PRO . . . . . 0.514 ' HD3' ' HA ' ' A' ' 75' ' ' MET . 41.3 Cg_endo -80.1 112.03 2.76 Favored 'Trans proline' 0 C--N 1.352 0.723 0 C-N-CA 122.973 2.448 . . . . 0.68 110.183 176.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' TYR . . . . . . . . . . . . . 42.4 p90 -110.87 165.34 11.93 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-O 121.37 0.605 . . . . 0.68 111.927 -178.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 12.6 mtt180 -142.27 162.99 34.08 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 114.894 -1.048 . . . . 2.66 108.653 179.031 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ILE . . . . . 0.7 ' O ' HD21 ' B' ' 31' ' ' LEU . 74.1 mt -100.93 102.34 13.32 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.435 0 CA-C-O 120.854 0.359 . . . . 0.8 110.406 -179.915 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -95.73 156.02 16.5 Favored 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.255 -0.43 . . . . 2.33 110.295 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' VAL . . . . . 0.748 HG21 ' SG ' ' B' ' 40' ' ' CYS . 65.2 t -116.18 112.72 40.7 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.452 0 CA-C-N 116.126 -0.488 . . . . 0.78 109.937 179.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ASN . . . . . 0.438 ' O ' ' ND2' ' A' ' 63' ' ' ASN . 51.8 t30 -113.03 133.67 54.87 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.726 -0.67 . . . . 2.04 110.269 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.438 ' ND2' ' O ' ' A' ' 62' ' ' ASN . 0.0 OUTLIER 49.08 24.4 0.91 Allowed 'General case' 0 CA--C 1.538 0.506 0 CA-C-N 116.066 -0.515 . . . . 1.7 111.456 179.683 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.09 17.15 58.21 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 116.382 -0.372 . . . . 0.68 112.822 178.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . . . . . . . . . 7.8 mtp180 -123.8 130.29 24.5 Favored Pre-proline 0 C--N 1.326 -0.433 0 CA-C-N 117.128 0.464 . . . . 3.52 110.001 179.435 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' PRO . . . . . . . . . . . . . 45.1 Cg_endo -71.97 120.91 7.14 Favored 'Trans proline' 0 C--N 1.346 0.443 0 C-N-CA 122.407 2.071 . . . . 0.54 111.906 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' GLU . . . . . . . . . . . . . 30.1 mt-10 -134.5 163.6 29.33 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.032 0.444 . . . . 1.88 110.865 179.826 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LEU . . . . . 1.075 HD21 HD21 ' B' ' 68' ' ' LEU . 96.1 mt -88.62 138.49 31.38 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.856 -0.611 . . . . 0.7 111.481 -179.228 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -122.35 107.4 12.04 Favored 'General case' 0 C--N 1.33 -0.261 0 N-CA-C 108.643 -0.873 . . . . 0.64 108.643 178.3 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -88.77 128.29 35.63 Favored 'General case' 0 C--N 1.326 -0.433 0 CA-C-O 121.242 0.544 . . . . 0.51 111.283 -178.438 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ASP . . . . . 0.425 ' OD1' ' N ' ' A' ' 74' ' ' ALA . 7.6 t0 -94.22 89.0 5.78 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 115.352 -0.84 . . . . 0.88 110.138 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' PHE . . . . . . . . . . . . . 29.1 m-85 -69.79 -9.94 56.53 Favored 'General case' 0 C--N 1.33 -0.252 0 CA-C-N 116.028 -0.533 . . . . 0.66 111.341 -179.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LYS . . . . . 0.481 ' CD ' ' N ' ' A' ' 73' ' ' LYS . 1.1 mptp? -80.01 -20.75 44.66 Favored 'General case' 0 N--CA 1.454 -0.261 0 CA-C-O 120.501 0.191 . . . . 2.5 111.011 -179.672 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' ALA . . . . . 0.425 ' N ' ' OD1' ' A' ' 71' ' ' ASP . . . -120.07 13.98 12.21 Favored 'General case' 0 C--N 1.331 -0.214 0 N-CA-C 112.224 0.453 . . . . 0.74 112.224 -178.209 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' MET . . . . . 0.514 ' HA ' ' HD3' ' A' ' 56' ' ' PRO . 10.6 ptt? -72.84 143.06 47.96 Favored 'General case' 0 C--N 1.327 -0.4 0 C-N-CA 120.316 -0.554 . . . . 0.7 110.09 179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LYS . . . . . . . . . . . . . 31.6 mttp -110.05 128.26 55.32 Favored 'General case' 0 C--N 1.322 -0.608 0 CA-C-N 115.441 -0.8 . . . . 2.78 110.429 -179.001 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ARG . . . . . 0.462 ' HG3' ' CE2' ' A' ' 53' ' ' TYR . 0.0 OUTLIER -62.7 128.96 38.39 Favored 'General case' 0 N--CA 1.455 -0.211 0 N-CA-C 109.446 -0.576 . . . . 3.41 109.446 179.179 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.495 -0.764 . . . . 1.5 110.382 -179.514 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' MET . . . . . . . . . . . . . 57.0 mtm . . . . . 0 N--CA 1.492 1.66 0 CA-C-O 120.994 0.425 . . . . 1.1 110.32 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -144.39 165.62 27.4 Favored 'General case' 0 C--N 1.328 -0.366 0 CA-C-N 115.996 -0.547 . . . . 1.63 110.198 179.775 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' ILE . . . . . 0.468 HD11 HD12 ' B' ' 31' ' ' LEU . 18.1 tt -150.98 145.62 16.54 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-O 120.879 0.371 . . . . 0.58 110.374 179.877 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' GLN . . . . . . . . . . . . . 19.7 tt0 -77.54 126.04 30.28 Favored 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.189 -0.46 . . . . 1.07 110.557 -179.82 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' ILE . . . . . . . . . . . . . 71.2 mt -130.11 116.92 38.77 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.317 0 CA-C-N 116.079 -0.51 . . . . 0.46 110.002 179.905 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.441 ' HA ' ' HA ' ' B' ' 52' ' ' SER . 38.3 m -92.21 104.53 16.89 Favored 'General case' 0 C--N 1.328 -0.342 0 N-CA-C 109.381 -0.6 . . . . 0.62 109.381 179.347 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' PHE . . . . . . . . . . . . . 40.6 m-85 -80.33 160.93 25.29 Favored 'General case' 0 CA--C 1.516 -0.356 0 CA-C-O 121.277 0.56 . . . . 0.75 111.05 -178.895 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' THR . . . . . . . . . . . . . 66.2 p -129.9 -179.38 5.17 Favored 'General case' 0 C--N 1.324 -0.525 0 CA-C-N 115.382 -0.826 . . . . 0.66 109.741 179.379 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' ASP . . . . . . . . . . . . . 0.4 OUTLIER -97.37 23.6 7.39 Favored 'General case' 0 C--N 1.326 -0.43 0 CA-C-N 116.335 -0.393 . . . . 2.38 110.519 -179.627 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -100.76 101.13 11.91 Favored 'General case' 0 CA--C 1.519 -0.231 0 CA-C-N 116.152 -0.476 . . . . 0.85 109.784 179.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' VAL . . . . . 0.424 ' HA ' ' HA ' ' B' ' 25' ' ' GLN . 2.2 t -120.43 119.87 61.08 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.436 0 C-N-CA 120.384 -0.526 . . . . 0.94 110.861 -179.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' ARG . . . . . 0.507 ' N ' ' O ' ' B' ' 24' ' ' PHE . 0.0 OUTLIER -89.25 113.99 25.3 Favored 'General case' 0 C--N 1.327 -0.372 0 CA-C-N 115.485 -0.78 . . . . 3.5 110.226 179.505 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' GLN . . . . . . . . . . . . . 32.2 mt-30 -113.26 145.81 40.41 Favored 'General case' 0 C--N 1.326 -0.443 0 CA-C-N 116.118 -0.492 . . . . 2.13 109.924 -179.949 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' GLY . . . . . . . . . . . . . . . 172.21 -178.38 44.4 Favored Glycine 0 CA--C 1.524 0.595 0 C-N-CA 120.717 -0.754 . . . . 1.44 111.767 179.829 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -107.07 145.66 32.13 Favored 'General case' 0 C--N 1.331 -0.204 0 CA-C-N 115.39 -0.405 . . . . 1.98 110.125 179.93 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 16' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -87.19 172.08 10.18 Favored 'General case' 0 C--N 1.326 -0.424 0 CA-C-N 116.123 -0.49 . . . . 2.18 110.16 179.871 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 17' ' ' ALA . . . . . . . . . . . . . . . -57.94 -24.85 59.7 Favored 'General case' 0 C--N 1.327 -0.377 0 CA-C-N 116.201 -0.454 . . . . 2.71 110.417 179.807 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 18' ' ' LYS . . . . . . . . . . . . . 10.0 mmtp -87.25 8.06 25.75 Favored 'General case' 0 C--O 1.233 0.196 0 CA-C-N 116.63 -0.259 . . . . 4.16 111.121 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' GLY . . . . . . . . . . . . . . . 76.6 2.68 76.26 Favored Glycine 0 CA--C 1.529 0.932 0 N-CA-C 111.82 -0.512 . . . . 2.38 111.82 179.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' ASN . . . . . . . . . . . . . 7.3 m120 -82.69 143.83 47.68 Favored Pre-proline 0 C--N 1.333 -0.148 0 CA-C-N 117.252 0.526 . . . . 2.55 110.763 -179.87 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' PRO . . . . . . . . . . . . . 49.6 Cg_endo -83.26 140.62 9.85 Favored 'Trans proline' 0 C--N 1.345 0.384 0 C-N-CA 123.065 2.51 . . . . 1.77 112.072 -179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' TYR . . . . . . . . . . . . . 27.3 p90 -136.24 148.05 47.87 Favored 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 121.107 0.48 . . . . 1.52 110.75 179.863 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' THR . . . . . . . . . . . . . 24.1 m -127.85 98.94 5.33 Favored 'General case' 0 C--N 1.327 -0.388 0 CA-C-N 115.639 -0.71 . . . . 0.97 109.995 179.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' PHE . . . . . 0.507 ' O ' ' N ' ' B' ' 12' ' ' ARG . 29.1 m-85 -98.86 126.63 44.57 Favored 'General case' 0 C--N 1.316 -0.868 0 CA-C-N 115.961 -0.563 . . . . 1.26 109.873 179.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' GLN . . . . . 0.424 ' HA ' ' HA ' ' B' ' 11' ' ' VAL . 54.4 tt0 -114.08 143.87 44.06 Favored 'General case' 0 C--N 1.322 -0.587 0 CA-C-O 120.688 0.28 . . . . 0.71 110.311 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' GLU . . . . . . . . . . . . . 25.5 tt0 -81.9 155.19 25.43 Favored 'General case' 0 CA--C 1.516 -0.364 0 CA-C-O 121.491 0.663 . . . . 1.28 110.67 -179.911 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' GLY . . . . . . . . . . . . . . . -173.64 145.73 8.41 Favored Glycine 0 CA--C 1.523 0.548 0 CA-C-N 115.029 -0.987 . . . . 0.51 111.042 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' PHE . . . . . 0.436 ' HB2' ' HB ' ' B' ' 6' ' ' THR . 24.5 m-85 -96.61 137.77 35.19 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-O 121.042 0.448 . . . . 1.21 110.224 179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' LEU . . . . . 0.471 ' HB2' ' SG ' ' B' ' 40' ' ' CYS . 0.2 OUTLIER -104.35 142.78 33.95 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 115.694 -0.685 . . . . 0.91 111.006 -178.775 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' HIS . . . . . . . . . . . . . 71.8 m-70 -117.23 117.99 31.06 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.074 -0.512 . . . . 0.73 110.159 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' LEU . . . . . 0.7 HD21 ' O ' ' A' ' 59' ' ' ILE . 3.2 mp -113.51 138.97 49.37 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-O 121.077 0.465 . . . . 1.63 110.924 -179.576 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -62.01 -24.47 67.06 Favored 'General case' 0 N--CA 1.467 0.377 0 CA-C-N 115.688 -0.687 . . . . 3.19 111.275 -179.635 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' ASP . . . . . 0.4 ' OD1' HD23 ' B' ' 31' ' ' LEU . 12.5 p-10 -98.34 11.28 38.54 Favored 'General case' 0 C--N 1.319 -0.746 0 CA-C-N 115.988 -0.551 . . . . 1.58 111.686 -178.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 34' ' ' LYS . . . . . . . . . . . . . 9.2 mmtm -131.48 131.45 22.91 Favored Pre-proline 0 C--N 1.33 -0.268 0 N-CA-C 109.923 -0.399 . . . . 1.4 109.923 179.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 35' ' ' PRO . . . . . . . . . . . . . 46.6 Cg_endo -73.43 -34.97 5.29 Favored 'Trans proline' 0 C--N 1.346 0.426 0 C-N-CA 122.44 2.094 . . . . 1.21 112.098 -179.641 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 36' ' ' HIS . . . . . . . . . . . . . 99.5 m-70 -112.11 151.83 43.91 Favored Pre-proline 0 C--N 1.327 -0.371 0 CA-C-N 116.299 -0.409 . . . . 1.72 110.35 179.738 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 37' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -78.34 151.55 26.3 Favored 'Trans proline' 0 C--N 1.341 0.17 0 C-N-CA 122.86 2.373 . . . . 0.93 111.584 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 38' ' ' LEU . . . . . . . . . . . . . 19.9 mt -107.1 139.03 42.17 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-O 121.002 0.429 . . . . 1.34 111.281 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 39' ' ' GLN . . . . . . . . . . . . . 42.1 tt0 -78.09 120.03 22.34 Favored 'General case' 0 C--N 1.33 -0.243 0 N-CA-C 109.071 -0.714 . . . . 1.92 109.071 178.945 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 40' ' ' CYS . . . . . 0.748 ' SG ' HG21 ' A' ' 61' ' ' VAL . 2.6 m -134.62 157.63 46.12 Favored 'General case' 0 C--N 1.328 -0.369 0 CA-C-O 120.823 0.344 . . . . 1.11 110.603 -178.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 41' ' ' GLN . . . . . . . . . . . . . 28.9 mt-30 -115.11 146.3 41.47 Favored 'General case' 0 C--N 1.33 -0.246 0 CA-C-N 116.122 -0.49 . . . . 2.04 109.689 179.39 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 42' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -124.25 145.6 49.27 Favored 'General case' 0 C--N 1.327 -0.382 0 CA-C-N 116.221 -0.445 . . . . 0.57 111.746 -178.279 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 43' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -90.98 75.84 6.29 Favored 'General case' 0 C--N 1.331 -0.232 0 N-CA-C 108.925 -0.768 . . . . 1.09 108.925 178.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 44' ' ' VAL . . . . . . . . . . . . . 19.1 m -82.65 161.62 3.46 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.539 0 CA-C-N 115.582 -0.736 . . . . 0.85 111.835 -178.497 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 45' ' ' GLU . . . . . . . . . . . . . 5.5 mt-10 -96.55 -36.36 10.78 Favored 'General case' 0 C--N 1.331 -0.235 0 N-CA-C 108.479 -0.934 . . . . 2.4 108.479 178.446 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 46' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -126.42 146.66 49.99 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 115.121 -0.945 . . . . 1.0 109.465 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 47' ' ' VAL . . . . . . . . . . . . . 93.0 t -66.84 127.76 28.87 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.355 0 CA-C-O 120.933 0.397 . . . . 0.75 110.864 -179.456 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 48' ' ' ILE . . . . . . . . . . . . . 90.1 mt -98.3 134.11 22.26 Favored Pre-proline 0 C--N 1.331 -0.215 0 CA-C-N 115.999 -0.546 . . . . 0.53 109.924 179.577 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 49' ' ' PRO . . . . . . . . . . . . . 40.6 Cg_endo -66.65 131.36 25.78 Favored 'Trans proline' 0 C--N 1.344 0.32 0 C-N-CA 122.322 2.015 . . . . 0.67 112.343 179.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 50' ' ' ALA . . . . . . . . . . . . . . . -49.38 128.35 16.89 Favored 'General case' 0 C--N 1.328 -0.358 0 CA-C-N 115.622 -0.717 . . . . 0.78 110.907 -179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 51' ' ' GLY . . . . . . . . . . . . . . . 162.57 158.5 9.68 Favored Glycine 0 CA--C 1.526 0.735 0 N-CA-C 110.56 -1.016 . . . . 0.67 110.56 -179.888 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 52' ' ' SER . . . . . 0.441 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 0.3 OUTLIER -81.42 129.96 34.85 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-O 120.923 0.392 . . . . 0.95 110.59 -179.847 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 53' ' ' TYR . . . . . 0.466 ' CD2' ' SD ' ' B' ' 75' ' ' MET . 55.9 m-85 -129.23 155.15 46.01 Favored 'General case' 0 C--N 1.331 -0.238 0 CA-C-N 115.96 -0.564 . . . . 0.71 111.283 -179.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 54' ' ' GLN . . . . . . . . . . . . . 13.2 mt-30 -107.22 87.34 2.48 Favored 'General case' 0 C--N 1.327 -0.371 0 N-CA-C 106.513 -1.662 . . . . 1.84 106.513 176.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 55' ' ' VAL . . . . . . . . . . . . . 16.4 t -83.81 127.21 68.38 Favored Pre-proline 0 C--N 1.319 -0.733 0 N-CA-C 113.813 1.042 . . . . 0.57 113.813 -175.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 56' ' ' PRO . . . . . 0.521 ' HD3' ' HA ' ' B' ' 75' ' ' MET . 41.1 Cg_endo -80.13 112.03 2.75 Favored 'Trans proline' 0 C--N 1.352 0.751 0 C-N-CA 122.972 2.448 . . . . 0.68 110.18 176.507 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 57' ' ' TYR . . . . . . . . . . . . . 42.2 p90 -110.95 165.34 11.94 Favored 'General case' 0 C--N 1.327 -0.407 0 CA-C-O 121.39 0.614 . . . . 0.68 111.914 -178.587 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 58' ' ' ARG . . . . . . . . . . . . . 12.8 mtt180 -142.36 162.93 34.21 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 114.897 -1.047 . . . . 2.67 108.606 179.098 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' ILE . . . . . 0.71 ' O ' HD21 ' A' ' 31' ' ' LEU . 73.8 mt -100.9 102.41 13.42 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.468 0 CA-C-O 120.915 0.388 . . . . 0.8 110.381 -179.916 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -95.81 156.14 16.46 Favored 'General case' 0 CA--C 1.518 -0.285 0 CA-C-N 116.3 -0.409 . . . . 2.34 110.264 179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' VAL . . . . . 0.746 HG21 ' SG ' ' A' ' 40' ' ' CYS . 64.8 t -116.28 112.65 40.38 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.457 0 CA-C-N 116.13 -0.486 . . . . 0.79 109.93 179.798 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' ASN . . . . . 0.469 ' O ' ' ND2' ' B' ' 63' ' ' ASN . 51.9 t30 -112.93 133.6 54.82 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.75 -0.659 . . . . 2.04 110.289 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' ASN . . . . . 0.469 ' ND2' ' O ' ' B' ' 62' ' ' ASN . 0.0 OUTLIER 49.05 24.42 0.9 Allowed 'General case' 0 CA--C 1.537 0.46 0 CA-C-N 116.103 -0.499 . . . . 1.69 111.491 179.726 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' GLY . . . . . . . . . . . . . . . 88.07 17.25 58.05 Favored Glycine 0 CA--C 1.528 0.859 0 CA-C-N 116.392 -0.367 . . . . 0.69 112.817 178.052 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' ARG . . . . . . . . . . . . . 7.7 mtp180 -123.78 130.37 24.47 Favored Pre-proline 0 C--N 1.326 -0.428 0 CA-C-N 117.139 0.47 . . . . 3.52 109.979 179.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' PRO . . . . . . . . . . . . . 44.5 Cg_endo -72.08 120.81 7.06 Favored 'Trans proline' 0 C--N 1.346 0.422 0 C-N-CA 122.456 2.104 . . . . 0.54 111.875 -179.627 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' GLU . . . . . . . . . . . . . 30.2 mt-10 -134.48 163.6 29.33 Favored 'General case' 0 N--CA 1.462 0.171 0 CA-C-O 121.05 0.452 . . . . 1.88 110.841 179.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' LEU . . . . . 1.075 HD21 HD21 ' A' ' 68' ' ' LEU . 96.1 mt -88.66 138.53 31.34 Favored 'General case' 0 C--N 1.33 -0.248 0 CA-C-N 115.811 -0.631 . . . . 0.7 111.443 -179.158 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' ALA . . . . . . . . . . . . . . . -122.29 107.42 12.09 Favored 'General case' 0 C--N 1.33 -0.267 0 N-CA-C 108.584 -0.895 . . . . 0.64 108.584 178.299 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' PHE . . . . . . . . . . . . . 95.2 m-85 -88.74 128.24 35.62 Favored 'General case' 0 C--N 1.326 -0.445 0 CA-C-O 121.193 0.521 . . . . 0.51 111.269 -178.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' ASP . . . . . 0.43 ' OD1' ' N ' ' B' ' 74' ' ' ALA . 7.2 t0 -94.17 88.97 5.8 Favored 'General case' 0 C--N 1.329 -0.294 0 CA-C-N 115.444 -0.798 . . . . 0.9 110.132 179.976 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 72' ' ' PHE . . . . . . . . . . . . . 29.0 m-85 -69.68 -10.05 56.76 Favored 'General case' 0 C--N 1.33 -0.282 0 CA-C-N 116.044 -0.526 . . . . 0.66 111.481 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 73' ' ' LYS . . . . . 0.485 ' N ' ' CD ' ' B' ' 73' ' ' LYS . 1.1 mptp? -80.07 -20.2 45.76 Favored 'General case' 0 N--CA 1.454 -0.27 0 CA-C-O 120.482 0.182 . . . . 2.5 111.095 -179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 74' ' ' ALA . . . . . 0.43 ' N ' ' OD1' ' B' ' 71' ' ' ASP . . . -121.07 15.1 11.53 Favored 'General case' 0 C--N 1.332 -0.189 0 N-CA-C 111.919 0.34 . . . . 0.75 111.919 -178.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 75' ' ' MET . . . . . 0.521 ' HA ' ' HD3' ' B' ' 56' ' ' PRO . 10.4 ptt? -73.28 144.38 46.65 Favored 'General case' 0 CA--C 1.516 -0.363 0 C-N-CA 120.164 -0.615 . . . . 0.71 109.829 179.492 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 76' ' ' LYS . . . . . . . . . . . . . 30.5 mttp -111.88 127.49 55.85 Favored 'General case' 0 C--N 1.322 -0.621 0 CA-C-N 115.577 -0.738 . . . . 2.78 110.544 -178.886 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 77' ' ' ARG . . . . . 0.446 ' HG3' ' CE2' ' B' ' 53' ' ' TYR . 0.0 OUTLIER -61.76 128.55 36.75 Favored 'General case' 0 N--CA 1.455 -0.196 0 N-CA-C 109.247 -0.649 . . . . 3.41 109.247 179.435 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 78' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.041 0 CA-C-O 118.403 -0.808 . . . . 1.49 110.032 -179.655 . . . . . . . . 0 0 . 1 stop_ save_