data_1e8b_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 1e8b _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' ' ' TYR . . . . . 0.401 ' CD1' ' N ' ' A' ' 1' ' ' TYR . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.804 0.335 . . . . 6.6799999999999997 111.213 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.525 ' O ' ' CG ' ' A' ' 3' ' ' HIS . . . 88.72 172.99 46.76 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.807 -0.711 . . . . 2.2999999999999998 112.506 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . 0.632 ' CD2' ' CG2' ' A' ' 11' ' ' VAL . 1.4 p-80 54.61 160.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.804 0.335 . . . . 3.5699999999999998 110.884 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' CYS . . . . . 0.507 ' N ' ' SG ' ' A' ' 31' ' ' CYS . 5.2 m -141.72 135.51 29.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.21 -0.45 . . . . 1.3500000000000001 110.977 -179.811 -41.974 67.779 66.07 103.848 2.031 103.812 79.668 164.786 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.474 ' HA ' ' HA ' ' A' ' 11' ' ' VAL . 0.4 OUTLIER -91.97 134.25 30.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 2.3399999999999999 111.001 179.93 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' THR . . . . . 0.488 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 11.5 t -148.52 -177.08 5.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.306 -0.406 . . . . 2.23 111.326 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ASP . . . . . 0.449 ' HB2' HG22 ' A' ' 10' ' ' VAL . 1.3 m-20 64.64 -91.52 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.064 -0.516 . . . . 4.1200000000000001 110.893 179.924 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -152.36 30.74 0.54 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 4.8600000000000003 110.721 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 127.16 6.58 5.28 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.809 -0.71 . . . . 1.6699999999999999 112.49 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.569 HG13 ' CZ ' ' A' ' 12' ' ' TYR . 0.5 OUTLIER -88.27 98.28 7.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.804 0.335 . . . . 2.3100000000000001 111.045 -179.984 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' VAL . . . . . 0.632 ' CG2' ' CD2' ' A' ' 3' ' ' HIS . 1.1 p -91.22 126.11 43.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 1.6899999999999999 110.967 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' TYR . . . . . 0.569 ' CZ ' HG13 ' A' ' 10' ' ' VAL . 87.5 m-85 -116.14 112.7 22.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.049 -0.523 . . . . 1.1299999999999999 110.958 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . 0.523 ' HA ' ' CB ' ' A' ' 3' ' ' HIS . 16.3 m -43.26 159.87 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.264 -0.425 . . . . 1.97 110.869 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.465 ' HB ' ' HA ' ' A' ' 32' ' ' LEU . 2.5 m -50.47 173.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 1.97 111.266 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 31' ' ' CYS . . . 39.81 28.2 0.13 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.508 -0.853 . . . . 1.2 111.962 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' MET . . . . . 0.546 ' CE ' ' CB ' ' A' ' 144' ' ' THR . 2.8 ttt -119.13 120.79 38.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.842 0.353 . . . . 1.3700000000000001 111.067 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLN . . . . . 0.518 ' HB2' ' CD2' ' A' ' 115' ' ' LEU . 3.1 mt-30 -93.45 162.9 13.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 1.96 110.927 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.573 ' CH2' HG12 ' A' ' 36' ' ' VAL . 6.4 p90 -170.2 129.31 0.9 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 0.97999999999999998 110.863 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LEU . . . . . . . . . . . . . 3.3 tp -68.27 143.54 55.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.154 -0.475 . . . . 1.9299999999999999 110.999 179.923 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LYS . . . . . 0.45 ' HD2' ' SG ' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -158.18 144.21 17.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 3.7999999999999998 110.918 -179.96 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.03 119.96 19.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 2.6299999999999999 111.146 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.7 tm0? -115.83 48.7 1.18 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 3.48 110.833 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 124.31 -88.23 0.38 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.758 -0.734 . . . . 2.0699999999999998 112.535 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -138.61 29.82 2.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.803 0.335 . . . . 3.0 110.867 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.91 167.25 18.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.237 -0.438 . . . . 3.4500000000000002 110.916 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -84.05 146.93 27.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 3.3399999999999999 110.881 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 36.4 mtp -137.64 144.61 41.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 1.5900000000000001 110.925 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.522 ' CD1' HD23 ' A' ' 115' ' ' LEU . 9.7 tp -92.26 97.46 10.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 2.3500000000000001 110.841 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.527 ' O ' ' CE3' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -105.05 118.12 35.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 1.1100000000000001 110.927 -179.995 -117.355 73.029 -120.365 103.791 2.03 103.788 70.564 -114.568 3 3 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.517 ' OG1' ' CB ' ' A' ' 17' ' ' GLN . 95.2 m -118.44 141.32 48.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.471 . . . . 1.1499999999999999 111.105 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.525 ' O ' ' N ' ' A' ' 15' ' ' GLY . 5.3 t -90.21 140.63 29.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 1.23 110.658 179.786 164.786 79.668 66.07 103.812 2.031 103.848 67.779 -41.974 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . 0.465 ' HA ' ' HB ' ' A' ' 14' ' ' VAL . 1.7 mp -143.18 24.08 1.81 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.243 -0.435 . . . . 2.2799999999999998 110.97 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.55 -51.93 3.42 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.683 -0.77 . . . . 2.0299999999999998 112.574 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -75.03 -10.54 59.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.861 0.363 . . . . 4.6699999999999999 110.971 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.42 157.32 7.15 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.802 -0.713 . . . . 1.4099999999999999 112.537 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' VAL . . . . . 0.573 HG12 ' CH2' ' A' ' 18' ' ' TRP . 19.3 t -74.23 127.13 35.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.833 0.349 . . . . 1.5 111.113 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.3 m -96.01 90.06 5.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 1.8899999999999999 110.851 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' CYS . . . . . 0.466 ' HA ' ' O ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -82.31 139.61 34.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 1.3400000000000001 110.948 -179.989 -114.568 70.564 -120.365 103.788 2.03 103.791 73.029 -117.355 3 3 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.446 ' O ' ' O ' ' A' ' 40' ' ' GLU . 3.3 tt0 -142.59 102.9 4.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.223 -0.444 . . . . 2.71 110.904 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.451 ' O ' ' N ' ' A' ' 42' ' ' ALA . 1.1 tt0 -36.33 158.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 2.7200000000000002 110.879 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 23.2 m -64.89 62.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 3.52 111.148 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . 0.451 ' N ' ' O ' ' A' ' 40' ' ' GLU . . . -85.56 157.51 20.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.172 -0.467 . . . . 3.29 111.126 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' VAL . . . . . 0.448 ' O ' ' O ' ' A' ' 42' ' ' ALA . 3.1 m -47.65 -178.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 6.5899999999999999 111.228 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' A' ' 45' ' ' GLN . 1.6 m -95.74 165.51 12.27 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.19 -0.459 . . . . 5.6500000000000004 110.802 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . 0.568 ' N ' ' CG2' ' A' ' 44' ' ' THR . 1.9 tt0 -63.11 68.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.317 -0.401 . . . . 8.6699999999999999 110.867 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' THR . . . . . 0.518 ' N ' ' O ' ' A' ' 44' ' ' THR . 6.0 p -50.11 167.69 0.05 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.118 -0.492 . . . . 8.2699999999999996 111.248 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' TYR . . . . . 0.574 ' CE1' ' HB2' ' A' ' 96' ' ' PHE . 15.2 p90 -175.7 149.45 0.97 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 8.8000000000000007 110.833 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 57.98 -164.64 7.56 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.724 -0.75 . . . . 10.18 112.542 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLY . . . . . 0.573 ' N ' ' CE2' ' A' ' 96' ' ' PHE . . . 88.81 -176.35 44.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.74 -0.743 . . . . 11.52 112.598 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ASN . . . . . 0.627 ' ND2' ' CZ ' ' A' ' 94' ' ' TYR . 4.1 m-20 -89.68 32.82 0.86 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.714 0.292 . . . . 12.94 110.812 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' SER . . . . . 0.457 ' O ' ' HB2' ' A' ' 54' ' ' GLU . 3.3 t -142.27 12.11 1.96 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.339 -0.391 . . . . 12.24 110.875 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.45 ' HB3' ' O ' ' A' ' 51' ' ' SER . 28.1 t-20 67.41 31.43 6.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.248 -0.433 . . . . 13.09 110.929 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLY . . . . . 0.455 ' HA2' ' HA ' ' A' ' 47' ' ' TYR . . . 60.17 15.53 37.5 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.781 -0.723 . . . . 10.43 112.463 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLU . . . . . 0.61 ' CB ' ' CD ' ' A' ' 55' ' ' PRO . 0.5 OUTLIER -61.96 -174.39 0.08 OUTLIER Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 120.942 0.401 . . . . 12.73 110.876 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PRO . . . . . 0.61 ' CD ' ' CB ' ' A' ' 54' ' ' GLU . 10.3 Cg_exo -72.21 158.23 52.29 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 123.208 2.605 . . . . 11.119999999999999 112.256 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' CYS . . . . . 0.433 ' C ' HG21 ' A' ' 57' ' ' VAL . 0.0 OUTLIER -85.84 -173.94 4.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 10.44 110.948 -179.98 -21.507 -109.806 -52.017 103.826 2.03 103.837 146.586 48.541 3 3 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . 0.487 ' CG2' ' C ' ' A' ' 84' ' ' THR . 1.9 t -154.5 66.99 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.129 -0.487 . . . . 13.289999999999999 111.143 -179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' LEU . . . . . 0.529 ' CB ' ' HA ' ' A' ' 59' ' ' PRO . 0.0 OUTLIER -96.26 178.46 1.4 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 12.01 110.795 179.988 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' PRO . . . . . 0.529 ' HA ' ' CB ' ' A' ' 58' ' ' LEU . 36.2 Cg_exo -60.21 144.41 36.37 Favored 'Cis proline' 0 C--N 1.343 0.239 0 C-N-CA 123.196 -1.585 . . . . 13.609999999999999 112.353 0.001 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' PHE . . . . . 0.564 ' CD2' ' HB3' ' A' ' 83' ' ' SER . 7.5 p90 -137.43 116.34 12.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 13.27 110.878 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' THR . . . . . 0.525 ' CG2' ' HA ' ' A' ' 66' ' ' THR . 4.7 p -80.32 153.16 28.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 15.710000000000001 111.14 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' TYR . . . . . 0.575 ' HB3' ' CE1' ' A' ' 67' ' ' PHE . 6.0 t80 -162.2 128.47 3.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.923 0.392 . . . . 14.6 111.038 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ASN . . . . . 0.472 ' ND2' ' O ' ' A' ' 62' ' ' TYR . 0.3 OUTLIER 76.28 -11.32 1.17 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.044 -0.525 . . . . 17.120000000000001 111.755 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.56 -0.67 7.44 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.642 -0.789 . . . . 17.719999999999999 111.955 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ARG . . . . . 0.614 ' CG ' ' CZ ' ' A' ' 67' ' ' PHE . 0.0 OUTLIER -116.48 151.3 36.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.76 0.314 . . . . 15.81 110.476 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' THR . . . . . 0.525 ' HA ' ' CG2' ' A' ' 61' ' ' THR . 6.7 m -99.34 106.39 18.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.347 -0.388 . . . . 15.92 111.154 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' PHE . . . . . 0.614 ' CZ ' ' CG ' ' A' ' 65' ' ' ARG . 6.5 m-85 -94.3 127.61 40.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 13.220000000000001 110.85 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' TYR . . . . . 0.416 ' C ' HD21 ' A' ' 58' ' ' LEU . 9.6 m-85 -88.19 -23.52 23.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 14.52 110.859 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' SER . . . . . 0.464 ' HA ' HD23 ' A' ' 58' ' ' LEU . 1.4 m -134.85 -162.63 1.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.136 -0.484 . . . . 9.1099999999999994 110.812 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 90.3 m -66.05 154.95 38.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 7.2400000000000002 110.988 179.91 -66.711 -124.621 -93.274 103.844 2.029 103.798 -177.659 -18.597 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.505 ' O ' ' CD1' ' A' ' 81' ' ' TRP . 4.9 t -156.67 147.09 21.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.262 -0.426 . . . . 9.4700000000000006 111.133 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' THR . . . . . 0.523 ' CG2' ' HG ' ' A' ' 80' ' ' LEU . 1.2 p -84.74 9.43 14.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 9.6099999999999994 111.148 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' GLU . . . . . 0.539 ' HG3' ' CZ ' ' A' ' 67' ' ' PHE . 20.1 mm-40 -47.48 113.4 0.69 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.291 -0.413 . . . . 12.09 110.899 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 78.08 -5.4 54.46 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.754 -0.736 . . . . 11.85 112.488 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ARG . . . . . 0.569 ' HD3' ' CD1' ' A' ' 81' ' ' TRP . 0.0 OUTLIER -75.0 120.63 20.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.803 0.335 . . . . 10.69 110.92 -179.948 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -113.49 13.52 18.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 13.0 110.899 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' ASP . . . . . 0.436 ' OD2' ' HG3' ' A' ' 75' ' ' ARG . 0.0 OUTLIER -105.37 -12.53 15.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 9.8100000000000005 110.864 -179.938 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.31 -57.62 0.42 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.746 -0.74 . . . . 8.6799999999999997 112.504 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' HIS . . . . . 0.572 ' CG ' ' OH ' ' A' ' 47' ' ' TYR . 1.5 m170 -61.88 177.82 0.4 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.832 0.349 . . . . 8.0399999999999991 110.862 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' LEU . . . . . 0.525 ' CD2' ' HB3' ' A' ' 100' ' ' HIS . 2.6 mp -105.0 -173.14 2.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 6.9400000000000004 110.959 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' TRP . . . . . 0.569 ' CD1' ' HD3' ' A' ' 75' ' ' ARG . 53.0 p-90 -158.99 153.65 24.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.164 -0.471 . . . . 11.949999999999999 110.848 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' CYS . . . . . 0.449 ' SG ' HG23 ' A' ' 46' ' ' THR . 6.4 p -140.3 142.84 35.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.195 -0.457 . . . . 9.4399999999999995 110.931 179.943 48.541 146.586 -52.017 103.837 2.03 103.826 -109.806 -21.507 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' SER . . . . . 0.564 ' HB3' ' CD2' ' A' ' 60' ' ' PHE . 24.6 p -61.2 130.77 47.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.132 -0.486 . . . . 12.300000000000001 110.875 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' THR . . . . . 0.517 ' O ' ' CG2' ' A' ' 85' ' ' THR . 2.4 p -95.53 30.15 2.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 12.619999999999999 111.129 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' THR . . . . . 0.517 ' CG2' ' O ' ' A' ' 84' ' ' THR . 1.4 p -172.88 131.93 0.53 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 14.640000000000001 111.17 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' SER . . . . . 0.42 ' C ' ' O ' ' A' ' 85' ' ' THR . 3.6 t -36.33 -52.57 0.82 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 16.239999999999998 110.797 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ASN . . . . . 0.523 ' HB2' ' CB ' ' A' ' 90' ' ' GLN . 0.8 OUTLIER -94.24 75.84 3.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 17.800000000000001 110.765 179.905 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' TYR . . . . . 0.525 ' O ' ' N ' ' A' ' 92' ' ' GLN . 18.0 t80 -45.09 -74.33 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.083 -0.508 . . . . 15.25 111.079 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -44.86 -24.69 0.23 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.24 -0.436 . . . . 18.0 111.275 -179.72 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' GLN . . . . . 0.523 ' CB ' ' HB2' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -69.38 -62.51 1.35 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.352 -0.385 . . . . 19.899999999999999 111.251 -179.837 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' ASP . . . . . 0.518 ' CB ' ' HG2' ' A' ' 93' ' ' LYS . 31.7 m-20 -95.87 3.6 53.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.336 -0.393 . . . . 16.73 111.354 -179.711 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' GLN . . . . . 0.525 ' N ' ' O ' ' A' ' 88' ' ' TYR . 0.6 OUTLIER 41.04 37.95 0.63 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.364 -0.38 . . . . 16.02 110.911 -179.973 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' LYS . . . . . 0.518 ' HG2' ' CB ' ' A' ' 91' ' ' ASP . 33.0 mmtt -97.0 152.09 19.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.284 -0.416 . . . . 15.09 110.868 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.627 ' CZ ' ' ND2' ' A' ' 50' ' ' ASN . 3.8 p90 -165.07 -178.01 4.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.269 -0.423 . . . . 12.42 111.07 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' SER . . . . . 0.431 ' O ' ' HA ' ' A' ' 81' ' ' TRP . 20.6 m -165.0 136.65 4.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.069 -0.514 . . . . 9.7100000000000009 110.832 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' PHE . . . . . 0.574 ' HB2' ' CE1' ' A' ' 47' ' ' TYR . 0.7 OUTLIER -74.84 146.38 42.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.317 -0.401 . . . . 10.34 110.95 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' CYS . . . . . 0.528 ' HB3' ' CG2' ' A' ' 44' ' ' THR . 0.0 OUTLIER -124.09 177.23 5.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 6.2599999999999998 110.891 -179.995 -18.597 -177.659 -93.274 103.798 2.029 103.844 -124.621 -66.711 3 3 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' THR . . . . . 0.44 ' O ' ' C ' ' A' ' 99' ' ' ASP . 0.2 OUTLIER -106.32 121.52 44.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 5.8600000000000003 111.122 179.903 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ASP . . . . . 0.47 ' C ' ' CD2' ' A' ' 100' ' ' HIS . 6.8 p-10 33.0 39.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.052 -0.522 . . . . 6.8099999999999996 111.014 -179.797 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' HIS . . . . . 0.572 ' NE2' ' CG2' ' A' ' 102' ' ' VAL . 7.0 p80 33.54 43.96 0.06 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.62 -0.718 . . . . 7.29 111.087 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' THR . . . . . 0.523 ' O ' ' CD1' ' A' ' 103' ' ' LEU . 4.3 t 28.64 47.93 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.859 -0.61 . . . . 4.2000000000000002 111.672 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' VAL . . . . . 0.572 ' CG2' ' NE2' ' A' ' 100' ' ' HIS . 4.8 t -38.88 149.22 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.146 -0.479 . . . . 3.2799999999999998 111.296 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' LEU . . . . . 0.523 ' CD1' ' O ' ' A' ' 101' ' ' THR . 0.2 OUTLIER -152.27 109.06 3.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.108 -0.496 . . . . 2.5 110.835 179.946 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' VAL . . . . . 0.521 ' O ' ' N ' ' A' ' 116' ' ' CYS . 14.6 t -101.84 132.81 47.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.431 . . . . 1.3700000000000001 110.848 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -101.63 81.56 2.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.178 -0.464 . . . . 3.1600000000000001 110.758 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' THR . . . . . 0.528 ' CG2' ' HB2' ' A' ' 116' ' ' CYS . 2.5 p -84.94 169.89 13.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 1.4199999999999999 111.334 -179.729 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' ARG . . . . . 0.466 ' HA ' ' HA3' ' A' ' 113' ' ' GLY . 11.5 ptt180 -165.09 129.31 2.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.976 -0.556 . . . . 4.3600000000000003 110.921 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' GLY . . . . . 0.535 ' HA2' ' CD2' ' A' ' 156' ' ' PHE . . . 115.04 173.29 17.71 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.74 -0.743 . . . . 2.0 112.493 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLY . . . . . 0.631 ' CA ' ' CZ ' ' A' ' 154' ' ' PHE . . . 82.5 -95.31 1.77 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.753 -0.737 . . . . 2.4199999999999999 112.492 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 73.1 m-80 -148.24 16.52 1.05 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.849 0.357 . . . . 1.8100000000000001 110.916 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' SER . . . . . 0.519 ' CB ' HG22 ' A' ' 144' ' ' THR . 5.1 p -113.72 -13.59 12.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 1.8999999999999999 110.854 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 43.3 m-20 44.31 89.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 1.6599999999999999 110.739 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLY . . . . . 0.466 ' HA3' ' O ' ' A' ' 106' ' ' THR . . . 41.89 73.09 0.23 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.707 -0.759 . . . . 1.0700000000000001 112.305 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' ALA . . . . . 0.513 ' CB ' HG23 ' A' ' 144' ' ' THR . . . -118.43 141.95 48.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.89 0.376 . . . . 1.1399999999999999 111.291 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.522 HD23 ' CD1' ' A' ' 28' ' ' LEU . 24.6 tp -64.89 84.31 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.11 -0.495 . . . . 2.0699999999999998 110.549 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' CYS . . . . . 0.528 ' HB2' ' CG2' ' A' ' 106' ' ' THR . 0.5 OUTLIER -42.41 131.82 3.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.21 -0.45 . . . . 1.0600000000000001 110.867 -179.805 -141.024 -162.461 151.048 103.779 2.03 103.89 74.372 45.788 3 3 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' HIS . . . . . 0.488 ' CD2' ' O ' ' A' ' 119' ' ' PRO . 33.0 t60 -98.18 135.16 40.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.936 -0.575 . . . . 1.5 110.819 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' PHE . . . . . 0.551 ' CZ ' ' SG ' ' A' ' 142' ' ' CYS . 42.5 m-85 -129.23 135.46 27.63 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 1.3 110.859 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' PRO . . . . . 0.488 ' O ' ' CD2' ' A' ' 117' ' ' HIS . 7.7 Cg_exo -73.93 178.08 34.96 Favored 'Cis proline' 0 N--CA 1.463 -0.282 0 C-N-CA 123.277 -1.551 . . . . 1.4199999999999999 112.115 -0.037 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' PHE . . . . . 0.454 ' O ' ' HB2' ' A' ' 127' ' ' TYR . 31.4 p90 -144.82 125.67 14.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 1.05 110.583 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' LEU . . . . . 0.582 ' CD2' ' N ' ' A' ' 126' ' ' ASN . 2.5 tm? -75.67 132.72 40.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.069 0.461 . . . . 2.1899999999999999 111.382 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' TYR . . . . . 0.524 ' CD1' ' HB2' ' A' ' 123' ' ' ASN . 2.2 t80 -128.48 115.23 17.84 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.56 -0.745 . . . . 2.0600000000000001 109.838 179.042 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ASN . . . . . 0.524 ' HB2' ' CD1' ' A' ' 122' ' ' TYR . 1.7 t-20 53.9 56.38 7.2 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.814 -0.439 . . . . 2.3500000000000001 109.814 -179.045 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ASN . . . . . 0.523 ' O ' ' C8 ' ' A' ' 161' ' ' NAG . 10.5 p30 48.48 24.99 0.83 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.772 -0.649 . . . . 2.71 110.64 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' HIS . . . . . 0.541 ' N ' HD23 ' A' ' 121' ' ' LEU . 5.3 t-160 -124.58 84.44 2.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.685 -0.689 . . . . 1.8500000000000001 109.968 179.078 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 126' ' ' ASN . . . . . 0.582 ' N ' ' CD2' ' A' ' 121' ' ' LEU . 11.7 m-80 -34.88 142.67 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.108 -0.497 . . . . 1.6299999999999999 111.191 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 127' ' ' TYR . . . . . 0.462 ' O ' ' HB3' ' A' ' 119' ' ' PRO . 3.0 m-85 -140.57 156.98 46.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 1.5 110.735 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 128' ' ' THR . . . . . 0.481 HG21 ' CB ' ' A' ' 119' ' ' PRO . 0.2 OUTLIER -148.91 60.06 1.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.271 -0.422 . . . . 1.9199999999999999 111.19 -179.97 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 129' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 131' ' ' THR . 1.1 p30 166.95 139.53 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.933 -0.576 . . . . 2.5 110.774 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 130' ' ' CYS . . . . . 0.461 ' HA ' ' O ' ' A' ' 141' ' ' TRP . 4.6 m -49.14 86.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.023 -0.535 . . . . 1.3100000000000001 110.897 -179.776 -41.363 -112.744 -86.108 103.82 2.03 103.715 -179.719 -79.969 2 2 . 1 . 001 nuclear orig full ' A' A ' 131' ' ' THR . . . . . 0.52 ' N ' ' O ' ' A' ' 129' ' ' ASP . 5.1 t -74.91 152.64 38.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.121 -0.491 . . . . 1.23 111.09 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 2.7 m -109.75 53.83 0.68 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.17 -0.468 . . . . 2.1499999999999999 110.899 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -86.09 113.89 22.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 2.3199999999999998 110.938 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 96.82 -7.96 65.43 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.722 -0.752 . . . . 2.54 112.516 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 24.6 mtp85 -111.84 140.76 46.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.873 0.368 . . . . 2.6499999999999999 110.894 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 33.3 mtt180 -119.88 13.02 12.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 5.2699999999999996 110.902 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 137' ' ' ASP . . . . . 0.505 ' O ' ' N ' ' A' ' 139' ' ' MET . 0.3 OUTLIER -123.66 130.22 52.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.24 -0.436 . . . . 1.97 110.929 -179.994 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -41.07 91.16 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 3.1699999999999999 110.842 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 139' ' ' MET . . . . . 0.505 ' N ' ' O ' ' A' ' 137' ' ' ASP . 5.6 ttm -164.46 54.16 0.14 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 2.5499999999999998 110.914 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 140' ' ' LYS . . . . . 0.443 ' HB2' ' HB2' ' A' ' 130' ' ' CYS . 0.0 OUTLIER -36.36 142.6 0.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 3.02 110.907 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 141' ' ' TRP . . . . . 0.498 ' CE3' ' HB2' ' A' ' 154' ' ' PHE . 51.8 p-90 -143.83 164.19 31.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.435 . . . . 1.1799999999999999 110.867 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 142' ' ' CYS . . . . . 0.551 ' SG ' ' CZ ' ' A' ' 118' ' ' PHE . 4.3 p -143.85 -179.59 6.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.277 -0.42 . . . . 1.23 111.008 -179.9 45.788 74.372 151.048 103.89 2.03 103.779 -162.461 -141.024 2 2 . 1 . 001 nuclear orig full ' A' A ' 143' ' ' GLY . . . . . 0.466 ' HA2' ' HB2' ' A' ' 148' ' ' TYR . . . -88.14 137.68 14.57 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.791 -0.718 . . . . 0.97999999999999998 112.511 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 144' ' ' THR . . . . . 0.546 ' CB ' ' CE ' ' A' ' 16' ' ' MET . 10.3 p -75.09 0.15 17.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.712 0.291 . . . . 1.8600000000000001 111.194 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 145' ' ' THR . . . . . 0.415 HG21 ' C ' ' A' ' 144' ' ' THR . 6.4 p -149.69 174.29 12.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.296 -0.411 . . . . 1.21 111.089 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 146' ' ' GLN . . . . . 0.516 ' HG3' ' ND2' ' A' ' 147' ' ' ASN . 1.8 pt20 -63.74 -11.12 23.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.266 -0.424 . . . . 2.9500000000000002 111.024 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 147' ' ' ASN . . . . . 0.531 ' CB ' ' HB3' ' A' ' 150' ' ' ALA . 72.3 m-20 -146.99 77.66 1.46 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 2.4700000000000002 110.686 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 148' ' ' TYR . . . . . 0.568 ' CE1' ' HB3' ' A' ' 154' ' ' PHE . 2.8 t80 -50.76 -60.44 3.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.067 -0.515 . . . . 1.1200000000000001 111.083 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 149' ' ' ASP . . . . . . . . . . . . . 21.8 t70 -57.59 -15.98 8.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.331 -0.395 . . . . 1.75 110.922 -179.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 150' ' ' ALA . . . . . 0.531 ' HB3' ' CB ' ' A' ' 147' ' ' ASN . . . -85.5 -24.12 27.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.15 -0.477 . . . . 1.4299999999999999 110.934 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -114.43 -16.28 11.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.141 -0.481 . . . . 1.8400000000000001 110.945 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 152' ' ' GLN . . . . . 0.495 ' N ' ' O ' ' A' ' 148' ' ' TYR . 0.2 OUTLIER 62.78 48.71 4.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.14 -0.482 . . . . 1.9099999999999999 110.995 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 153' ' ' LYS . . . . . 0.522 ' HE2' ' CB ' ' A' ' 13' ' ' SER . 13.5 mtpp -142.71 113.63 7.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 2.6299999999999999 110.889 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 154' ' ' PHE . . . . . 0.631 ' CZ ' ' CA ' ' A' ' 109' ' ' GLY . 28.3 p90 -119.75 169.94 9.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.209 -0.45 . . . . 1.1100000000000001 110.915 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 155' ' ' GLY . . . . . 0.465 ' HA3' ' O ' ' A' ' 108' ' ' GLY . . . -156.53 148.21 17.78 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.76 -0.733 . . . . 1.1899999999999999 112.468 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 156' ' ' PHE . . . . . 0.535 ' CD2' ' HA2' ' A' ' 108' ' ' GLY . 34.8 m-85 -75.01 143.09 43.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.767 0.317 . . . . 1.3100000000000001 110.737 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 157' ' ' CYS . . . . . 0.456 ' HB3' ' HD2' ' A' ' 158' ' ' PRO . 22.2 m -89.84 166.9 18.72 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 1.6000000000000001 110.99 -179.83 -79.969 -179.719 -86.108 103.715 2.03 103.82 -112.744 -41.363 2 2 . 1 . 001 nuclear orig full ' A' A ' 158' ' ' PRO . . . . . 0.456 ' HD2' ' HB3' ' A' ' 157' ' ' CYS . 50.4 Cg_exo -53.73 -176.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.707 2.271 . . . . 1.5700000000000001 112.34 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 159' ' ' MET . . . . . 0.518 ' CE ' ' O ' ' A' ' 159' ' ' MET . 0.0 OUTLIER -72.25 -27.42 62.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 4.9400000000000004 110.867 -179.981 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 160' ' ' ALA . . . . . 0.504 ' N ' ' HG3' ' A' ' 159' ' ' MET . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.321 -0.847 . . . . 4.9500000000000002 111.172 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 161' ' ' NAG . . . . . 0.523 ' C8 ' ' O ' ' A' ' 124' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.804 0.335 . . . . 6.3700000000000001 111.213 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.525 ' O ' ' CG ' ' A' ' 3' ' ' HIS . . . 88.72 172.99 46.76 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.807 -0.711 . . . . 2.2999999999999998 112.506 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . 0.531 ' CB ' ' HA ' ' A' ' 13' ' ' SER . 0.6 OUTLIER 54.61 160.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.804 0.335 . . . . 2.8300000000000001 110.884 -179.942 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' CYS . . . . . 0.507 ' N ' ' SG ' ' A' ' 31' ' ' CYS . 5.2 m -141.72 135.51 29.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.21 -0.45 . . . . 0.98999999999999999 110.977 -179.811 -41.974 67.779 66.07 103.848 2.031 103.812 79.668 164.786 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.507 ' HA ' ' HA ' ' A' ' 11' ' ' VAL . 0.4 OUTLIER -91.97 134.25 30.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 1.74 111.001 179.93 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' THR . . . . . 0.716 HG21 ' CZ2' ' A' ' 18' ' ' TRP . 11.5 t -148.52 -177.08 5.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.306 -0.406 . . . . 1.8400000000000001 111.326 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 64.64 -91.52 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.064 -0.516 . . . . 4.1200000000000001 110.893 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -152.36 30.74 0.54 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 4.5099999999999998 110.721 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 127.16 6.58 5.28 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.809 -0.71 . . . . 1.4399999999999999 112.49 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.667 HG11 ' OH ' ' A' ' 12' ' ' TYR . 0.5 OUTLIER -88.27 98.28 7.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.804 0.335 . . . . 1.6399999999999999 111.045 -179.984 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 11' ' ' VAL . . . . . 0.507 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 1.1 p -91.22 126.11 43.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 1.0700000000000001 110.967 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' TYR . . . . . 0.667 ' OH ' HG11 ' A' ' 10' ' ' VAL . 87.5 m-85 -116.14 112.7 22.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.049 -0.523 . . . . 0.82999999999999996 110.958 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . 0.531 ' HA ' ' CB ' ' A' ' 3' ' ' HIS . 16.3 m -43.26 159.87 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.264 -0.425 . . . . 1.52 110.869 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.479 ' HB ' ' HA ' ' A' ' 32' ' ' LEU . 2.5 m -50.47 173.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 1.4099999999999999 111.266 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 31' ' ' CYS . . . 39.81 28.2 0.13 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.508 -0.853 . . . . 0.73999999999999999 111.962 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' MET . . . . . 0.999 ' C ' HG23 ' A' ' 30' ' ' THR . 2.8 ttt -119.13 120.79 38.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.842 0.353 . . . . 0.95999999999999996 111.067 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLN . . . . . 1.03 ' HB2' HD23 ' A' ' 115' ' ' LEU . 3.1 mt-30 -93.45 162.9 13.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 1.6100000000000001 110.927 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.716 ' CZ2' HG21 ' A' ' 6' ' ' THR . 6.4 p90 -170.2 129.31 0.9 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 0.63 110.863 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LEU . . . . . 0.505 HD12 ' HA ' ' A' ' 19' ' ' LEU . 3.3 tp -68.27 143.54 55.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.154 -0.475 . . . . 1.4199999999999999 110.999 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LYS . . . . . 0.454 ' HD2' ' SG ' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -158.18 144.21 17.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 3.3100000000000001 110.918 -179.96 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.03 119.96 19.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 2.3399999999999999 111.146 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.7 tm0? -115.83 48.7 1.18 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 3.1299999999999999 110.833 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 124.31 -88.23 0.38 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.758 -0.734 . . . . 1.9199999999999999 112.535 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -138.61 29.82 2.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.803 0.335 . . . . 2.7400000000000002 110.867 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.91 167.25 18.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.237 -0.438 . . . . 3.0699999999999998 110.916 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -84.05 146.93 27.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 2.8399999999999999 110.881 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 36.4 mtp -137.64 144.61 41.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 1.45 110.925 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.855 HD11 ' CD2' ' A' ' 115' ' ' LEU . 9.7 tp -92.26 97.46 10.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 1.73 110.841 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.527 ' O ' ' CE3' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -105.05 118.12 35.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.90000000000000002 110.927 -179.995 -117.355 73.029 -120.365 103.791 2.03 103.788 70.564 -114.568 3 3 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.999 HG23 ' C ' ' A' ' 16' ' ' MET . 95.2 m -118.44 141.32 48.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.471 . . . . 0.57999999999999996 111.105 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.525 ' O ' ' N ' ' A' ' 15' ' ' GLY . 5.3 t -90.21 140.63 29.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 1.0900000000000001 110.658 179.786 164.786 79.668 66.07 103.812 2.031 103.848 67.779 -41.974 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.479 ' HA ' ' HB ' ' A' ' 14' ' ' VAL . 1.7 mp -143.18 24.08 1.81 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.243 -0.435 . . . . 1.6200000000000001 110.97 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.55 -51.93 3.42 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.683 -0.77 . . . . 2.0299999999999998 112.574 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -75.03 -10.54 59.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.861 0.363 . . . . 4.4500000000000002 110.971 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.42 157.32 7.15 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.802 -0.713 . . . . 1.3799999999999999 112.537 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' VAL . . . . . 0.551 HG13 ' CH2' ' A' ' 18' ' ' TRP . 19.3 t -74.23 127.13 35.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.833 0.349 . . . . 0.84999999999999998 111.113 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.3 m -96.01 90.06 5.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 1.72 110.851 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' CYS . . . . . 0.478 ' HA ' ' O ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -82.31 139.61 34.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 1.0800000000000001 110.948 -179.989 -114.568 70.564 -120.365 103.788 2.03 103.791 73.029 -117.355 3 3 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.446 ' O ' ' O ' ' A' ' 40' ' ' GLU . 3.3 tt0 -142.59 102.9 4.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.223 -0.444 . . . . 2.25 110.904 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.51 ' O ' ' N ' ' A' ' 42' ' ' ALA . 1.1 tt0 -36.33 158.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 2.7200000000000002 110.879 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 23.2 m -64.89 62.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 3.0600000000000001 111.148 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.51 ' N ' ' O ' ' A' ' 40' ' ' GLU . . . -85.56 157.51 20.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.172 -0.467 . . . . 3.2400000000000002 111.126 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' VAL . . . . . 0.448 ' O ' ' O ' ' A' ' 42' ' ' ALA . 3.1 m -47.65 -178.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 6.2400000000000002 111.228 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' A' ' 45' ' ' GLN . 1.6 m -95.74 165.51 12.27 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.19 -0.459 . . . . 5.6500000000000004 110.802 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . 0.568 ' N ' ' CG2' ' A' ' 44' ' ' THR . 1.9 tt0 -63.11 68.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.317 -0.401 . . . . 8.2899999999999991 110.867 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' THR . . . . . 0.518 ' N ' ' O ' ' A' ' 44' ' ' THR . 6.0 p -50.11 167.69 0.05 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.118 -0.492 . . . . 7.96 111.248 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' TYR . . . . . 0.606 ' HH ' ' CG ' ' A' ' 79' ' ' HIS . 15.2 p90 -175.7 149.45 0.97 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 8.6199999999999992 110.833 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 57.98 -164.64 7.56 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.724 -0.75 . . . . 9.7799999999999994 112.542 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLY . . . . . 0.58 ' HA2' ' CZ ' ' A' ' 96' ' ' PHE . . . 88.81 -176.35 44.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.74 -0.743 . . . . 11.52 112.598 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ASN . . . . . 0.477 ' OD1' ' CZ ' ' A' ' 94' ' ' TYR . 2.0 m120 -89.68 32.82 0.86 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.714 0.292 . . . . 12.93 110.812 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' SER . . . . . 0.623 ' CB ' HG21 ' A' ' 84' ' ' THR . 3.3 t -142.27 12.11 1.96 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.339 -0.391 . . . . 11.710000000000001 110.875 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.458 ' HB3' ' O ' ' A' ' 51' ' ' SER . 28.1 t-20 67.41 31.43 6.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.248 -0.433 . . . . 12.890000000000001 110.929 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLY . . . . . 0.479 ' HA3' ' HA ' ' A' ' 47' ' ' TYR . . . 60.17 15.53 37.5 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.781 -0.723 . . . . 10.42 112.463 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLU . . . . . 0.61 ' CB ' ' CD ' ' A' ' 55' ' ' PRO . 0.5 OUTLIER -61.96 -174.39 0.08 OUTLIER Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 120.942 0.401 . . . . 12.73 110.876 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PRO . . . . . 0.61 ' CD ' ' CB ' ' A' ' 54' ' ' GLU . 10.3 Cg_exo -72.21 158.23 52.29 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 123.208 2.605 . . . . 10.550000000000001 112.256 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' CYS . . . . . 0.421 ' HB3' ' HB2' ' A' ' 82' ' ' CYS . 0.0 OUTLIER -85.84 -173.94 4.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 10.44 110.948 -179.98 -21.507 -109.806 -52.017 103.826 2.03 103.837 146.586 48.541 3 3 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.566 HG23 ' C ' ' A' ' 84' ' ' THR . 1.9 t -154.5 66.99 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.129 -0.487 . . . . 12.890000000000001 111.143 -179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' LEU . . . . . 0.646 HD23 ' CD1' ' A' ' 60' ' ' PHE . 0.0 OUTLIER -96.26 178.46 1.4 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 12.01 110.795 179.988 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 59' ' ' PRO . . . . . 0.588 ' HA ' ' CB ' ' A' ' 58' ' ' LEU . 36.2 Cg_exo -60.21 144.41 36.37 Favored 'Cis proline' 0 C--N 1.343 0.239 0 C-N-CA 123.196 -1.585 . . . . 13.210000000000001 112.353 0.001 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' PHE . . . . . 0.646 ' CD1' HD23 ' A' ' 58' ' ' LEU . 7.5 p90 -137.43 116.34 12.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 12.869999999999999 110.878 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' THR . . . . . 0.77 HG22 ' HA ' ' A' ' 66' ' ' THR . 4.7 p -80.32 153.16 28.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 15.6 111.14 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' TYR . . . . . 0.582 ' HB3' ' CE1' ' A' ' 67' ' ' PHE . 6.0 t80 -162.2 128.47 3.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.923 0.392 . . . . 14.58 111.038 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ASN . . . . . 0.574 ' ND2' ' C ' ' A' ' 63' ' ' ASN . 0.0 OUTLIER 76.28 -11.32 1.17 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.044 -0.525 . . . . 17.120000000000001 111.755 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.56 -0.67 7.44 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.642 -0.789 . . . . 17.27 111.955 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ARG . . . . . 0.631 ' HG3' ' CE1' ' A' ' 67' ' ' PHE . 0.0 OUTLIER -116.48 151.3 36.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.76 0.314 . . . . 15.75 110.476 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 66' ' ' THR . . . . . 0.77 ' HA ' HG22 ' A' ' 61' ' ' THR . 6.7 m -99.34 106.39 18.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.347 -0.388 . . . . 15.66 111.154 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' PHE . . . . . 0.631 ' CE1' ' HG3' ' A' ' 65' ' ' ARG . 6.5 m-85 -94.3 127.61 40.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 12.59 110.85 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' TYR . . . . . 0.606 ' O ' HD13 ' A' ' 58' ' ' LEU . 9.6 m-85 -88.19 -23.52 23.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 14.33 110.859 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' SER . . . . . 0.457 ' CA ' HD22 ' A' ' 58' ' ' LEU . 1.4 m -134.85 -162.63 1.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.136 -0.484 . . . . 8.8000000000000007 110.812 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 90.3 m -66.05 154.95 38.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 7.2400000000000002 110.988 179.91 -66.711 -124.621 -93.274 103.844 2.029 103.798 -177.659 -18.597 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.784 ' CA ' HD23 ' A' ' 80' ' ' LEU . 4.9 t -156.67 147.09 21.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.262 -0.426 . . . . 9.2599999999999998 111.133 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' THR . . . . . 1.048 HG23 ' HG ' ' A' ' 80' ' ' LEU . 1.2 p -84.74 9.43 14.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 9.6099999999999994 111.148 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' GLU . . . . . 0.559 ' HG3' ' CZ ' ' A' ' 67' ' ' PHE . 20.1 mm-40 -47.48 113.4 0.69 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.291 -0.413 . . . . 11.99 110.899 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 78.08 -5.4 54.46 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.754 -0.736 . . . . 11.369999999999999 112.488 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ARG . . . . . 0.586 ' HD3' ' CD1' ' A' ' 81' ' ' TRP . 0.0 OUTLIER -75.0 120.63 20.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.803 0.335 . . . . 10.289999999999999 110.92 -179.948 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -113.49 13.52 18.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 12.789999999999999 110.899 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' ASP . . . . . 0.445 ' OD2' ' HG3' ' A' ' 75' ' ' ARG . 0.0 OUTLIER -105.37 -12.53 15.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 9.8100000000000005 110.864 -179.938 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.31 -57.62 0.42 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.746 -0.74 . . . . 8.5 112.504 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' HIS . . . . . 0.611 ' O ' HG22 ' A' ' 72' ' ' THR . 1.5 m170 -61.88 177.82 0.4 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.832 0.349 . . . . 7.6500000000000004 110.862 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' LEU . . . . . 1.048 ' HG ' HG23 ' A' ' 72' ' ' THR . 2.6 mp -105.0 -173.14 2.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 6.7400000000000002 110.959 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 81' ' ' TRP . . . . . 0.586 ' CD1' ' HD3' ' A' ' 75' ' ' ARG . 53.0 p-90 -158.99 153.65 24.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.164 -0.471 . . . . 11.279999999999999 110.848 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' CYS . . . . . 0.421 ' HB2' ' HB3' ' A' ' 56' ' ' CYS . 6.4 p -140.3 142.84 35.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.195 -0.457 . . . . 9.4399999999999995 110.931 179.943 48.541 146.586 -52.017 103.837 2.03 103.826 -109.806 -21.507 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' SER . . . . . 0.566 ' HB3' ' CD2' ' A' ' 60' ' ' PHE . 24.6 p -61.2 130.77 47.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.132 -0.486 . . . . 12.02 110.875 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.883 ' O ' HG23 ' A' ' 85' ' ' THR . 2.4 p -95.53 30.15 2.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 12.619999999999999 111.129 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' THR . . . . . 0.883 HG23 ' O ' ' A' ' 84' ' ' THR . 1.4 p -172.88 131.93 0.53 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 14.199999999999999 111.17 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' SER . . . . . 0.42 ' C ' ' O ' ' A' ' 85' ' ' THR . 3.6 t -36.33 -52.57 0.82 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 15.94 110.797 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ASN . . . . . 0.546 ' HB2' ' CB ' ' A' ' 90' ' ' GLN . 0.8 OUTLIER -94.24 75.84 3.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 17.600000000000001 110.765 179.905 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 88' ' ' TYR . . . . . 0.525 ' O ' ' N ' ' A' ' 92' ' ' GLN . 18.0 t80 -45.09 -74.33 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.083 -0.508 . . . . 15.25 111.079 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -44.86 -24.69 0.23 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.24 -0.436 . . . . 18.0 111.275 -179.72 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 90' ' ' GLN . . . . . 0.546 ' CB ' ' HB2' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -69.38 -62.51 1.35 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.352 -0.385 . . . . 19.690000000000001 111.251 -179.837 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 91' ' ' ASP . . . . . 0.541 ' CB ' ' HG2' ' A' ' 93' ' ' LYS . 31.7 m-20 -95.87 3.6 53.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.336 -0.393 . . . . 16.57 111.354 -179.711 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' GLN . . . . . 0.525 ' N ' ' O ' ' A' ' 88' ' ' TYR . 0.6 OUTLIER 41.04 37.95 0.63 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.364 -0.38 . . . . 16.02 110.911 -179.973 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 93' ' ' LYS . . . . . 0.541 ' HG2' ' CB ' ' A' ' 91' ' ' ASP . 33.0 mmtt -97.0 152.09 19.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.284 -0.416 . . . . 14.83 110.868 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.477 ' CZ ' ' OD1' ' A' ' 50' ' ' ASN . 3.8 p90 -165.07 -178.01 4.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.269 -0.423 . . . . 11.84 111.07 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' SER . . . . . 0.444 ' O ' ' HA ' ' A' ' 81' ' ' TRP . 20.6 m -165.0 136.65 4.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.069 -0.514 . . . . 9.5299999999999994 110.832 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' PHE . . . . . 0.591 ' HB2' ' CE1' ' A' ' 47' ' ' TYR . 0.7 OUTLIER -74.84 146.38 42.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.317 -0.401 . . . . 9.7799999999999994 110.95 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 97' ' ' CYS . . . . . 0.551 ' HB3' ' CG2' ' A' ' 44' ' ' THR . 0.0 OUTLIER -124.09 177.23 5.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 6.21 110.891 -179.995 -18.597 -177.659 -93.274 103.798 2.029 103.844 -124.621 -66.711 3 3 . 1 . 001 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.44 ' O ' ' C ' ' A' ' 99' ' ' ASP . 0.2 OUTLIER -106.32 121.52 44.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 5.4900000000000002 111.122 179.903 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ASP . . . . . 0.661 ' O ' HG23 ' A' ' 102' ' ' VAL . 6.8 p-10 33.0 39.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.052 -0.522 . . . . 6.8099999999999996 111.014 -179.797 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' HIS . . . . . 1.154 ' CE1' HG22 ' A' ' 102' ' ' VAL . 32.7 p-80 33.54 43.96 0.06 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.62 -0.718 . . . . 6.4199999999999999 111.087 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' THR . . . . . 0.772 HG23 ' O ' ' A' ' 101' ' ' THR . 4.3 t 28.64 47.93 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.859 -0.61 . . . . 3.8700000000000001 111.672 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' VAL . . . . . 1.154 HG22 ' CE1' ' A' ' 100' ' ' HIS . 4.8 t -38.88 149.22 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.146 -0.479 . . . . 2.8300000000000001 111.296 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' LEU . . . . . 0.592 ' HB3' HD11 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -152.27 109.06 3.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.108 -0.496 . . . . 2.0 110.835 179.946 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 104' ' ' VAL . . . . . 0.889 HG21 ' CE2' ' A' ' 118' ' ' PHE . 14.6 t -101.84 132.81 47.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.431 . . . . 0.68000000000000005 110.848 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.63 81.56 2.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.178 -0.464 . . . . 2.6600000000000001 110.758 179.832 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' THR . . . . . 0.529 HG23 ' HB2' ' A' ' 116' ' ' CYS . 2.5 p -84.94 169.89 13.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.81999999999999995 111.334 -179.729 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 107' ' ' ARG . . . . . 0.458 ' HA ' ' HA2' ' A' ' 113' ' ' GLY . 11.5 ptt180 -165.09 129.31 2.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.976 -0.556 . . . . 3.8700000000000001 110.921 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' GLY . . . . . 0.538 ' HA3' ' CD2' ' A' ' 156' ' ' PHE . . . 115.04 173.29 17.71 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.74 -0.743 . . . . 2.0 112.493 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLY . . . . . 0.631 ' CA ' ' CZ ' ' A' ' 154' ' ' PHE . . . 82.5 -95.31 1.77 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.753 -0.737 . . . . 1.5800000000000001 112.492 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 30.3 m120 -148.24 16.52 1.05 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.849 0.357 . . . . 1.79 110.916 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' SER . . . . . 0.976 ' HB2' HG21 ' A' ' 144' ' ' THR . 5.1 p -113.72 -13.59 12.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 1.5900000000000001 110.854 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 43.3 m-20 44.31 89.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 1.6599999999999999 110.739 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLY . . . . . 0.466 ' HA2' ' O ' ' A' ' 106' ' ' THR . . . 41.89 73.09 0.23 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.707 -0.759 . . . . 0.63 112.305 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 114' ' ' ALA . . . . . 0.417 ' O ' ' OG1' ' A' ' 106' ' ' THR . . . -118.43 141.95 48.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.89 0.376 . . . . 0.42999999999999999 111.291 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 1.03 HD23 ' HB2' ' A' ' 17' ' ' GLN . 24.6 tp -64.89 84.31 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.11 -0.495 . . . . 1.47 110.549 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' CYS . . . . . 0.545 ' HB3' ' CG1' ' A' ' 104' ' ' VAL . 0.5 OUTLIER -42.41 131.82 3.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.21 -0.45 . . . . 0.57999999999999996 110.867 -179.805 -141.024 -162.461 151.048 103.779 2.03 103.89 74.372 45.788 3 3 . 1 . 001 nuclear build full ' A' A ' 117' ' ' HIS . . . . . . . . . . . . . 7.8 t-80 -98.18 135.16 40.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.936 -0.575 . . . . 1.03 110.819 179.985 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 118' ' ' PHE . . . . . 0.889 ' CE2' HG21 ' A' ' 104' ' ' VAL . 42.5 m-85 -129.23 135.46 27.63 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 0.79000000000000004 110.859 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' PRO . . . . . 0.835 ' HB3' HG23 ' A' ' 128' ' ' THR . 7.7 Cg_exo -73.93 178.08 34.96 Favored 'Cis proline' 0 N--CA 1.463 -0.282 0 C-N-CA 123.277 -1.551 . . . . 0.75 112.115 -0.037 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' PHE . . . . . 0.783 ' HZ ' HG22 ' A' ' 131' ' ' THR . 31.4 p90 -144.82 125.67 14.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 0.70999999999999996 110.583 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' LEU . . . . . 0.775 HD13 ' C ' ' A' ' 121' ' ' LEU . 2.5 tm? -75.67 132.72 40.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.069 0.461 . . . . 1.52 111.382 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' TYR . . . . . 0.712 ' N ' HD13 ' A' ' 121' ' ' LEU . 2.2 t80 -128.48 115.23 17.84 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.56 -0.745 . . . . 1.3999999999999999 109.838 179.042 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ASN . . . . . 0.542 ' HB2' ' CD1' ' A' ' 122' ' ' TYR . 1.7 t-20 53.9 56.38 7.2 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.814 -0.439 . . . . 2.0600000000000001 109.814 -179.045 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ASN . . . . . 0.767 ' H ' HD11 ' A' ' 121' ' ' LEU . 2.1 p-10 48.48 24.99 0.83 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.772 -0.649 . . . . 2.2799999999999998 110.64 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' HIS . . . . . 0.722 ' N ' HD21 ' A' ' 121' ' ' LEU . 5.3 t-160 -124.58 84.44 2.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.685 -0.689 . . . . 1.54 109.968 179.078 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 126' ' ' ASN . . . . . 0.582 ' N ' ' CD2' ' A' ' 121' ' ' LEU . 11.7 m-80 -34.88 142.67 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.108 -0.497 . . . . 1.6299999999999999 111.191 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 127' ' ' TYR . . . . . 0.475 ' HB2' ' O ' ' A' ' 120' ' ' PHE . 3.0 m-85 -140.57 156.98 46.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 1.0900000000000001 110.735 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 128' ' ' THR . . . . . 0.835 HG23 ' HB3' ' A' ' 119' ' ' PRO . 0.2 OUTLIER -148.91 60.06 1.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.271 -0.422 . . . . 1.3600000000000001 111.19 -179.97 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 129' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 131' ' ' THR . 1.1 p30 166.95 139.53 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.933 -0.576 . . . . 2.5 110.774 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 130' ' ' CYS . . . . . 0.473 ' HA ' ' O ' ' A' ' 141' ' ' TRP . 4.6 m -49.14 86.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.023 -0.535 . . . . 1.1599999999999999 110.897 -179.776 -41.363 -112.744 -86.108 103.82 2.03 103.715 -179.719 -79.969 2 2 . 1 . 001 nuclear build full ' A' A ' 131' ' ' THR . . . . . 0.783 HG22 ' HZ ' ' A' ' 120' ' ' PHE . 5.1 t -74.91 152.64 38.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.121 -0.491 . . . . 0.79000000000000004 111.09 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 2.7 m -109.75 53.83 0.68 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.17 -0.468 . . . . 1.77 110.899 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -86.09 113.89 22.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 2.3199999999999998 110.938 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 96.82 -7.96 65.43 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.722 -0.752 . . . . 2.04 112.516 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 24.6 mtp85 -111.84 140.76 46.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.873 0.368 . . . . 2.21 110.894 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 33.3 mtt180 -119.88 13.02 12.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 4.8300000000000001 110.902 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 137' ' ' ASP . . . . . 0.505 ' O ' ' N ' ' A' ' 139' ' ' MET . 0.3 OUTLIER -123.66 130.22 52.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.24 -0.436 . . . . 1.95 110.929 -179.994 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -41.07 91.16 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 2.8100000000000001 110.842 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 139' ' ' MET . . . . . 0.505 ' N ' ' O ' ' A' ' 137' ' ' ASP . 5.6 ttm -164.46 54.16 0.14 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 2.0600000000000001 110.914 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 140' ' ' LYS . . . . . 0.468 ' HB2' ' HB2' ' A' ' 130' ' ' CYS . 0.0 OUTLIER -36.36 142.6 0.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 2.5800000000000001 110.907 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 141' ' ' TRP . . . . . 0.514 ' CE3' ' HB2' ' A' ' 154' ' ' PHE . 51.8 p-90 -143.83 164.19 31.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.435 . . . . 0.78000000000000003 110.867 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 142' ' ' CYS . . . . . 0.551 ' SG ' ' CZ ' ' A' ' 118' ' ' PHE . 4.3 p -143.85 -179.59 6.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.277 -0.42 . . . . 0.68000000000000005 111.008 -179.9 45.788 74.372 151.048 103.89 2.03 103.779 -162.461 -141.024 2 2 . 1 . 001 nuclear build full ' A' A ' 143' ' ' GLY . . . . . 0.505 ' HA3' ' HB2' ' A' ' 148' ' ' TYR . . . -88.14 137.68 14.57 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.791 -0.718 . . . . 0.38 112.511 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 144' ' ' THR . . . . . 0.976 HG21 ' HB2' ' A' ' 111' ' ' SER . 10.3 p -75.09 0.15 17.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.712 0.291 . . . . 1.1799999999999999 111.194 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 6.4 p -149.69 174.29 12.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.296 -0.411 . . . . 0.71999999999999997 111.089 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 146' ' ' GLN . . . . . 0.515 ' HG3' ' ND2' ' A' ' 147' ' ' ASN . 1.8 pt20 -63.74 -11.12 23.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.266 -0.424 . . . . 2.4900000000000002 111.024 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 147' ' ' ASN . . . . . 0.573 ' CB ' ' HB3' ' A' ' 150' ' ' ALA . 72.3 m-20 -146.99 77.66 1.46 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 1.95 110.686 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 148' ' ' TYR . . . . . 0.574 ' CE1' ' HB3' ' A' ' 154' ' ' PHE . 2.8 t80 -50.76 -60.44 3.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.067 -0.515 . . . . 0.65000000000000002 111.083 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 149' ' ' ASP . . . . . 0.422 ' CB ' ' H ' ' A' ' 123' ' ' ASN . 21.8 t70 -57.59 -15.98 8.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.331 -0.395 . . . . 1.75 110.922 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 150' ' ' ALA . . . . . 0.573 ' HB3' ' CB ' ' A' ' 147' ' ' ASN . . . -85.5 -24.12 27.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.15 -0.477 . . . . 0.95999999999999996 110.934 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -114.43 -16.28 11.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.141 -0.481 . . . . 1.8400000000000001 110.945 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 152' ' ' GLN . . . . . 0.442 ' N ' ' O ' ' A' ' 148' ' ' TYR . 0.2 OUTLIER 62.78 48.71 4.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.14 -0.482 . . . . 1.8700000000000001 110.995 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 153' ' ' LYS . . . . . 0.507 ' HE2' ' CB ' ' A' ' 13' ' ' SER . 13.5 mtpp -142.71 113.63 7.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 2.1600000000000001 110.889 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 154' ' ' PHE . . . . . 0.631 ' CZ ' ' CA ' ' A' ' 109' ' ' GLY . 28.3 p90 -119.75 169.94 9.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.209 -0.45 . . . . 0.92000000000000004 110.915 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 155' ' ' GLY . . . . . 0.477 ' HA2' ' O ' ' A' ' 108' ' ' GLY . . . -156.53 148.21 17.78 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.76 -0.733 . . . . 0.41999999999999998 112.468 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 156' ' ' PHE . . . . . 0.538 ' CD2' ' HA3' ' A' ' 108' ' ' GLY . 34.8 m-85 -75.01 143.09 43.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.767 0.317 . . . . 1.02 110.737 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 157' ' ' CYS . . . . . 0.46 ' HB3' ' HD2' ' A' ' 158' ' ' PRO . 22.2 m -89.84 166.9 18.72 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 1.2 110.99 -179.83 -79.969 -179.719 -86.108 103.715 2.03 103.82 -112.744 -41.363 2 2 . 1 . 001 nuclear build full ' A' A ' 158' ' ' PRO . . . . . 0.46 ' HD2' ' HB3' ' A' ' 157' ' ' CYS . 50.4 Cg_exo -53.73 -176.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.707 2.271 . . . . 1.3899999999999999 112.34 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 159' ' ' MET . . . . . 0.518 ' CE ' ' O ' ' A' ' 159' ' ' MET . 0.0 OUTLIER -72.25 -27.42 62.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 4.4900000000000002 110.867 -179.981 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 160' ' ' ALA . . . . . 0.515 ' HB2' ' HE2' ' A' ' 159' ' ' MET . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.321 -0.847 . . . . 4.9500000000000002 111.172 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 161' ' ' NAG . . . . . 0.586 ' H82' ' O ' ' A' ' 124' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' TYR . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.486 1.36 0 CA-C-O 120.804 0.335 . . . . 6.37 111.213 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.525 ' O ' ' CG ' ' A' ' 3' ' ' HIS . . . 88.72 172.99 46.76 Favored Glycine 0 N--CA 1.45 -0.395 0 C-N-CA 120.807 -0.711 . . . . 2.3 112.506 -179.996 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . 0.632 ' CD2' ' CG2' ' A' ' 11' ' ' VAL . 1.4 p-80 54.61 160.09 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.305 0 CA-C-O 120.804 0.335 . . . . 2.83 110.884 -179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' CYS . . . . . 0.507 ' N ' ' SG ' ' A' ' 31' ' ' CYS . 5.2 m -141.72 135.51 29.88 Favored 'General case' 0 C--N 1.33 -0.267 0 CA-C-N 116.21 -0.45 . . . . 0.99 110.977 -179.811 -41.974 67.779 66.07 103.848 2.031 103.812 79.668 164.786 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.507 ' HA ' ' HA ' ' A' ' 11' ' ' VAL . 0.4 OUTLIER -91.97 134.25 30.84 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.278 0 CA-C-N 116.237 -0.438 . . . . 1.74 111.001 179.93 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' THR . . . . . 0.716 HG21 ' CZ2' ' A' ' 18' ' ' TRP . 11.5 t -148.52 -177.08 5.58 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.306 -0.406 . . . . 1.84 111.326 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ASP . . . . . . . . . . . . . 1.3 m-20 64.64 -91.52 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.277 0 CA-C-N 116.064 -0.516 . . . . 4.12 110.893 179.924 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -152.36 30.74 0.54 Allowed 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.233 -0.44 . . . . 4.51 110.721 179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLY . . . . . . . . . . . . . . . 127.16 6.58 5.28 Favored Glycine 0 N--CA 1.449 -0.475 0 C-N-CA 120.809 -0.71 . . . . 1.44 112.49 -179.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.667 HG11 ' OH ' ' A' ' 12' ' ' TYR . 0.5 OUTLIER -88.27 98.28 7.58 Favored 'Isoleucine or valine' 0 C--N 1.33 -0.265 0 CA-C-O 120.804 0.335 . . . . 1.64 111.045 -179.984 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' VAL . . . . . 0.632 ' CG2' ' CD2' ' A' ' 3' ' ' HIS . 1.1 p -91.22 126.11 43.92 Favored 'Isoleucine or valine' 0 C--N 1.327 -0.406 0 CA-C-N 116.067 -0.515 . . . . 1.07 110.967 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' TYR . . . . . 0.667 ' OH ' HG11 ' A' ' 10' ' ' VAL . 87.5 m-85 -116.14 112.7 22.08 Favored 'General case' 0 C--N 1.329 -0.312 0 CA-C-N 116.049 -0.523 . . . . 0.83 110.958 -179.862 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . 0.531 ' HA ' ' CB ' ' A' ' 3' ' ' HIS . 16.3 m -43.26 159.87 0.03 OUTLIER 'General case' 0 C--N 1.328 -0.338 0 CA-C-N 116.264 -0.425 . . . . 1.52 110.869 179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.479 ' HB ' ' HA ' ' A' ' 32' ' ' LEU . 2.5 m -50.47 173.91 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.326 -0.434 0 CA-C-N 115.941 -0.572 . . . . 1.41 111.266 -179.926 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . 0.525 ' N ' ' O ' ' A' ' 31' ' ' CYS . . . 39.81 28.2 0.13 Allowed Glycine 0 N--CA 1.45 -0.394 0 C-N-CA 120.508 -0.853 . . . . 0.74 111.962 -179.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' MET . . . . . 0.999 ' C ' HG23 ' A' ' 30' ' ' THR . 2.8 ttt -119.13 120.79 38.17 Favored 'General case' 0 C--N 1.33 -0.24 0 CA-C-O 120.842 0.353 . . . . 0.96 111.067 -179.765 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLN . . . . . 1.03 ' HB2' HD23 ' A' ' 115' ' ' LEU . 3.1 mt-30 -93.45 162.9 13.79 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.242 -0.435 . . . . 1.61 110.927 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.716 ' CZ2' HG21 ' A' ' 6' ' ' THR . 6.4 p90 -170.2 129.31 0.9 Allowed 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.165 -0.47 . . . . 0.63 110.863 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LEU . . . . . 0.664 HD23 HE21 ' A' ' 105' ' ' GLN . 3.3 tp -68.27 143.54 55.22 Favored 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.154 -0.475 . . . . 1.42 110.999 179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LYS . . . . . 0.454 ' HD2' ' SG ' ' A' ' 29' ' ' CYS . 0.0 OUTLIER -158.18 144.21 17.17 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 116.222 -0.445 . . . . 3.31 110.918 -179.96 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -75.03 119.96 19.91 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-N 116.192 -0.458 . . . . 2.34 111.146 -179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 5.7 tm0? -115.83 48.7 1.18 Allowed 'General case' 0 C--N 1.33 -0.276 0 CA-C-N 116.188 -0.46 . . . . 3.13 110.833 -179.985 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 124.31 -88.23 0.38 Allowed Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.758 -0.734 . . . . 1.92 112.535 179.959 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ASN . . . . . . . . . . . . . 1.2 t-20 -138.61 29.82 2.36 Favored 'General case' 0 C--N 1.329 -0.297 0 CA-C-O 120.803 0.335 . . . . 2.74 110.867 -179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -164.91 167.25 18.81 Favored 'General case' 0 C--N 1.329 -0.325 0 CA-C-N 116.237 -0.438 . . . . 3.07 110.916 179.948 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -84.05 146.93 27.67 Favored 'General case' 0 C--N 1.328 -0.327 0 CA-C-N 116.185 -0.461 . . . . 2.84 110.881 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' MET . . . . . . . . . . . . . 36.4 mtp -137.64 144.61 41.97 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.193 -0.458 . . . . 1.45 110.925 -179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.855 HD11 ' CD2' ' A' ' 115' ' ' LEU . 9.7 tp -92.26 97.46 10.9 Favored 'General case' 0 C--N 1.329 -0.316 0 CA-C-N 116.206 -0.452 . . . . 1.73 110.841 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.527 ' O ' ' CE3' ' A' ' 18' ' ' TRP . 0.0 OUTLIER -105.05 118.12 35.71 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.093 -0.503 . . . . 0.9 110.927 -179.995 -117.355 73.029 -120.365 103.791 2.03 103.788 70.564 -114.568 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.999 HG23 ' C ' ' A' ' 16' ' ' MET . 95.2 m -118.44 141.32 48.67 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.165 -0.471 . . . . 0.58 111.105 -179.929 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.525 ' O ' ' N ' ' A' ' 15' ' ' GLY . 5.3 t -90.21 140.63 29.49 Favored 'General case' 0 C--N 1.328 -0.344 0 CA-C-N 116.137 -0.483 . . . . 1.09 110.658 179.786 164.786 79.668 66.07 103.812 2.031 103.848 67.779 -41.974 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.479 ' HA ' ' HB ' ' A' ' 14' ' ' VAL . 1.7 mp -143.18 24.08 1.81 Allowed 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.243 -0.435 . . . . 1.62 110.97 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . 77.55 -51.93 3.42 Favored Glycine 0 N--CA 1.451 -0.33 0 C-N-CA 120.683 -0.77 . . . . 2.03 112.574 179.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' ASN . . . . . . . . . . . . . 2.6 t-20 -75.03 -10.54 59.57 Favored 'General case' 0 C--N 1.329 -0.306 0 CA-C-O 120.861 0.363 . . . . 4.45 110.971 -179.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 144.42 157.32 7.15 Favored Glycine 0 N--CA 1.45 -0.373 0 C-N-CA 120.802 -0.713 . . . . 1.38 112.537 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' VAL . . . . . 0.551 HG13 ' CH2' ' A' ' 18' ' ' TRP . 19.3 t -74.23 127.13 35.86 Favored 'Isoleucine or valine' 0 C--N 1.328 -0.335 0 CA-C-O 120.833 0.349 . . . . 0.85 111.113 -179.947 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' SER . . . . . . . . . . . . . 33.3 m -96.01 90.06 5.43 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.22 -0.446 . . . . 1.72 110.851 179.94 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' CYS . . . . . 0.478 ' HA ' ' O ' ' A' ' 28' ' ' LEU . 0.1 OUTLIER -82.31 139.61 34.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.239 -0.437 . . . . 1.08 110.948 -179.989 -114.568 70.564 -120.365 103.788 2.03 103.791 73.029 -117.355 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.446 ' O ' ' O ' ' A' ' 40' ' ' GLU . 3.3 tt0 -142.59 102.9 4.14 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.223 -0.444 . . . . 2.25 110.904 179.986 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.51 ' O ' ' N ' ' A' ' 42' ' ' ALA . 1.1 tt0 -36.33 158.2 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.295 0 CA-C-N 116.196 -0.456 . . . . 2.72 110.879 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' THR . . . . . . . . . . . . . 23.2 m -64.89 62.2 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 116.166 -0.47 . . . . 3.06 111.148 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.51 ' N ' ' O ' ' A' ' 40' ' ' GLU . . . -85.56 157.51 20.38 Favored 'General case' 0 C--N 1.33 -0.255 0 CA-C-N 116.172 -0.467 . . . . 3.24 111.126 179.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' VAL . . . . . 0.448 ' O ' ' O ' ' A' ' 42' ' ' ALA . 3.1 m -47.65 -178.35 0.0 OUTLIER 'Isoleucine or valine' 0 C--N 1.329 -0.309 0 CA-C-N 116.15 -0.477 . . . . 6.24 111.228 179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . 0.568 ' CG2' ' N ' ' A' ' 45' ' ' GLN . 1.6 m -95.74 165.51 12.27 Favored 'General case' 0 N--CA 1.453 -0.32 0 CA-C-N 116.19 -0.459 . . . . 5.65 110.802 179.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . 0.568 ' N ' ' CG2' ' A' ' 44' ' ' THR . 1.9 tt0 -63.11 68.63 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.289 0 CA-C-N 116.317 -0.401 . . . . 8.29 110.867 179.979 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' THR . . . . . 0.518 ' N ' ' O ' ' A' ' 44' ' ' THR . 6.0 p -50.11 167.69 0.05 Allowed 'General case' 0 C--N 1.331 -0.231 0 CA-C-N 116.118 -0.492 . . . . 7.96 111.248 -179.99 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' TYR . . . . . 0.606 ' HH ' ' CG ' ' A' ' 79' ' ' HIS . 15.2 p90 -175.7 149.45 0.97 Allowed 'General case' 0 C--N 1.329 -0.297 0 CA-C-N 116.159 -0.473 . . . . 8.62 110.833 179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 57.98 -164.64 7.56 Favored Glycine 0 N--CA 1.451 -0.325 0 C-N-CA 120.724 -0.75 . . . . 9.78 112.542 179.996 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLY . . . . . 0.58 ' HA2' ' CZ ' ' A' ' 96' ' ' PHE . . . 88.81 -176.35 44.23 Favored Glycine 0 N--CA 1.452 -0.286 0 C-N-CA 120.74 -0.743 . . . . 11.52 112.598 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ASN . . . . . 0.627 ' ND2' ' CZ ' ' A' ' 94' ' ' TYR . 4.1 m-20 -89.68 32.82 0.86 Allowed 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.714 0.292 . . . . 12.93 110.812 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' SER . . . . . 0.623 ' CB ' HG21 ' A' ' 84' ' ' THR . 3.3 t -142.27 12.11 1.96 Allowed 'General case' 0 C--N 1.328 -0.356 0 CA-C-N 116.339 -0.391 . . . . 11.71 110.875 179.96 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.458 ' HB3' ' O ' ' A' ' 51' ' ' SER . 28.1 t-20 67.41 31.43 6.38 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.248 -0.433 . . . . 12.89 110.929 179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLY . . . . . 0.479 ' HA3' ' HA ' ' A' ' 47' ' ' TYR . . . 60.17 15.53 37.5 Favored Glycine 0 N--CA 1.451 -0.336 0 C-N-CA 120.781 -0.723 . . . . 10.42 112.463 179.946 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLU . . . . . 0.61 ' CB ' ' CD ' ' A' ' 55' ' ' PRO . 0.5 OUTLIER -61.96 -174.39 0.08 OUTLIER Pre-proline 0 C--N 1.329 -0.289 0 CA-C-O 120.942 0.401 . . . . 12.73 110.876 179.994 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PRO . . . . . 0.61 ' CD ' ' CB ' ' A' ' 54' ' ' GLU . 10.3 Cg_exo -72.21 158.23 52.29 Favored 'Trans proline' 0 N--CA 1.463 -0.283 0 C-N-CA 123.208 2.605 . . . . 10.55 112.256 -179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' CYS . . . . . 0.421 ' HB3' ' HB2' ' A' ' 82' ' ' CYS . 0.0 OUTLIER -85.84 -173.94 4.86 Favored 'General case' 0 C--N 1.329 -0.302 0 CA-C-N 116.237 -0.438 . . . . 10.44 110.948 -179.98 -21.507 -109.806 -52.017 103.826 2.03 103.837 146.586 48.541 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.566 HG23 ' C ' ' A' ' 84' ' ' THR . 1.9 t -154.5 66.99 0.03 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.353 0 CA-C-N 116.129 -0.487 . . . . 12.89 111.143 -179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' LEU . . . . . 0.646 HD23 ' CD1' ' A' ' 60' ' ' PHE . 0.0 OUTLIER -96.26 178.46 1.4 Allowed Pre-proline 0 C--N 1.329 -0.304 0 CA-C-N 116.155 -0.475 . . . . 12.01 110.795 179.988 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' PRO . . . . . 0.588 ' HA ' ' CB ' ' A' ' 58' ' ' LEU . 36.2 Cg_exo -60.21 144.41 36.37 Favored 'Cis proline' 0 C--N 1.343 0.239 0 C-N-CA 123.196 -1.585 . . . . 13.21 112.353 0.001 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' PHE . . . . . 0.646 ' CD1' HD23 ' A' ' 58' ' ' LEU . 7.5 p90 -137.43 116.34 12.35 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.164 -0.471 . . . . 12.87 110.878 179.944 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' THR . . . . . 0.77 HG22 ' HA ' ' A' ' 66' ' ' THR . 4.7 p -80.32 153.16 28.58 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.223 -0.444 . . . . 15.6 111.14 -179.988 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' TYR . . . . . 0.582 ' HB3' ' CE1' ' A' ' 67' ' ' PHE . 6.0 t80 -162.2 128.47 3.6 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.923 0.392 . . . . 14.58 111.038 179.818 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ASN . . . . . 0.472 ' ND2' ' O ' ' A' ' 62' ' ' TYR . 0.3 OUTLIER 76.28 -11.32 1.17 Allowed 'General case' 0 CA--C 1.531 0.244 0 CA-C-N 116.044 -0.525 . . . . 17.12 111.755 179.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . 126.56 -0.67 7.44 Favored Glycine 0 N--CA 1.45 -0.431 0 C-N-CA 120.642 -0.789 . . . . 17.27 111.955 -179.677 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ARG . . . . . 0.631 ' HG3' ' CE1' ' A' ' 67' ' ' PHE . 0.0 OUTLIER -116.48 151.3 36.37 Favored 'General case' 0 C--N 1.33 -0.274 0 CA-C-O 120.76 0.314 . . . . 15.75 110.476 179.995 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' THR . . . . . 0.77 ' HA ' HG22 ' A' ' 61' ' ' THR . 6.7 m -99.34 106.39 18.48 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.347 -0.388 . . . . 15.66 111.154 179.951 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' PHE . . . . . 0.631 ' CE1' ' HG3' ' A' ' 65' ' ' ARG . 6.5 m-85 -94.3 127.61 40.27 Favored 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.182 -0.463 . . . . 12.59 110.85 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' TYR . . . . . 0.606 ' O ' HD13 ' A' ' 58' ' ' LEU . 9.6 m-85 -88.19 -23.52 23.57 Favored 'General case' 0 C--N 1.329 -0.317 0 CA-C-N 116.131 -0.486 . . . . 14.33 110.859 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' SER . . . . . 0.457 ' CA ' HD22 ' A' ' 58' ' ' LEU . 1.4 m -134.85 -162.63 1.28 Allowed 'General case' 0 C--N 1.329 -0.283 0 CA-C-N 116.136 -0.484 . . . . 8.8 110.812 -179.959 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' CYS . . . . . . . . . . . . . 90.3 m -66.05 154.95 38.15 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.221 -0.445 . . . . 7.24 110.988 179.91 -66.711 -124.621 -93.274 103.844 2.029 103.798 -177.659 -18.597 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.784 ' CA ' HD23 ' A' ' 80' ' ' LEU . 4.9 t -156.67 147.09 21.42 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.262 -0.426 . . . . 9.26 111.133 -179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' THR . . . . . 1.048 HG23 ' HG ' ' A' ' 80' ' ' LEU . 1.2 p -84.74 9.43 14.06 Favored 'General case' 0 C--N 1.329 -0.324 0 CA-C-N 116.203 -0.453 . . . . 9.61 111.148 179.942 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' GLU . . . . . 0.559 ' HG3' ' CZ ' ' A' ' 67' ' ' PHE . 20.1 mm-40 -47.48 113.4 0.69 Allowed 'General case' 0 C--N 1.329 -0.301 0 CA-C-N 116.291 -0.413 . . . . 11.99 110.899 179.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' GLY . . . . . . . . . . . . . . . 78.08 -5.4 54.46 Favored Glycine 0 N--CA 1.45 -0.425 0 C-N-CA 120.754 -0.736 . . . . 11.37 112.488 -179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ARG . . . . . 0.586 ' HD3' ' CD1' ' A' ' 81' ' ' TRP . 0.0 OUTLIER -75.0 120.63 20.8 Favored 'General case' 0 C--N 1.329 -0.309 0 CA-C-O 120.803 0.335 . . . . 10.29 110.92 -179.948 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLN . . . . . . . . . . . . . 15.8 mm100 -113.49 13.52 18.87 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-N 116.197 -0.456 . . . . 12.79 110.899 -179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' ASP . . . . . 0.445 ' OD2' ' HG3' ' A' ' 75' ' ' ARG . 0.0 OUTLIER -105.37 -12.53 15.99 Favored 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.241 -0.436 . . . . 9.81 110.864 -179.938 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLY . . . . . . . . . . . . . . . 110.31 -57.62 0.42 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.746 -0.74 . . . . 8.5 112.504 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' HIS . . . . . 0.611 ' O ' HG22 ' A' ' 72' ' ' THR . 1.5 m170 -61.88 177.82 0.4 Allowed 'General case' 0 C--N 1.329 -0.317 0 CA-C-O 120.832 0.349 . . . . 7.65 110.862 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' LEU . . . . . 1.048 ' HG ' HG23 ' A' ' 72' ' ' THR . 2.6 mp -105.0 -173.14 2.23 Favored 'General case' 0 C--N 1.33 -0.28 0 CA-C-N 116.194 -0.457 . . . . 6.74 110.959 179.999 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' TRP . . . . . 0.586 ' CD1' ' HD3' ' A' ' 75' ' ' ARG . 53.0 p-90 -158.99 153.65 24.52 Favored 'General case' 0 C--N 1.327 -0.375 0 CA-C-N 116.164 -0.471 . . . . 11.28 110.848 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' CYS . . . . . 0.421 ' HB2' ' HB3' ' A' ' 56' ' ' CYS . 6.4 p -140.3 142.84 35.64 Favored 'General case' 0 C--N 1.328 -0.332 0 CA-C-N 116.195 -0.457 . . . . 9.44 110.931 179.943 48.541 146.586 -52.017 103.837 2.03 103.826 -109.806 -21.507 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' SER . . . . . 0.566 ' HB3' ' CD2' ' A' ' 60' ' ' PHE . 24.6 p -61.2 130.77 47.92 Favored 'General case' 0 C--N 1.329 -0.284 0 CA-C-N 116.132 -0.486 . . . . 12.02 110.875 179.993 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.883 ' O ' HG23 ' A' ' 85' ' ' THR . 2.4 p -95.53 30.15 2.37 Favored 'General case' 0 C--N 1.329 -0.298 0 CA-C-N 116.15 -0.477 . . . . 12.62 111.129 -179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' THR . . . . . 0.883 HG23 ' O ' ' A' ' 84' ' ' THR . 1.4 p -172.88 131.93 0.53 Allowed 'General case' 0 C--N 1.329 -0.305 0 CA-C-N 116.164 -0.471 . . . . 14.2 111.17 179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' SER . . . . . 0.42 ' C ' ' O ' ' A' ' 85' ' ' THR . 3.6 t -36.33 -52.57 0.82 Allowed 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.221 -0.445 . . . . 15.94 110.797 -179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ASN . . . . . 0.546 ' HB2' ' CB ' ' A' ' 90' ' ' GLN . 0.8 OUTLIER -94.24 75.84 3.98 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.218 -0.446 . . . . 17.6 110.765 179.905 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' TYR . . . . . 0.525 ' O ' ' N ' ' A' ' 92' ' ' GLN . 18.0 t80 -45.09 -74.33 0.04 OUTLIER 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.083 -0.508 . . . . 15.25 111.079 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' GLU . . . . . . . . . . . . . 10.7 mt-10 -44.86 -24.69 0.23 Allowed 'General case' 0 C--N 1.328 -0.346 0 CA-C-N 116.24 -0.436 . . . . 18.0 111.275 -179.72 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' GLN . . . . . 0.546 ' CB ' ' HB2' ' A' ' 87' ' ' ASN . 0.0 OUTLIER -69.38 -62.51 1.35 Allowed 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.352 -0.385 . . . . 19.69 111.251 -179.837 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' ASP . . . . . 0.541 ' CB ' ' HG2' ' A' ' 93' ' ' LYS . 31.7 m-20 -95.87 3.6 53.5 Favored 'General case' 0 C--N 1.33 -0.256 0 CA-C-N 116.336 -0.393 . . . . 16.57 111.354 -179.711 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' GLN . . . . . 0.525 ' N ' ' O ' ' A' ' 88' ' ' TYR . 0.6 OUTLIER 41.04 37.95 0.63 Allowed 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.364 -0.38 . . . . 16.02 110.911 -179.973 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' LYS . . . . . 0.541 ' HG2' ' CB ' ' A' ' 91' ' ' ASP . 33.0 mmtt -97.0 152.09 19.07 Favored 'General case' 0 C--N 1.329 -0.319 0 CA-C-N 116.284 -0.416 . . . . 14.83 110.868 179.896 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.627 ' CZ ' ' ND2' ' A' ' 50' ' ' ASN . 3.8 p90 -165.07 -178.01 4.91 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.269 -0.423 . . . . 11.84 111.07 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' SER . . . . . 0.444 ' O ' ' HA ' ' A' ' 81' ' ' TRP . 20.6 m -165.0 136.65 4.2 Favored 'General case' 0 C--N 1.329 -0.311 0 CA-C-N 116.069 -0.514 . . . . 9.53 110.832 179.889 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' PHE . . . . . 0.591 ' HB2' ' CE1' ' A' ' 47' ' ' TYR . 0.7 OUTLIER -74.84 146.38 42.03 Favored 'General case' 0 C--N 1.33 -0.281 0 CA-C-N 116.317 -0.401 . . . . 9.78 110.95 -179.915 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' CYS . . . . . 0.551 ' HB3' ' CG2' ' A' ' 44' ' ' THR . 0.0 OUTLIER -124.09 177.23 5.91 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.192 -0.458 . . . . 6.21 110.891 -179.995 -18.597 -177.659 -93.274 103.798 2.029 103.844 -124.621 -66.711 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.44 ' O ' ' C ' ' A' ' 99' ' ' ASP . 0.2 OUTLIER -106.32 121.52 44.39 Favored 'General case' 0 C--N 1.329 -0.323 0 CA-C-N 116.236 -0.438 . . . . 5.49 111.122 179.903 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ASP . . . . . 0.661 ' O ' HG23 ' A' ' 102' ' ' VAL . 6.8 p-10 33.0 39.34 0.02 OUTLIER 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 116.052 -0.522 . . . . 6.81 111.014 -179.797 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' HIS . . . . . 1.007 ' CE1' HG22 ' A' ' 102' ' ' VAL . 7.0 p80 33.54 43.96 0.06 Allowed 'General case' 0 C--N 1.328 -0.352 0 CA-C-N 115.62 -0.718 . . . . 6.42 111.087 179.982 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' THR . . . . . 0.772 ' O ' HG23 ' A' ' 101' ' ' THR . 4.3 t 28.64 47.93 0.03 OUTLIER 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 115.859 -0.61 . . . . 3.87 111.672 179.81 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' VAL . . . . . 1.007 HG22 ' CE1' ' A' ' 100' ' ' HIS . 4.8 t -38.88 149.22 0.06 OUTLIER 'Isoleucine or valine' 0 C--N 1.328 -0.354 0 CA-C-N 116.146 -0.479 . . . . 2.83 111.296 -179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' LEU . . . . . 0.592 ' HB3' HD11 ' A' ' 115' ' ' LEU . 0.2 OUTLIER -152.27 109.06 3.48 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 116.108 -0.496 . . . . 2.0 110.835 179.946 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' VAL . . . . . 0.889 HG21 ' CE2' ' A' ' 118' ' ' PHE . 14.6 t -101.84 132.81 47.01 Favored 'Isoleucine or valine' 0 C--N 1.329 -0.308 0 CA-C-N 116.251 -0.431 . . . . 0.68 110.848 179.91 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' GLN . . . . . 0.664 HE21 HD23 ' A' ' 19' ' ' LEU . 0.2 OUTLIER -101.63 81.56 2.18 Favored 'General case' 0 C--N 1.33 -0.25 0 CA-C-N 116.178 -0.464 . . . . 2.66 110.758 179.832 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' THR . . . . . 0.529 HG23 ' HB2' ' A' ' 116' ' ' CYS . 2.5 p -84.94 169.89 13.6 Favored 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.153 -0.476 . . . . 0.82 111.334 -179.729 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' ARG . . . . . 0.458 ' HA ' ' HA2' ' A' ' 113' ' ' GLY . 11.5 ptt180 -165.09 129.31 2.43 Favored 'General case' 0 C--N 1.329 -0.304 0 CA-C-N 115.976 -0.556 . . . . 3.87 110.921 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' GLY . . . . . 0.538 ' HA3' ' CD2' ' A' ' 156' ' ' PHE . . . 115.04 173.29 17.71 Favored Glycine 0 N--CA 1.451 -0.31 0 C-N-CA 120.74 -0.743 . . . . 2.0 112.493 -179.995 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLY . . . . . 0.631 ' CA ' ' CZ ' ' A' ' 154' ' ' PHE . . . 82.5 -95.31 1.77 Allowed Glycine 0 N--CA 1.451 -0.332 0 C-N-CA 120.753 -0.737 . . . . 1.58 112.492 179.969 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ASN . . . . . . . . . . . . . 73.1 m-80 -148.24 16.52 1.05 Allowed 'General case' 0 C--N 1.328 -0.33 0 CA-C-O 120.849 0.357 . . . . 1.79 110.916 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' SER . . . . . 0.976 ' HB2' HG21 ' A' ' 144' ' ' THR . 5.1 p -113.72 -13.59 12.65 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.175 -0.466 . . . . 1.59 110.854 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' ASN . . . . . . . . . . . . . 43.3 m-20 44.31 89.32 0.01 OUTLIER 'General case' 0 C--N 1.329 -0.318 0 CA-C-N 116.216 -0.447 . . . . 1.66 110.739 -179.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLY . . . . . 0.466 ' HA2' ' O ' ' A' ' 106' ' ' THR . . . 41.89 73.09 0.23 Allowed Glycine 0 N--CA 1.451 -0.347 0 C-N-CA 120.707 -0.759 . . . . 0.63 112.305 -179.836 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' ALA . . . . . 0.417 ' O ' ' OG1' ' A' ' 106' ' ' THR . . . -118.43 141.95 48.05 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-O 120.89 0.376 . . . . 0.43 111.291 -179.767 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 1.03 HD23 ' HB2' ' A' ' 17' ' ' GLN . 24.6 tp -64.89 84.31 0.04 OUTLIER 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.11 -0.495 . . . . 1.47 110.549 179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' CYS . . . . . 0.545 ' HB3' ' CG1' ' A' ' 104' ' ' VAL . 0.5 OUTLIER -42.41 131.82 3.64 Favored 'General case' 0 C--N 1.33 -0.275 0 CA-C-N 116.21 -0.45 . . . . 0.58 110.867 -179.805 -141.024 -162.461 151.048 103.779 2.03 103.89 74.372 45.788 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' HIS . . . . . 0.488 ' CD2' ' O ' ' A' ' 119' ' ' PRO . 33.0 t60 -98.18 135.16 40.23 Favored 'General case' 0 C--N 1.329 -0.303 0 CA-C-N 115.936 -0.575 . . . . 1.03 110.819 179.985 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' PHE . . . . . 0.889 ' CE2' HG21 ' A' ' 104' ' ' VAL . 42.5 m-85 -129.23 135.46 27.63 Favored Pre-proline 0 C--N 1.328 -0.329 0 CA-C-N 116.167 -0.469 . . . . 0.79 110.859 -179.971 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' PRO . . . . . 0.835 ' HB3' HG23 ' A' ' 128' ' ' THR . 7.7 Cg_exo -73.93 178.08 34.96 Favored 'Cis proline' 0 N--CA 1.463 -0.282 0 C-N-CA 123.277 -1.551 . . . . 0.75 112.115 -0.037 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' PHE . . . . . 0.783 ' HZ ' HG22 ' A' ' 131' ' ' THR . 31.4 p90 -144.82 125.67 14.35 Favored 'General case' 0 C--N 1.329 -0.291 0 CA-C-N 116.155 -0.475 . . . . 0.71 110.583 179.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' LEU . . . . . 0.775 ' C ' HD13 ' A' ' 121' ' ' LEU . 2.5 tm? -75.67 132.72 40.75 Favored 'General case' 0 C--N 1.328 -0.354 0 CA-C-O 121.069 0.461 . . . . 1.52 111.382 -179.512 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' TYR . . . . . 0.712 ' N ' HD13 ' A' ' 121' ' ' LEU . 2.2 t80 -128.48 115.23 17.84 Favored 'General case' 0 C--N 1.327 -0.391 0 CA-C-N 115.56 -0.745 . . . . 1.4 109.838 179.042 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ASN . . . . . 0.542 ' HB2' ' CD1' ' A' ' 122' ' ' TYR . 1.7 t-20 53.9 56.38 7.2 Favored 'General case' 0 C--N 1.327 -0.375 0 N-CA-C 109.814 -0.439 . . . . 2.06 109.814 -179.045 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ASN . . . . . 0.767 ' H ' HD11 ' A' ' 121' ' ' LEU . 10.5 p30 48.48 24.99 0.83 Allowed 'General case' 0 C--N 1.331 -0.237 0 CA-C-N 115.772 -0.649 . . . . 2.28 110.64 -179.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' HIS . . . . . 0.722 ' N ' HD21 ' A' ' 121' ' ' LEU . 5.3 t-160 -124.58 84.44 2.28 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-N 115.685 -0.689 . . . . 1.54 109.968 179.078 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 126' ' ' ASN . . . . . 0.582 ' N ' ' CD2' ' A' ' 121' ' ' LEU . 11.7 m-80 -34.88 142.67 0.05 OUTLIER 'General case' 0 C--N 1.33 -0.269 0 CA-C-N 116.108 -0.497 . . . . 1.63 111.191 -179.263 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 127' ' ' TYR . . . . . 0.475 ' HB2' ' O ' ' A' ' 120' ' ' PHE . 3.0 m-85 -140.57 156.98 46.13 Favored 'General case' 0 C--N 1.329 -0.299 0 CA-C-N 116.198 -0.455 . . . . 1.09 110.735 179.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 128' ' ' THR . . . . . 0.835 HG23 ' HB3' ' A' ' 119' ' ' PRO . 0.2 OUTLIER -148.91 60.06 1.06 Allowed 'General case' 0 C--N 1.328 -0.334 0 CA-C-N 116.271 -0.422 . . . . 1.36 111.19 -179.97 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 129' ' ' ASP . . . . . 0.52 ' O ' ' N ' ' A' ' 131' ' ' THR . 1.1 p30 166.95 139.53 0.02 OUTLIER 'General case' 0 C--N 1.327 -0.379 0 CA-C-N 115.933 -0.576 . . . . 2.5 110.774 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 130' ' ' CYS . . . . . 0.473 ' HA ' ' O ' ' A' ' 141' ' ' TRP . 4.6 m -49.14 86.41 0.0 OUTLIER 'General case' 0 C--N 1.328 -0.349 0 CA-C-N 116.023 -0.535 . . . . 1.16 110.897 -179.776 -41.363 -112.744 -86.108 103.82 2.03 103.715 -179.719 -79.969 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 131' ' ' THR . . . . . 0.783 HG22 ' HZ ' ' A' ' 120' ' ' PHE . 5.1 t -74.91 152.64 38.84 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.121 -0.491 . . . . 0.79 111.09 -179.931 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 132' ' ' SER . . . . . . . . . . . . . 2.7 m -109.75 53.83 0.68 Allowed 'General case' 0 C--N 1.33 -0.261 0 CA-C-N 116.17 -0.468 . . . . 1.77 110.899 179.967 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 133' ' ' GLU . . . . . . . . . . . . . 4.6 mm-40 -86.09 113.89 22.51 Favored 'General case' 0 C--N 1.328 -0.328 0 CA-C-N 116.194 -0.457 . . . . 2.32 110.938 179.986 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 134' ' ' GLY . . . . . . . . . . . . . . . 96.82 -7.96 65.43 Favored Glycine 0 N--CA 1.451 -0.315 0 C-N-CA 120.722 -0.752 . . . . 2.04 112.516 -179.966 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 135' ' ' ARG . . . . . . . . . . . . . 24.6 mtp85 -111.84 140.76 46.23 Favored 'General case' 0 C--N 1.328 -0.348 0 CA-C-O 120.873 0.368 . . . . 2.21 110.894 -179.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 136' ' ' ARG . . . . . . . . . . . . . 33.3 mtt180 -119.88 13.02 12.21 Favored 'General case' 0 C--N 1.33 -0.273 0 CA-C-N 116.204 -0.453 . . . . 4.83 110.902 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 137' ' ' ASP . . . . . 0.505 ' O ' ' N ' ' A' ' 139' ' ' MET . 0.3 OUTLIER -123.66 130.22 52.31 Favored 'General case' 0 C--N 1.328 -0.337 0 CA-C-N 116.24 -0.436 . . . . 1.95 110.929 -179.994 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 138' ' ' ASN . . . . . . . . . . . . . 3.6 m-20 -41.07 91.16 0.0 OUTLIER 'General case' 0 C--N 1.329 -0.3 0 CA-C-N 116.157 -0.474 . . . . 2.81 110.842 -179.962 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 139' ' ' MET . . . . . 0.505 ' N ' ' O ' ' A' ' 137' ' ' ASP . 5.6 ttm -164.46 54.16 0.14 Allowed 'General case' 0 C--N 1.329 -0.293 0 CA-C-N 116.188 -0.46 . . . . 2.06 110.914 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 140' ' ' LYS . . . . . 0.468 ' HB2' ' HB2' ' A' ' 130' ' ' CYS . 0.0 OUTLIER -36.36 142.6 0.08 Allowed 'General case' 0 C--N 1.33 -0.271 0 CA-C-N 116.211 -0.449 . . . . 2.58 110.907 179.996 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 141' ' ' TRP . . . . . 0.514 ' CE3' ' HB2' ' A' ' 154' ' ' PHE . 51.8 p-90 -143.83 164.19 31.22 Favored 'General case' 0 C--N 1.328 -0.329 0 CA-C-N 116.244 -0.435 . . . . 0.78 110.867 -179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 142' ' ' CYS . . . . . 0.551 ' SG ' ' CZ ' ' A' ' 118' ' ' PHE . 4.3 p -143.85 -179.59 6.56 Favored 'General case' 0 C--N 1.329 -0.287 0 CA-C-N 116.277 -0.42 . . . . 0.68 111.008 -179.9 45.788 74.372 151.048 103.89 2.03 103.779 -162.461 -141.024 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 143' ' ' GLY . . . . . 0.505 ' HA3' ' HB2' ' A' ' 148' ' ' TYR . . . -88.14 137.68 14.57 Favored Glycine 0 N--CA 1.45 -0.426 0 C-N-CA 120.791 -0.718 . . . . 0.38 112.511 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 144' ' ' THR . . . . . 0.976 HG21 ' HB2' ' A' ' 111' ' ' SER . 10.3 p -75.09 0.15 17.09 Favored 'General case' 0 C--N 1.329 -0.32 0 CA-C-O 120.712 0.291 . . . . 1.18 111.194 179.966 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 145' ' ' THR . . . . . . . . . . . . . 6.4 p -149.69 174.29 12.75 Favored 'General case' 0 C--N 1.33 -0.268 0 CA-C-N 116.296 -0.411 . . . . 0.72 111.089 179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 146' ' ' GLN . . . . . 0.515 ' HG3' ' ND2' ' A' ' 147' ' ' ASN . 1.8 pt20 -63.74 -11.12 23.59 Favored 'General case' 0 C--N 1.328 -0.343 0 CA-C-N 116.266 -0.424 . . . . 2.49 111.024 -179.992 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 147' ' ' ASN . . . . . 0.573 ' CB ' ' HB3' ' A' ' 150' ' ' ALA . 72.3 m-20 -146.99 77.66 1.46 Allowed 'General case' 0 C--N 1.329 -0.308 0 CA-C-N 116.183 -0.462 . . . . 1.95 110.686 179.998 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 148' ' ' TYR . . . . . 0.574 ' CE1' ' HB3' ' A' ' 154' ' ' PHE . 2.8 t80 -50.76 -60.44 3.06 Favored 'General case' 0 C--N 1.328 -0.362 0 CA-C-N 116.067 -0.515 . . . . 0.65 111.083 -179.803 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 149' ' ' ASP . . . . . 0.422 ' CB ' ' H ' ' A' ' 123' ' ' ASN . 21.8 t70 -57.59 -15.98 8.94 Favored 'General case' 0 C--N 1.328 -0.336 0 CA-C-N 116.331 -0.395 . . . . 1.75 110.922 -179.831 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 150' ' ' ALA . . . . . 0.573 ' HB3' ' CB ' ' A' ' 147' ' ' ASN . . . -85.5 -24.12 27.47 Favored 'General case' 0 C--N 1.328 -0.33 0 CA-C-N 116.15 -0.477 . . . . 0.96 110.934 179.962 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 151' ' ' ASP . . . . . . . . . . . . . 0.3 OUTLIER -114.43 -16.28 11.96 Favored 'General case' 0 C--N 1.329 -0.296 0 CA-C-N 116.141 -0.481 . . . . 1.84 110.945 -179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 152' ' ' GLN . . . . . 0.442 ' N ' ' O ' ' A' ' 148' ' ' TYR . 0.2 OUTLIER 62.78 48.71 4.01 Favored 'General case' 0 C--N 1.329 -0.314 0 CA-C-N 116.14 -0.482 . . . . 1.87 110.995 -179.917 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 153' ' ' LYS . . . . . 0.507 ' HE2' ' CB ' ' A' ' 13' ' ' SER . 13.5 mtpp -142.71 113.63 7.57 Favored 'General case' 0 C--N 1.329 -0.29 0 CA-C-N 116.219 -0.446 . . . . 2.16 110.889 -179.954 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 154' ' ' PHE . . . . . 0.631 ' CZ ' ' CA ' ' A' ' 109' ' ' GLY . 28.3 p90 -119.75 169.94 9.67 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 116.209 -0.45 . . . . 0.92 110.915 179.895 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 155' ' ' GLY . . . . . 0.477 ' HA2' ' O ' ' A' ' 108' ' ' GLY . . . -156.53 148.21 17.78 Favored Glycine 0 N--CA 1.451 -0.321 0 C-N-CA 120.76 -0.733 . . . . 0.42 112.468 179.991 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 156' ' ' PHE . . . . . 0.538 ' CD2' ' HA3' ' A' ' 108' ' ' GLY . 34.8 m-85 -75.01 143.09 43.73 Favored 'General case' 0 C--N 1.329 -0.31 0 CA-C-O 120.767 0.317 . . . . 1.02 110.737 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 157' ' ' CYS . . . . . 0.46 ' HB3' ' HD2' ' A' ' 158' ' ' PRO . 22.2 m -89.84 166.9 18.72 Favored Pre-proline 0 C--N 1.328 -0.328 0 CA-C-N 116.232 -0.44 . . . . 1.2 110.99 -179.83 -79.969 -179.719 -86.108 103.715 2.03 103.82 -112.744 -41.363 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 158' ' ' PRO . . . . . 0.46 ' HD2' ' HB3' ' A' ' 157' ' ' CYS . 50.4 Cg_exo -53.73 -176.27 0.03 OUTLIER 'Trans proline' 0 C--N 1.341 0.151 0 C-N-CA 122.707 2.271 . . . . 1.39 112.34 179.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 159' ' ' MET . . . . . 0.518 ' CE ' ' O ' ' A' ' 159' ' ' MET . 0.0 OUTLIER -72.25 -27.42 62.5 Favored 'General case' 0 C--N 1.329 -0.307 0 CA-C-N 116.224 -0.444 . . . . 4.49 110.867 -179.981 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 160' ' ' ALA . . . . . 0.515 ' HB2' ' HE2' ' A' ' 159' ' ' MET . . . . . . . . 0 C--O 1.249 1.07 0 CA-C-O 118.321 -0.847 . . . . 4.95 111.172 179.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 161' ' ' NAG . . . . . 0.586 ' H82' ' O ' ' A' ' 124' ' ' ASN . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 1 1 . 1 stop_ save_